data_5u6h_residue save_MolProbity _Software.Sf_category software _Software.Sf_framecode MolProbity _Software.Entry_ID ? _Software.ID 1 _Software.Name MolProbity _Software.Version 4.0 _Software.Details . save_ save_CYRANGE _Software.Sf_category software _Software.Sf_framecode CYRANGE _Software.Entry_ID ? _Software.ID 2 _Software.Name CYRANGE _Software.Version 2.0 _Software.Details . save_ save_Structure_validation_residue _Structure_validation_residue.Sf_category structure_validation _Structure_validation_residue.Sf_framecode Structure_validation_residue _Structure_validation_residue.Entry_ID ? _Structure_validation_residue.List_ID 1 _Structure_validation_residue.PDB_accession_code 5u6h _Structure_validation_residue.Date_analyzed 2017-07-28 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 ' 13' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.541 0.624 0 N-CA-C 113.936 1.087 . . . . 0.0 113.936 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 81.8 mt -95.06 -22.25 18.03 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 125.894 1.677 . . . . 0.0 114.344 -177.174 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 4.6 m -73.53 74.67 1.46 Allowed 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 125.035 1.334 . . . . 0.0 111.206 -179.238 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 8.5 tp -75.65 142.66 42.53 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 127.234 2.213 . . . . 0.0 111.64 -177.62 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 12.8 mt-10 -72.17 152.15 42.46 Favored 'General case' 0 N--CA 1.47 0.548 0 O-C-N 120.684 -1.26 . . . . 0.0 112.796 179.613 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 14.9 m -84.01 153.44 3.72 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.811 0 C-N-CA 122.737 0.415 . . . . 0.0 110.483 175.093 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 34.9 t -73.48 134.01 43.79 Favored 'General case' 0 CA--C 1.539 0.528 0 N-CA-C 109.724 -0.472 . . . . 0.0 109.724 175.77 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 5.7 mpt_? -68.99 -43.18 75.39 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 124.898 1.279 . . . . 0.0 112.675 -176.958 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 12.8 mm-40 -70.41 -34.49 72.58 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 124.461 1.105 . . . . 0.0 111.947 -179.549 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 78.3 t80 -61.92 -27.0 68.51 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 124.145 0.978 . . . . 0.0 111.753 175.553 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 71.7 mm-40 -61.86 -21.5 64.72 Favored 'General case' 0 N--CA 1.478 0.93 0 N-CA-C 113.734 1.013 . . . . 0.0 113.734 177.185 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -118.62 13.66 13.41 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 125.521 1.528 . . . . 0.0 112.054 177.375 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 59.83 37.11 92.03 Favored Glycine 0 CA--C 1.533 1.165 0 C-N-CA 124.821 1.2 . . . . 0.0 113.933 -179.207 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 6.1 t -124.93 16.26 8.57 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 124.563 1.145 . . . . 0.0 113.66 -176.446 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 12.4 t -66.0 169.96 6.15 Favored 'General case' 0 CA--C 1.558 1.26 0 C-N-CA 124.245 1.018 . . . . 0.0 111.048 173.978 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 94.5 p -128.82 4.01 5.42 Favored 'General case' 0 N--CA 1.477 0.918 0 N-CA-C 115.673 1.731 . . . . 0.0 115.673 -175.646 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 53.1 mtt-85 -133.39 147.29 64.26 Favored Pre-proline 0 N--CA 1.474 0.744 0 C-N-CA 126.12 1.768 . . . . 0.0 111.027 179.403 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 93.5 Cg_endo -72.64 167.73 26.35 Favored 'Trans proline' 0 CA--C 1.541 0.836 0 C-N-CA 122.251 1.968 . . . . 0.0 109.929 175.42 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -53.91 -30.12 44.89 Favored 'General case' 0 N--CA 1.474 0.766 0 O-C-N 121.32 -0.863 . . . . 0.0 112.936 176.329 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 28.1 p -73.95 -10.21 59.41 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 125.536 1.534 . . . . 0.0 115.059 178.427 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -135.25 -13.4 2.08 Favored 'General case' 0 N--CA 1.478 0.952 0 N-CA-C 116.818 2.155 . . . . 0.0 116.818 -176.132 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 5.1 t -70.62 162.3 29.18 Favored 'General case' 0 CA--C 1.552 1.024 0 CA-C-N 120.553 1.524 . . . . 0.0 113.709 -178.969 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -77.01 -12.19 59.9 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 126.78 2.032 . . . . 0.0 114.106 -179.814 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 62.0 m-85 -137.92 172.87 12.3 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 126.191 1.797 . . . . 0.0 110.571 179.287 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -80.67 149.94 29.58 Favored 'General case' 0 CA--C 1.549 0.915 0 O-C-N 121.147 -0.97 . . . . 0.0 113.097 -177.311 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 65.3 m170 -124.81 89.9 51.78 Favored Pre-proline 0 CA--C 1.552 1.021 0 C-N-CA 125.828 1.651 . . . . 0.0 111.243 -179.097 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 31.1 Cg_endo -62.08 143.05 94.38 Favored 'Trans proline' 0 CA--C 1.542 0.907 0 C-N-CA 123.11 2.54 . . . . 0.0 112.729 179.542 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 45.8 p -80.13 -84.94 0.09 Allowed 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 124.799 1.24 . . . . 0.0 113.678 -178.732 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 35.7 mtmm -144.49 -55.87 0.35 Allowed 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 126.979 2.112 . . . . 0.0 111.579 -179.054 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 35.3 m -76.27 -17.95 59.22 Favored 'General case' 0 N--CA 1.477 0.914 0 N-CA-C 113.234 0.828 . . . . 0.0 113.234 178.184 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 73.9 m -57.34 124.19 18.02 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 124.801 1.24 . . . . 0.0 112.341 179.942 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 56.8 tt0 -87.67 134.85 33.58 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 124.869 1.267 . . . . 0.0 110.566 179.169 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 1.6 m -124.3 148.32 28.57 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.599 0 C-N-CA 125.315 1.446 . . . . 0.0 110.937 179.85 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 70.9 mm-40 -141.32 133.57 28.02 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 125.302 1.441 . . . . 0.0 110.152 179.312 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 63.1 t30 44.23 35.8 1.36 Allowed 'General case' 0 CA--C 1.555 1.144 0 N-CA-C 116.002 1.853 . . . . 0.0 116.002 177.963 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 83.9 20.14 60.06 Favored Glycine 0 CA--C 1.538 1.512 0 O-C-N 120.914 -1.116 . . . . 0.0 114.823 -179.246 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 43.1 mtt180 -139.34 163.46 32.43 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 125.703 1.601 . . . . 0.0 111.843 -178.69 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 2.9 m -137.29 135.13 47.27 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.692 0 C-N-CA 126.942 2.097 . . . . 0.0 110.276 -177.719 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 78.4 mt -83.9 125.85 40.18 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.546 0 O-C-N 121.541 -0.724 . . . . 0.0 109.855 -179.202 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -70.72 143.66 51.21 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 123.8 0.84 . . . . 0.0 110.447 176.358 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 17.2 t -65.08 98.86 0.32 Allowed 'General case' 0 C--O 1.239 0.536 0 C-N-CA 124.494 1.117 . . . . 0.0 113.091 -176.921 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 33.4 p90 -62.37 -37.36 85.42 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 115.188 -0.915 . . . . 0.0 109.971 175.391 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 70.7 m-20 -61.46 -43.61 98.56 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 118.522 0.601 . . . . 0.0 110.394 176.339 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 40.2 t -64.88 -43.32 93.3 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 119.773 1.169 . . . . 0.0 111.488 177.336 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 25.8 mt -64.64 -42.73 95.26 Favored 'General case' 0 CA--C 1.543 0.699 0 N-CA-C 113.555 0.946 . . . . 0.0 113.555 177.246 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 31.0 mmmt -80.59 -18.63 47.68 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 124.713 1.205 . . . . 0.0 113.836 -179.427 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 96.21 41.32 3.76 Favored Glycine 0 CA--C 1.537 1.454 0 C-N-CA 124.582 1.087 . . . . 0.0 114.943 177.911 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 50.5 tpt85 -126.75 -22.3 3.91 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 126.247 1.819 . . . . 0.0 115.213 -177.343 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 5.0 t . . . . . 0 CA--C 1.545 0.775 0 CA-C-N 119.997 1.271 . . . . 0.0 113.714 -175.737 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 9.1 t . . . . . 0 CA--C 1.544 0.72 0 CA-C-O 121.413 0.625 . . . . 0.0 111.409 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 23.6 mtmt -82.43 1.03 39.43 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 123.922 0.889 . . . . 0.0 113.242 -178.645 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 76.4 m-85 -120.37 150.01 41.43 Favored 'General case' 0 C--N 1.326 -0.429 0 C-N-CA 124.581 1.152 . . . . 0.0 111.611 -174.413 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -75.09 111.66 10.54 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 123.411 0.685 . . . . 0.0 111.99 -176.323 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 11.5 m170 -65.26 119.83 62.49 Favored Pre-proline 0 CA--C 1.545 0.787 0 N-CA-C 105.212 -2.144 . . . . 0.0 105.212 171.413 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -69.06 125.18 12.18 Favored 'Trans proline' 0 CA--C 1.543 0.94 0 C-N-CA 122.028 1.819 . . . . 0.0 114.528 -169.803 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 90.3 Cg_endo -78.02 154.87 29.7 Favored 'Trans proline' 0 CA--C 1.542 0.882 0 C-N-CA 123.403 2.735 . . . . 0.0 111.734 178.851 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 81.2 Cg_exo -47.47 -41.74 29.09 Favored 'Trans proline' 0 CA--C 1.538 0.723 0 C-N-CA 123.905 3.07 . . . . 0.0 115.176 179.287 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 6.4 t60 -65.35 -22.82 66.86 Favored 'General case' 0 N--CA 1.476 0.843 0 N-CA-C 114.437 1.273 . . . . 0.0 114.437 179.267 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 67.7 mt -111.11 -17.89 13.13 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 124.332 1.053 . . . . 0.0 113.027 -179.608 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 25.5 mtpp -55.96 -38.55 70.51 Favored 'General case' 0 N--CA 1.475 0.816 0 CA-C-N 120.144 1.338 . . . . 0.0 110.882 173.678 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 24.0 m -59.27 -43.3 92.51 Favored 'General case' 0 N--CA 1.474 0.734 0 CA-C-N 118.621 0.646 . . . . 0.0 110.933 176.62 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 17.4 mm100 -67.71 -47.88 68.1 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 123.537 0.735 . . . . 0.0 111.101 177.647 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 88.4 mt -60.76 -40.82 93.93 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 124.168 0.987 . . . . 0.0 112.618 178.462 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -55.34 -52.75 62.49 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 124.416 1.087 . . . . 0.0 110.6 175.226 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 73.3 mt -69.61 -37.94 75.45 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.436 0 C-N-CA 125.81 1.644 . . . . 0.0 111.386 -176.27 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 93.1 m-20 -63.82 -40.64 97.09 Favored 'General case' 0 CA--C 1.543 0.675 0 O-C-N 121.586 -0.696 . . . . 0.0 110.372 173.87 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.918 0 C-N-CA 124.139 0.876 . . . . 0.0 111.679 177.657 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.474 0.734 0 N-CA-C 113.865 1.061 . . . . 0.0 113.865 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 78.3 mt -95.53 -18.69 20.42 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 126.489 1.916 . . . . 0.0 114.199 -178.328 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 7.2 m -78.41 79.4 4.85 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 125.082 1.353 . . . . 0.0 110.762 -178.138 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -76.55 144.4 39.71 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 128.196 2.598 . . . . 0.0 111.075 -177.569 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 9.2 mt-10 -73.74 150.83 40.89 Favored 'General case' 0 N--CA 1.472 0.665 0 O-C-N 120.788 -1.195 . . . . 0.0 111.659 175.789 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 16.3 m -81.14 149.05 5.09 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.783 0 N-CA-C 109.404 -0.591 . . . . 0.0 109.404 173.568 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 42.4 t -63.9 126.86 29.02 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-O 121.98 0.895 . . . . 0.0 111.244 179.08 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 3.3 mpt_? -63.7 -26.02 68.47 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 124.743 1.217 . . . . 0.0 113.151 -177.317 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 13.9 mm-40 -82.8 -37.77 24.04 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-O 121.136 0.493 . . . . 0.0 109.785 177.017 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 61.2 t80 -62.67 -30.37 71.33 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 124.759 1.224 . . . . 0.0 111.076 174.677 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 79.5 mt-30 -59.48 -21.41 60.07 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.667 0.787 . . . . 0.0 112.869 175.088 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 3.5 mpt_? -118.33 14.47 13.82 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 126.171 1.788 . . . . 0.0 111.842 178.009 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 58.48 36.38 84.29 Favored Glycine 0 CA--C 1.534 1.251 0 C-N-CA 125.225 1.393 . . . . 0.0 114.194 -179.992 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 6.7 t -128.49 16.63 6.5 Favored 'General case' 0 N--CA 1.476 0.87 0 N-CA-C 114.727 1.38 . . . . 0.0 114.727 -175.85 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 10.2 t -68.06 172.05 6.12 Favored 'General case' 0 CA--C 1.559 1.289 0 O-C-N 121.542 -0.724 . . . . 0.0 110.487 173.104 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 51.1 m -133.98 11.88 3.95 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 125.332 1.453 . . . . 0.0 114.764 -176.114 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 70.2 mtm-85 -134.85 146.38 58.56 Favored Pre-proline 0 N--CA 1.476 0.843 0 C-N-CA 125.281 1.433 . . . . 0.0 112.625 -176.906 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -68.68 166.15 27.04 Favored 'Trans proline' 0 CA--C 1.542 0.885 0 C-N-CA 122.154 1.903 . . . . 0.0 109.96 172.457 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 -54.24 -27.75 36.8 Favored 'General case' 0 N--CA 1.474 0.764 0 N-CA-C 113.725 1.009 . . . . 0.0 113.725 177.762 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 11.7 p -76.82 -11.88 59.89 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 125.491 1.516 . . . . 0.0 114.953 178.588 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 51.2 mm-40 -119.59 -27.26 5.55 Favored 'General case' 0 N--CA 1.476 0.869 0 N-CA-C 116.063 1.875 . . . . 0.0 116.063 -174.468 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 3.3 t -67.93 163.77 21.34 Favored 'General case' 0 CA--C 1.548 0.872 0 N-CA-C 115.773 1.768 . . . . 0.0 115.773 -175.033 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.61 -11.94 59.99 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 127.881 2.472 . . . . 0.0 112.659 -179.989 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 75.6 m-85 -143.07 172.99 11.96 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 126.711 2.004 . . . . 0.0 110.138 179.957 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -79.32 152.56 30.41 Favored 'General case' 0 CA--C 1.547 0.848 0 N-CA-C 114.291 1.219 . . . . 0.0 114.291 -177.787 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 63.3 m170 -126.43 89.6 51.84 Favored Pre-proline 0 CA--C 1.551 0.99 0 C-N-CA 126.138 1.775 . . . . 0.0 109.637 178.21 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 33.6 Cg_endo -63.48 148.08 92.8 Favored 'Trans proline' 0 CA--C 1.539 0.775 0 C-N-CA 123.052 2.501 . . . . 0.0 114.648 -177.367 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 58.2 p -87.29 -173.47 4.41 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 125.445 1.498 . . . . 0.0 112.245 176.061 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 67.9 mttm -62.42 -19.38 63.41 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 125.704 1.602 . . . . 0.0 113.478 173.828 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 61.1 p -109.11 -24.04 11.36 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 125.062 1.345 . . . . 0.0 114.326 -179.965 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 82.6 m -60.98 129.13 39.85 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-N 119.329 0.968 . . . . 0.0 112.902 179.839 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 67.1 tp60 -81.41 135.1 35.64 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 124.171 0.988 . . . . 0.0 110.411 177.628 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 15.0 t -117.48 144.68 24.73 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.819 0 C-N-CA 125.693 1.597 . . . . 0.0 109.299 -179.823 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 50.3 mt-10 -146.16 124.43 12.26 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 125.698 1.599 . . . . 0.0 110.404 179.5 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 62.9 t30 43.64 36.94 1.35 Allowed 'General case' 0 CA--C 1.554 1.133 0 N-CA-C 116.357 1.984 . . . . 0.0 116.357 178.043 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 86.49 16.96 61.17 Favored Glycine 0 CA--C 1.537 1.457 0 O-C-N 120.929 -1.107 . . . . 0.0 114.875 -179.873 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 62.8 mtt180 -138.24 163.73 31.01 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 126.373 1.869 . . . . 0.0 110.807 -179.536 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 5.1 m -139.63 144.2 29.12 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.506 0 C-N-CA 126.994 2.118 . . . . 0.0 109.323 -177.918 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 60.4 mt -94.06 132.82 37.1 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.729 0 O-C-N 121.146 -0.971 . . . . 0.0 110.112 -177.925 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -74.43 148.99 40.64 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 124.156 0.982 . . . . 0.0 112.465 178.344 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 7.8 t -69.2 95.72 0.78 Allowed 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 125.025 1.33 . . . . 0.0 109.981 179.531 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 27.2 p90 -58.01 -36.32 72.51 Favored 'General case' 0 N--CA 1.467 0.385 0 C-N-CA 123.439 0.695 . . . . 0.0 111.417 179.373 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 74.5 m-20 -58.5 -36.23 73.46 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.439 0.696 . . . . 0.0 111.447 177.144 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 47.7 t -70.87 -38.22 73.09 Favored 'General case' 0 CA--C 1.54 0.583 0 O-C-N 121.149 -0.969 . . . . 0.0 111.642 178.251 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 50.0 mt -69.26 -42.66 75.29 Favored 'General case' 0 N--CA 1.474 0.732 0 O-C-N 121.316 -0.865 . . . . 0.0 112.352 175.205 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 31.3 mmmt -75.56 -9.94 59.02 Favored 'General case' 0 N--CA 1.478 0.925 0 C-N-CA 125.038 1.335 . . . . 0.0 113.844 -179.992 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 78.44 37.06 28.55 Favored Glycine 0 CA--C 1.536 1.346 0 C-N-CA 124.414 1.007 . . . . 0.0 113.82 179.519 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 51.1 ttp180 -119.86 -22.55 6.74 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 126.852 2.061 . . . . 0.0 114.256 -177.016 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 3.7 t . . . . . 0 CA--C 1.545 0.771 0 CA-C-O 122.245 1.021 . . . . 0.0 113.604 -177.639 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 86.2 m . . . . . 0 CA--C 1.543 0.677 0 N-CA-C 113.684 0.994 . . . . 0.0 113.684 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 43.0 mtmt -93.42 9.15 37.67 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 124.698 1.199 . . . . 0.0 111.16 173.188 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 70.1 m-85 -129.91 149.27 51.71 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 126.797 2.039 . . . . 0.0 111.351 -173.602 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -74.74 117.1 16.19 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 124.312 1.045 . . . . 0.0 112.901 -176.046 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 1.8 m-70 -67.67 121.58 79.91 Favored Pre-proline 0 CA--C 1.544 0.726 0 CA-C-O 118.194 -0.908 . . . . 0.0 108.829 173.994 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 67.6 Cg_exo -45.68 107.7 0.12 Allowed 'Trans proline' 0 CA--C 1.543 0.969 0 C-N-CA 124.894 3.729 . . . . 0.0 115.392 -178.649 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 98.4 Cg_endo -76.34 155.25 36.79 Favored 'Trans proline' 0 CA--C 1.541 0.857 0 C-N-CA 121.515 1.476 . . . . 0.0 110.606 176.362 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_endo -56.19 -29.68 76.57 Favored 'Trans proline' 0 CA--C 1.54 0.816 0 C-N-CA 123.169 2.579 . . . . 0.0 114.839 -177.664 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 11.8 m-70 -80.15 -14.44 58.47 Favored 'General case' 0 N--CA 1.476 0.853 0 N-CA-C 114.598 1.333 . . . . 0.0 114.598 177.238 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 73.6 mt -116.18 -15.84 11.04 Favored 'General case' 0 N--CA 1.476 0.833 0 CA-C-N 119.394 0.997 . . . . 0.0 113.353 179.63 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 67.2 mttt -52.5 -37.43 57.37 Favored 'General case' 0 N--CA 1.476 0.873 0 CA-C-N 119.76 1.163 . . . . 0.0 111.186 173.273 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 19.4 m -63.37 -44.25 95.29 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 123.722 0.809 . . . . 0.0 111.21 176.431 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 18.5 mm100 -67.93 -42.93 80.28 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 124.067 0.947 . . . . 0.0 111.546 178.636 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 80.5 mt -61.47 -47.59 84.96 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 123.846 0.858 . . . . 0.0 110.996 177.284 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 3.8 pt-20 -64.54 -37.2 86.74 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 119.651 1.114 . . . . 0.0 112.232 177.615 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 60.7 mt -62.9 -46.66 95.78 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.691 0 CA-C-N 119.395 0.998 . . . . 0.0 110.051 177.216 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 16.1 t-20 -63.35 -41.01 98.83 Favored 'General case' 0 CA--C 1.545 0.767 0 CA-C-N 118.598 0.635 . . . . 0.0 111.091 177.585 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 1.258 0 O-C-N 121.421 -0.799 . . . . 0.0 111.924 176.942 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.474 0.771 0 N-CA-C 114.224 1.194 . . . . 0.0 114.224 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 96.2 mt -91.3 -9.93 43.22 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 127.233 2.213 . . . . 0.0 114.954 -176.542 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 7.5 m -78.28 79.18 4.73 Favored 'General case' 0 N--CA 1.475 0.818 0 CA-C-O 122.336 1.065 . . . . 0.0 110.705 -179.175 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 12.4 tp -75.79 142.0 42.4 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 128.81 2.844 . . . . 0.0 112.023 -177.6 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -70.29 150.17 46.64 Favored 'General case' 0 N--CA 1.475 0.786 0 O-C-N 120.46 -1.4 . . . . 0.0 112.137 177.083 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 27.2 m -84.86 151.97 3.72 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.88 0 N-CA-C 109.676 -0.49 . . . . 0.0 109.676 172.104 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 51.3 t -67.54 125.78 27.25 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-O 121.804 0.812 . . . . 0.0 111.434 178.209 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 3.0 mpt_? -63.91 -26.21 68.49 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 124.763 1.225 . . . . 0.0 112.954 -178.158 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 11.1 mm-40 -81.79 -38.4 25.64 Favored 'General case' 0 CA--C 1.538 0.492 0 N-CA-C 109.662 -0.496 . . . . 0.0 109.662 176.877 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 59.7 t80 -63.84 -33.41 75.62 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 124.782 1.233 . . . . 0.0 110.969 175.093 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 84.7 mt-30 -59.31 -24.07 62.99 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 123.701 0.801 . . . . 0.0 112.396 174.277 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 72.9 mtt85 -114.95 12.49 16.81 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 126.453 1.901 . . . . 0.0 112.582 -175.582 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 58.19 34.95 75.51 Favored Glycine 0 CA--C 1.534 1.231 0 C-N-CA 125.256 1.407 . . . . 0.0 113.927 -179.828 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 6.7 t -131.89 14.67 4.8 Favored 'General case' 0 N--CA 1.474 0.762 0 N-CA-C 114.942 1.46 . . . . 0.0 114.942 -175.169 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 8.8 t -67.69 172.54 5.12 Favored 'General case' 0 CA--C 1.557 1.214 0 O-C-N 121.366 -0.834 . . . . 0.0 110.689 173.822 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 89.9 p -140.48 10.69 2.29 Favored 'General case' 0 N--CA 1.477 0.905 0 N-CA-C 115.349 1.611 . . . . 0.0 115.349 -176.309 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 59.0 mtm-85 -131.72 147.08 64.58 Favored Pre-proline 0 N--CA 1.474 0.731 0 C-N-CA 125.522 1.529 . . . . 0.0 112.405 -178.074 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -68.52 165.96 27.39 Favored 'Trans proline' 0 CA--C 1.542 0.889 0 C-N-CA 121.943 1.762 . . . . 0.0 109.633 171.82 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 7.1 p-10 -53.31 -31.8 45.8 Favored 'General case' 0 N--CA 1.473 0.724 0 O-C-N 121.268 -0.895 . . . . 0.0 113.244 177.826 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 22.7 p -72.76 -9.36 58.56 Favored 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 115.136 1.532 . . . . 0.0 115.136 178.468 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 19.8 mt-10 -122.47 -25.41 4.77 Favored 'General case' 0 N--CA 1.477 0.882 0 N-CA-C 115.9 1.815 . . . . 0.0 115.9 -176.421 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 3.0 t -69.68 164.02 24.37 Favored 'General case' 0 CA--C 1.547 0.829 0 N-CA-C 115.195 1.554 . . . . 0.0 115.195 -176.614 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -79.51 -11.14 59.9 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 127.186 2.194 . . . . 0.0 113.764 -179.495 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 65.9 m-85 -141.67 175.55 9.61 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 126.393 1.877 . . . . 0.0 110.673 -179.446 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -79.58 149.97 31.21 Favored 'General case' 0 CA--C 1.547 0.85 0 O-C-N 120.986 -1.071 . . . . 0.0 113.253 -178.078 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 65.2 m170 -123.88 91.99 49.0 Favored Pre-proline 0 CA--C 1.55 0.962 0 C-N-CA 125.785 1.634 . . . . 0.0 110.412 178.859 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_endo -63.0 162.3 26.41 Favored 'Trans proline' 0 CA--C 1.54 0.81 0 C-N-CA 123.356 2.704 . . . . 0.0 114.155 -179.224 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 84.6 p -131.6 -172.26 2.81 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 125.858 1.663 . . . . 0.0 112.531 178.84 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 60.4 pttt -27.14 -48.84 0.04 OUTLIER 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 129.345 3.058 . . . . 0.0 118.425 -175.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 5.5 p -109.66 -12.11 14.68 Favored 'General case' 0 N--CA 1.475 0.806 0 N-CA-C 115.697 1.74 . . . . 0.0 115.697 -176.286 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 66.7 m -57.9 128.63 38.04 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 124.546 1.138 . . . . 0.0 113.977 -176.835 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 44.4 tt0 -81.0 125.72 30.5 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 125.575 1.55 . . . . 0.0 110.215 178.333 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 23.2 t -119.67 133.43 66.47 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.976 0 C-N-CA 125.861 1.665 . . . . 0.0 109.608 -178.222 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -144.74 131.39 19.99 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 124.859 1.264 . . . . 0.0 111.504 -179.205 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 62.6 t30 41.41 38.01 0.76 Allowed 'General case' 0 CA--C 1.552 1.043 0 C-N-CA 127.277 2.231 . . . . 0.0 116.714 177.475 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 88.25 15.41 60.63 Favored Glycine 0 CA--C 1.535 1.324 0 O-C-N 120.979 -1.076 . . . . 0.0 114.975 179.536 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 31.6 mtt180 -139.43 168.3 20.13 Favored 'General case' 0 N--CA 1.467 0.4 0 C-N-CA 126.209 1.804 . . . . 0.0 112.185 -179.355 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 2.2 m -141.31 140.31 31.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 C-N-CA 127.737 2.415 . . . . 0.0 108.79 -178.914 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 47.2 mt -89.23 126.19 42.23 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.608 0 O-C-N 121.098 -1.001 . . . . 0.0 109.727 -179.336 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -71.66 146.83 48.02 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 124.071 0.948 . . . . 0.0 111.436 177.303 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 14.7 t -69.1 99.1 1.06 Allowed 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 124.752 1.221 . . . . 0.0 113.03 -177.072 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 28.1 p90 -61.18 -37.73 83.97 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 115.263 -0.88 . . . . 0.0 109.939 174.746 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 75.3 m-20 -62.25 -43.54 98.6 Favored 'General case' 0 CA--C 1.538 0.501 0 O-C-N 121.776 -0.578 . . . . 0.0 110.665 177.293 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 46.6 t -63.83 -44.14 94.13 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 119.633 1.106 . . . . 0.0 111.3 177.313 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 43.7 mt -62.8 -42.24 99.63 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 124.082 0.953 . . . . 0.0 113.294 176.85 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 31.4 mmmt -80.61 -12.65 59.48 Favored 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 124.904 1.281 . . . . 0.0 113.839 179.876 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 85.99 38.42 8.61 Favored Glycine 0 CA--C 1.538 1.485 0 C-N-CA 124.6 1.095 . . . . 0.0 114.274 179.225 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 49.2 ttp180 -122.07 -20.39 6.29 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 126.721 2.008 . . . . 0.0 114.808 -176.825 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 5.6 t . . . . . 0 CA--C 1.546 0.808 0 CA-C-N 119.393 0.997 . . . . 0.0 113.187 -178.187 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 8.9 t . . . . . 0 CA--C 1.543 0.703 0 CA-C-O 121.202 0.525 . . . . 0.0 111.396 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 17.1 mtmt -83.94 0.26 48.59 Favored 'General case' 0 N--CA 1.476 0.838 0 N-CA-C 113.715 1.006 . . . . 0.0 113.715 -178.843 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 72.2 m-85 -120.96 152.07 38.96 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 122.216 1.008 . . . . 0.0 112.231 -173.21 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -75.61 113.37 12.97 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 123.547 0.739 . . . . 0.0 111.766 -176.656 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 15.4 m170 -68.09 116.4 38.58 Favored Pre-proline 0 CA--C 1.546 0.823 0 N-CA-C 105.126 -2.176 . . . . 0.0 105.126 171.256 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 66.3 Cg_endo -70.16 132.14 22.09 Favored 'Trans proline' 0 CA--C 1.543 0.932 0 C-N-CA 121.917 1.744 . . . . 0.0 114.393 -169.86 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_endo -76.05 159.05 37.85 Favored 'Trans proline' 0 CA--C 1.542 0.879 0 C-N-CA 123.902 3.068 . . . . 0.0 111.863 178.543 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 21.1 Cg_endo -55.57 -32.78 84.39 Favored 'Trans proline' 0 CA--C 1.538 0.719 0 C-N-CA 123.484 2.789 . . . . 0.0 114.715 -178.155 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 56.0 m80 -76.84 -13.41 60.01 Favored 'General case' 0 N--CA 1.474 0.773 0 N-CA-C 114.659 1.355 . . . . 0.0 114.659 177.779 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 91.2 mt -115.86 -18.13 10.83 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 124.551 1.14 . . . . 0.0 113.535 179.344 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 58.3 mtpt -53.8 -37.21 63.28 Favored 'General case' 0 N--CA 1.48 1.072 0 CA-C-N 119.992 1.269 . . . . 0.0 111.233 172.907 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 19.6 m -64.16 -42.13 96.87 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 124.628 1.171 . . . . 0.0 111.709 176.007 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 90.6 mm-40 -67.21 -42.91 83.32 Favored 'General case' 0 N--CA 1.466 0.356 0 C-N-CA 123.517 0.727 . . . . 0.0 110.421 178.531 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 66.7 mt -63.2 -45.66 90.7 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-O 118.391 -0.814 . . . . 0.0 112.183 176.927 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 7.2 pt-20 -63.99 -35.64 81.37 Favored 'General case' 0 N--CA 1.474 0.766 0 CA-C-N 120.476 1.489 . . . . 0.0 111.878 177.196 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 69.1 mt -63.13 -44.54 99.48 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.679 0 CA-C-N 119.049 0.841 . . . . 0.0 109.77 175.185 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 86.4 m-20 -61.12 -42.74 99.08 Favored 'General case' 0 CA--C 1.545 0.774 0 O-C-N 121.707 -0.621 . . . . 0.0 110.728 175.665 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 1.053 0 C-N-CA 124.881 1.229 . . . . 0.0 112.403 178.873 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.544 0.727 0 N-CA-C 114.08 1.141 . . . . 0.0 114.08 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 96.2 mt -91.19 -10.11 42.91 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 127.24 2.216 . . . . 0.0 114.78 -177.141 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 9.7 m -78.45 79.22 4.89 Favored 'General case' 0 N--CA 1.477 0.888 0 CA-C-N 119.728 1.149 . . . . 0.0 110.879 -178.805 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 10.0 tp -75.71 143.26 42.19 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 128.567 2.747 . . . . 0.0 111.875 -177.728 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 10.1 mt-10 -74.91 151.83 38.9 Favored 'General case' 0 N--CA 1.47 0.559 0 O-C-N 120.5 -1.375 . . . . 0.0 112.888 178.409 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 14.8 m -85.36 154.92 3.49 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.943 0 C-N-CA 123.255 0.622 . . . . 0.0 111.659 175.497 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 47.8 t -74.83 138.59 42.66 Favored 'General case' 0 CA--C 1.538 0.519 0 O-C-N 121.704 -0.622 . . . . 0.0 110.883 176.439 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.27 -39.57 74.85 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 124.811 1.244 . . . . 0.0 113.229 -178.422 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 13.5 mm-40 -73.97 -32.9 63.65 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 123.551 0.74 . . . . 0.0 111.351 179.268 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 67.3 t80 -62.75 -27.57 69.37 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 123.89 0.876 . . . . 0.0 111.471 175.844 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 57.9 mm-40 -65.28 -20.01 66.22 Favored 'General case' 0 N--CA 1.476 0.862 0 N-CA-C 112.815 0.672 . . . . 0.0 112.815 175.359 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 7.3 mpt_? -108.71 8.48 26.88 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 126.315 1.846 . . . . 0.0 111.607 176.894 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 58.64 36.12 84.22 Favored Glycine 0 CA--C 1.533 1.179 0 C-N-CA 125.421 1.486 . . . . 0.0 114.127 -179.677 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 4.8 t -130.96 7.81 4.73 Favored 'General case' 0 N--CA 1.477 0.917 0 N-CA-C 114.892 1.442 . . . . 0.0 114.892 -174.944 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 27.8 t -60.2 132.86 55.25 Favored 'General case' 0 CA--C 1.55 0.959 0 O-C-N 120.902 -1.124 . . . . 0.0 110.615 175.972 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 77.9 p -82.66 3.98 26.76 Favored 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 115.457 1.651 . . . . 0.0 115.457 -176.67 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 67.4 mtm-85 -130.23 146.2 60.58 Favored Pre-proline 0 N--CA 1.475 0.805 0 C-N-CA 125.252 1.421 . . . . 0.0 113.311 -176.216 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 95.2 Cg_endo -70.35 167.76 24.3 Favored 'Trans proline' 0 CA--C 1.543 0.958 0 C-N-CA 122.385 2.056 . . . . 0.0 110.021 171.706 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 -54.22 -29.12 45.28 Favored 'General case' 0 N--CA 1.475 0.81 0 N-CA-C 113.538 0.94 . . . . 0.0 113.538 177.158 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 16.2 p -75.52 -8.35 56.51 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 125.59 1.556 . . . . 0.0 114.981 178.642 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 19.3 mt-10 -124.78 -25.53 3.93 Favored 'General case' 0 N--CA 1.478 0.931 0 N-CA-C 116.092 1.886 . . . . 0.0 116.092 -176.012 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 4.3 t -68.92 163.14 25.11 Favored 'General case' 0 CA--C 1.548 0.895 0 N-CA-C 115.215 1.561 . . . . 0.0 115.215 -176.631 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -79.59 -9.99 59.72 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 127.286 2.234 . . . . 0.0 113.236 179.627 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 65.6 m-85 -140.54 174.0 10.95 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 126.411 1.885 . . . . 0.0 110.523 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -81.99 150.78 27.47 Favored 'General case' 0 CA--C 1.546 0.804 0 O-C-N 121.129 -0.982 . . . . 0.0 113.464 -177.742 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 66.5 m170 -123.82 86.52 53.24 Favored Pre-proline 0 CA--C 1.551 0.982 0 C-N-CA 126.043 1.737 . . . . 0.0 110.739 -179.587 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 29.5 Cg_endo -62.18 146.44 95.99 Favored 'Trans proline' 0 CA--C 1.54 0.811 0 C-N-CA 123.6 2.867 . . . . 0.0 114.923 -177.444 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 51.6 p -84.98 -176.05 6.04 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 124.867 1.267 . . . . 0.0 112.386 175.604 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 75.0 mmtt -60.67 -19.51 58.58 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 125.819 1.648 . . . . 0.0 113.553 173.558 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 43.0 m -109.06 -20.58 12.97 Favored 'General case' 0 N--CA 1.478 0.933 0 N-CA-C 114.216 1.191 . . . . 0.0 114.216 179.372 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 87.2 m -61.5 138.46 58.28 Favored 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 113.915 1.08 . . . . 0.0 113.915 -178.638 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 47.8 tt0 -83.57 127.66 33.91 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 125.832 1.653 . . . . 0.0 110.308 178.594 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 15.0 t -123.11 133.49 68.93 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.958 0 C-N-CA 125.666 1.587 . . . . 0.0 109.908 -177.852 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -144.24 129.29 18.57 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 125.114 1.366 . . . . 0.0 111.255 -179.136 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 61.9 t30 43.42 36.54 1.14 Allowed 'General case' 0 CA--C 1.552 1.051 0 C-N-CA 126.82 2.048 . . . . 0.0 116.462 177.94 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 87.41 14.24 64.17 Favored Glycine 0 CA--C 1.536 1.347 0 O-C-N 120.993 -1.067 . . . . 0.0 114.947 179.845 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 71.4 mtt180 -136.86 164.25 28.74 Favored 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 125.823 1.649 . . . . 0.0 111.087 -179.929 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 4.1 m -139.34 142.74 32.64 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.564 0 C-N-CA 127.13 2.172 . . . . 0.0 109.085 -177.926 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 29.1 mt -90.94 127.84 43.12 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.647 0 O-C-N 121.09 -1.006 . . . . 0.0 109.995 -178.51 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -73.38 147.46 44.29 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 123.962 0.905 . . . . 0.0 111.229 177.642 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 15.1 t -70.58 97.06 1.26 Allowed 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 125.655 1.582 . . . . 0.0 113.267 -175.82 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 28.1 p90 -59.66 -37.53 79.01 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 123.428 0.691 . . . . 0.0 110.407 175.179 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 69.7 m-20 -61.43 -36.82 81.42 Favored 'General case' 0 CA--C 1.54 0.574 0 O-C-N 121.645 -0.659 . . . . 0.0 111.632 177.273 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 46.7 p -67.19 -38.53 85.52 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-N 119.733 1.151 . . . . 0.0 111.976 177.304 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 42.1 mt -71.73 -42.97 66.64 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 124.51 1.124 . . . . 0.0 112.261 177.444 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 31.1 mmmt -76.12 -15.6 60.05 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 124.69 1.196 . . . . 0.0 113.7 179.573 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 87.76 42.41 6.07 Favored Glycine 0 CA--C 1.537 1.416 0 C-N-CA 124.519 1.057 . . . . 0.0 114.502 178.085 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 19.4 tpp180 -127.19 -23.43 3.57 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 125.865 1.666 . . . . 0.0 115.241 -176.922 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 8.2 t . . . . . 0 CA--C 1.546 0.8 0 CA-C-N 119.444 1.02 . . . . 0.0 113.142 -176.542 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 9.4 t . . . . . 0 CA--C 1.543 0.706 0 CA-C-O 121.299 0.571 . . . . 0.0 111.436 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 6.8 mtmp? -84.78 3.78 36.03 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 124.077 0.951 . . . . 0.0 113.457 -177.982 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 67.5 m-85 -124.76 152.79 43.37 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 124.207 1.003 . . . . 0.0 112.353 -173.881 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -79.65 116.4 19.83 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 123.712 0.805 . . . . 0.0 112.249 -175.788 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 32.7 m170 -68.99 114.42 23.1 Favored Pre-proline 0 CA--C 1.548 0.902 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 174.649 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 67.8 Cg_exo -47.23 112.99 0.6 Allowed 'Trans proline' 0 CA--C 1.541 0.861 0 C-N-CA 125.011 3.807 . . . . 0.0 116.267 -175.926 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 96.0 Cg_endo -76.0 157.01 38.7 Favored 'Trans proline' 0 CA--C 1.541 0.873 0 C-N-CA 121.74 1.627 . . . . 0.0 110.889 176.406 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_endo -57.41 -31.2 90.55 Favored 'Trans proline' 0 CA--C 1.539 0.734 0 C-N-CA 123.155 2.57 . . . . 0.0 114.839 -176.669 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 61.6 m80 -80.68 -10.84 59.7 Favored 'General case' 0 N--CA 1.475 0.803 0 N-CA-C 114.749 1.388 . . . . 0.0 114.749 178.169 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 77.3 mt -117.0 -16.96 10.47 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 124.214 1.005 . . . . 0.0 113.179 178.527 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 62.3 mttt -52.99 -35.47 59.29 Favored 'General case' 0 N--CA 1.475 0.825 0 CA-C-N 119.502 1.047 . . . . 0.0 111.58 173.249 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 24.5 m -63.64 -46.05 87.45 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 124.206 1.002 . . . . 0.0 111.295 175.969 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 92.4 mm-40 -65.57 -44.51 86.51 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 123.637 0.775 . . . . 0.0 110.659 177.661 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 87.9 mt -60.75 -46.52 90.13 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 123.833 0.853 . . . . 0.0 111.974 177.305 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -65.91 -35.42 80.58 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-N 119.934 1.243 . . . . 0.0 112.098 177.52 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 64.9 mt -62.6 -43.56 98.6 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.786 0 CA-C-N 119.258 0.935 . . . . 0.0 109.647 175.337 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 83.8 m-20 -61.77 -44.12 97.51 Favored 'General case' 0 CA--C 1.542 0.668 0 O-C-N 121.778 -0.576 . . . . 0.0 110.482 175.307 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.856 0 C-N-CA 124.701 1.143 . . . . 0.0 112.559 179.354 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.473 0.724 0 N-CA-C 113.372 0.878 . . . . 0.0 113.372 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 91.2 mt -88.2 -12.22 44.48 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 127.202 2.201 . . . . 0.0 113.886 -179.119 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 12.9 m -79.59 79.37 6.07 Favored 'General case' 0 N--CA 1.474 0.732 0 CA-C-O 122.487 1.137 . . . . 0.0 110.218 -178.377 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 11.9 tp -75.61 143.81 42.1 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 128.512 2.725 . . . . 0.0 111.548 -177.357 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 62.5 mt-10 -74.03 150.57 40.57 Favored 'General case' 0 CA--C 1.541 0.614 0 O-C-N 120.765 -1.21 . . . . 0.0 112.362 178.622 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 13.7 m -86.33 153.24 3.44 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.232 0 C-N-CA 123.539 0.736 . . . . 0.0 111.149 174.59 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 41.5 t -72.29 130.15 40.1 Favored 'General case' 0 CA--C 1.543 0.695 0 O-C-N 121.129 -0.982 . . . . 0.0 112.081 178.76 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.2 -28.94 69.73 Favored 'General case' 0 N--CA 1.479 0.992 0 O-C-N 121.287 -0.883 . . . . 0.0 113.09 179.821 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -77.03 -41.4 42.77 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 123.726 0.811 . . . . 0.0 110.142 178.884 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 65.0 t80 -63.54 -34.4 77.72 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 124.331 1.052 . . . . 0.0 111.517 175.907 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 13.6 mm100 -62.65 -14.51 44.33 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 124.03 0.932 . . . . 0.0 113.161 175.081 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 11.8 mtp-105 -121.41 12.67 10.9 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 127.428 2.291 . . . . 0.0 112.197 179.27 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 57.2 35.73 71.8 Favored Glycine 0 CA--C 1.534 1.261 0 C-N-CA 125.259 1.409 . . . . 0.0 114.0 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 7.4 t -131.73 15.6 4.84 Favored 'General case' 0 N--CA 1.476 0.842 0 N-CA-C 114.898 1.444 . . . . 0.0 114.898 -174.958 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 5.9 t -67.83 172.53 5.29 Favored 'General case' 0 CA--C 1.556 1.182 0 CA-C-N 119.137 0.88 . . . . 0.0 111.432 175.295 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 94.3 p -134.79 6.1 3.41 Favored 'General case' 0 N--CA 1.476 0.85 0 N-CA-C 115.55 1.685 . . . . 0.0 115.55 -175.782 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 81.5 mtt180 -133.1 143.34 48.04 Favored Pre-proline 0 N--CA 1.472 0.64 0 C-N-CA 125.53 1.532 . . . . 0.0 111.91 -179.39 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -68.17 165.72 27.54 Favored 'Trans proline' 0 CA--C 1.542 0.913 0 C-N-CA 122.144 1.896 . . . . 0.0 109.919 173.155 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -51.89 -32.7 33.59 Favored 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 113.765 1.024 . . . . 0.0 113.765 178.486 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 17.6 p -71.05 -14.08 62.2 Favored 'General case' 0 N--CA 1.473 0.725 0 C-N-CA 125.906 1.682 . . . . 0.0 115.021 178.481 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 74.3 mm-40 -123.78 -22.85 4.82 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 125.692 1.597 . . . . 0.0 115.23 -174.268 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 4.6 t -65.14 168.18 7.08 Favored 'General case' 0 CA--C 1.548 0.898 0 N-CA-C 115.937 1.829 . . . . 0.0 115.937 -175.527 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -80.41 -18.98 47.27 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 128.075 2.55 . . . . 0.0 113.102 -179.755 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 67.5 m-85 -145.2 178.37 8.12 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 126.625 1.97 . . . . 0.0 110.598 -178.061 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -79.37 151.13 31.15 Favored 'General case' 0 CA--C 1.547 0.864 0 O-C-N 120.812 -1.18 . . . . 0.0 113.404 -178.071 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 59.5 m170 -125.41 87.73 55.24 Favored Pre-proline 0 CA--C 1.549 0.932 0 C-N-CA 126.128 1.771 . . . . 0.0 110.355 179.576 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -64.32 147.32 90.9 Favored 'Trans proline' 0 C--N 1.352 0.754 0 C-N-CA 123.237 2.625 . . . . 0.0 114.379 -177.885 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 60.2 p -84.59 -176.31 6.18 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 124.685 1.194 . . . . 0.0 111.79 174.735 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 47.1 mmtm -61.04 -18.75 59.52 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 125.259 1.424 . . . . 0.0 113.253 173.084 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 42.1 m -109.17 -20.6 12.93 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 125.133 1.373 . . . . 0.0 114.563 -178.9 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 97.0 m -65.45 132.93 50.19 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-N 119.357 0.981 . . . . 0.0 112.659 179.862 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 33.9 mt-30 -77.24 138.43 39.41 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 123.271 0.628 . . . . 0.0 111.011 176.766 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 11.8 t -127.87 147.08 32.58 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.897 0 C-N-CA 125.666 1.586 . . . . 0.0 110.986 -176.895 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 4.3 pt-20 -149.02 117.48 6.51 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 125.188 1.395 . . . . 0.0 114.062 -179.349 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 75.0 m-20 40.66 30.46 0.09 Allowed 'General case' 0 CA--C 1.553 1.073 0 C-N-CA 127.536 2.334 . . . . 0.0 116.986 174.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 109.17 5.5 30.41 Favored Glycine 0 CA--C 1.536 1.371 0 C-N-CA 124.656 1.122 . . . . 0.0 114.932 -178.995 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 34.3 mtt180 -133.87 165.41 25.07 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 119.236 1.518 . . . . 0.0 112.508 179.04 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 3.8 m -140.42 145.79 25.39 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.534 0 C-N-CA 127.992 2.517 . . . . 0.0 109.107 -179.417 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 17.8 mt -94.13 131.44 41.01 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 O-C-N 121.003 -1.061 . . . . 0.0 110.201 -178.485 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -77.65 148.21 35.16 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 124.095 0.958 . . . . 0.0 111.659 178.632 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 21.5 t -70.63 98.94 1.58 Allowed 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 124.9 1.28 . . . . 0.0 112.582 -177.409 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 29.5 p90 -60.78 -38.34 84.95 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 123.652 0.781 . . . . 0.0 110.512 175.789 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 60.9 m-20 -59.59 -38.44 81.25 Favored 'General case' 0 CA--C 1.543 0.703 0 O-C-N 121.719 -0.613 . . . . 0.0 110.436 176.66 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 24.7 p -65.49 -41.71 92.98 Favored 'General case' 0 N--CA 1.472 0.632 0 CA-C-N 119.929 1.241 . . . . 0.0 112.164 177.832 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 33.6 mt -68.71 -41.25 79.34 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 124.756 1.222 . . . . 0.0 112.638 177.913 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 14.2 mmmm -77.53 -8.78 58.34 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 124.586 1.155 . . . . 0.0 113.437 178.743 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 78.71 41.12 16.02 Favored Glycine 0 CA--C 1.536 1.369 0 C-N-CA 124.733 1.158 . . . . 0.0 113.632 179.265 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 65.1 ttt-85 -123.64 -22.9 4.86 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 126.85 2.06 . . . . 0.0 114.873 -175.571 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 5.6 t . . . . . 0 CA--C 1.545 0.768 0 CA-C-N 119.24 0.927 . . . . 0.0 112.973 -178.0 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 4.5 t . . . . . 0 CA--C 1.546 0.813 0 CA-C-O 121.542 0.687 . . . . 0.0 112.525 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 32.3 mtmt -84.17 3.11 36.51 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 125.182 1.393 . . . . 0.0 113.868 -177.98 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 87.9 m-85 -125.46 152.87 44.34 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 124.944 1.298 . . . . 0.0 111.935 -175.298 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -76.38 117.42 18.03 Favored 'General case' 0 N--CA 1.465 0.307 0 C-N-CA 123.708 0.803 . . . . 0.0 112.213 -176.471 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 12.9 m170 -72.31 115.7 41.68 Favored Pre-proline 0 CA--C 1.547 0.859 0 N-CA-C 107.962 -1.125 . . . . 0.0 107.962 174.215 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_exo -48.87 115.22 1.56 Allowed 'Trans proline' 0 CA--C 1.542 0.905 0 C-N-CA 124.802 3.668 . . . . 0.0 115.696 -176.104 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 92.2 Cg_endo -78.88 153.65 25.77 Favored 'Trans proline' 0 CA--C 1.544 1.02 0 C-N-CA 121.887 1.725 . . . . 0.0 111.283 177.6 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 86.6 Cg_exo -47.16 -36.99 22.78 Favored 'Trans proline' 0 CA--C 1.537 0.664 0 C-N-CA 124.189 3.26 . . . . 0.0 115.704 179.682 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 69.8 m80 -79.63 -10.35 59.78 Favored 'General case' 0 N--CA 1.473 0.704 0 N-CA-C 115.588 1.699 . . . . 0.0 115.588 -179.643 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 79.9 mt -119.42 -14.55 9.16 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 124.512 1.125 . . . . 0.0 113.287 177.721 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 23.8 mtpp -54.45 -34.8 62.16 Favored 'General case' 0 N--CA 1.477 0.915 0 CA-C-N 119.451 1.023 . . . . 0.0 111.409 173.363 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 21.7 m -62.92 -45.71 91.2 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 123.877 0.871 . . . . 0.0 111.202 176.068 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 92.6 mm-40 -66.03 -44.99 83.05 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 123.604 0.761 . . . . 0.0 110.954 177.665 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 76.5 mt -60.72 -45.24 94.99 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 123.742 0.817 . . . . 0.0 112.212 177.809 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -66.85 -36.5 82.47 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-N 119.578 1.081 . . . . 0.0 111.886 177.343 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 63.9 mt -62.06 -42.05 93.49 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.754 0 CA-C-N 119.117 0.871 . . . . 0.0 109.797 175.384 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 86.4 m-20 -61.74 -47.12 86.64 Favored 'General case' 0 CA--C 1.543 0.704 0 O-C-N 121.861 -0.525 . . . . 0.0 110.395 175.32 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 1.058 0 C-N-CA 124.595 1.093 . . . . 0.0 113.105 179.355 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.475 0.79 0 N-CA-C 114.113 1.153 . . . . 0.0 114.113 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 90.7 mt -91.72 -12.02 35.18 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 127.22 2.208 . . . . 0.0 114.423 -177.822 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 9.6 m -79.03 74.2 5.56 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 124.678 1.191 . . . . 0.0 110.898 -177.792 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 9.8 tp -75.7 143.73 41.96 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 126.845 2.058 . . . . 0.0 111.853 -178.047 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 8.2 mt-10 -69.54 150.29 47.28 Favored 'General case' 0 N--CA 1.472 0.67 0 O-C-N 120.766 -1.209 . . . . 0.0 112.308 178.735 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 21.3 m -82.15 148.85 5.01 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 N-CA-C 109.303 -0.628 . . . . 0.0 109.303 173.545 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 49.6 t -66.01 130.92 44.91 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-O 121.757 0.789 . . . . 0.0 111.01 178.124 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 2.8 mpt_? -69.41 -33.75 73.47 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 125.667 1.587 . . . . 0.0 112.192 -177.725 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 14.8 mm-40 -77.9 -34.5 51.42 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 123.676 0.79 . . . . 0.0 110.998 178.36 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 74.6 t80 -62.59 -27.51 69.24 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 124.452 1.101 . . . . 0.0 111.365 175.222 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 54.4 mm-40 -65.03 -19.5 66.03 Favored 'General case' 0 N--CA 1.475 0.825 0 N-CA-C 112.806 0.669 . . . . 0.0 112.806 175.337 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 6.9 mpt_? -111.75 10.2 20.9 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 126.477 1.911 . . . . 0.0 111.56 177.012 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 58.32 36.31 82.83 Favored Glycine 0 CA--C 1.533 1.213 0 C-N-CA 125.463 1.506 . . . . 0.0 114.287 -179.957 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 6.2 t -130.84 11.9 5.2 Favored 'General case' 0 N--CA 1.478 0.963 0 N-CA-C 115.117 1.525 . . . . 0.0 115.117 -175.388 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 36.8 t -61.45 139.11 58.27 Favored 'General case' 0 CA--C 1.551 1.017 0 O-C-N 121.318 -0.864 . . . . 0.0 110.988 176.165 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 78.2 p -89.23 0.67 56.59 Favored 'General case' 0 N--CA 1.472 0.631 0 N-CA-C 115.686 1.735 . . . . 0.0 115.686 -176.755 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 68.0 mtt180 -132.65 145.35 56.79 Favored Pre-proline 0 N--CA 1.475 0.803 0 C-N-CA 125.19 1.396 . . . . 0.0 113.042 -177.131 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -68.94 166.14 27.58 Favored 'Trans proline' 0 CA--C 1.543 0.965 0 C-N-CA 122.39 2.06 . . . . 0.0 110.125 172.878 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -52.23 -32.1 35.21 Favored 'General case' 0 N--CA 1.477 0.89 0 N-CA-C 113.868 1.062 . . . . 0.0 113.868 178.022 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 22.4 p -72.14 -13.71 61.63 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 125.585 1.554 . . . . 0.0 114.941 178.553 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 70.8 mm-40 -125.35 -22.25 4.38 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 125.574 1.55 . . . . 0.0 115.182 -174.623 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 14.3 t -60.03 162.75 5.35 Favored 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 115.37 1.618 . . . . 0.0 115.37 -176.509 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.42 -13.65 58.95 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 126.748 2.019 . . . . 0.0 112.821 177.959 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 70.3 m-85 -141.61 175.92 9.31 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 126.657 1.983 . . . . 0.0 111.151 -178.76 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -81.57 151.3 27.77 Favored 'General case' 0 CA--C 1.551 1.008 0 O-C-N 120.753 -1.217 . . . . 0.0 113.599 -178.283 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 56.0 m170 -124.67 91.28 49.7 Favored Pre-proline 0 CA--C 1.551 1.001 0 C-N-CA 126.006 1.722 . . . . 0.0 111.168 179.419 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo -66.49 167.05 19.81 Favored 'Trans proline' 0 CA--C 1.542 0.922 0 C-N-CA 123.678 2.919 . . . . 0.0 114.395 -179.237 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 59.7 p -125.04 -174.28 3.01 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 126.116 1.766 . . . . 0.0 111.954 177.401 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 30.9 mmmt -49.48 -26.58 3.49 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 127.31 2.244 . . . . 0.0 116.323 -179.378 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 21.1 m -109.05 -19.07 13.51 Favored 'General case' 0 N--CA 1.481 1.082 0 N-CA-C 114.506 1.299 . . . . 0.0 114.506 -179.389 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 58.3 m -63.49 135.43 56.88 Favored 'General case' 0 CA--C 1.543 0.7 0 CA-C-N 119.359 0.981 . . . . 0.0 113.137 -178.734 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 40.4 tt0 -85.29 127.6 34.38 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 125.519 1.527 . . . . 0.0 110.044 178.716 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 20.1 t -120.45 133.6 66.64 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 C-N-CA 125.523 1.529 . . . . 0.0 109.51 -178.162 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 -143.19 130.44 20.89 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 125.016 1.326 . . . . 0.0 110.864 -179.118 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 45.59 36.65 2.68 Favored 'General case' 0 CA--C 1.555 1.147 0 C-N-CA 126.451 1.9 . . . . 0.0 115.366 178.936 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 81.18 19.94 65.88 Favored Glycine 0 CA--C 1.536 1.387 0 O-C-N 120.956 -1.09 . . . . 0.0 114.579 -179.856 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 63.4 mtt180 -138.69 163.25 32.61 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 125.995 1.718 . . . . 0.0 110.938 -179.16 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 3.3 m -138.17 140.07 40.94 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.501 0 C-N-CA 126.613 1.965 . . . . 0.0 109.381 -177.91 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 54.7 mt -90.32 130.63 39.25 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.662 0 O-C-N 121.544 -0.723 . . . . 0.0 109.528 -178.952 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -74.99 150.56 38.94 Favored 'General case' 0 CA--C 1.551 0.982 0 C-N-CA 123.782 0.833 . . . . 0.0 112.556 178.642 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 2.5 t -68.35 91.51 0.39 Allowed 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 125.614 1.566 . . . . 0.0 110.85 -178.375 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 25.2 p90 -56.48 -36.94 69.69 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 124.167 0.987 . . . . 0.0 111.498 178.996 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 72.7 m-20 -61.82 -33.7 74.6 Favored 'General case' 0 CA--C 1.54 0.592 0 O-C-N 121.878 -0.514 . . . . 0.0 111.597 177.43 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 30.4 t -70.39 -41.21 73.32 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-N 119.678 1.126 . . . . 0.0 110.769 177.254 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 42.0 mt -66.74 -41.11 88.38 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.01 0.924 . . . . 0.0 112.912 176.075 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 32.1 mmmt -81.32 -7.53 59.59 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 125.114 1.365 . . . . 0.0 114.203 -179.302 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 77.61 39.95 23.98 Favored Glycine 0 CA--C 1.537 1.431 0 C-N-CA 124.505 1.05 . . . . 0.0 114.12 178.889 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 50.4 ttp180 -125.98 -16.54 5.57 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 126.758 2.023 . . . . 0.0 114.79 -176.546 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 4.7 t . . . . . 0 CA--C 1.544 0.713 0 CA-C-N 119.448 1.022 . . . . 0.0 113.322 -176.233 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 63.2 m . . . . . 0 CA--C 1.537 0.48 0 N-CA-C 114.506 1.298 . . . . 0.0 114.506 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 19.1 mtmt -80.66 4.0 20.17 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-N 114.916 -1.038 . . . . 0.0 111.459 173.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 65.5 m-85 -125.61 144.94 50.36 Favored 'General case' 0 N--CA 1.447 -0.605 0 C-N-CA 126.416 1.886 . . . . 0.0 110.21 -174.24 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -72.81 117.56 14.66 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 123.817 0.847 . . . . 0.0 112.252 -176.017 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 3.8 m-70 -65.4 123.97 85.82 Favored Pre-proline 0 CA--C 1.546 0.801 0 N-CA-C 105.865 -1.902 . . . . 0.0 105.865 170.328 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -70.02 122.87 9.46 Favored 'Trans proline' 0 CA--C 1.544 0.992 0 C-N-CA 121.946 1.764 . . . . 0.0 113.938 -170.932 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 94.5 Cg_endo -77.82 153.29 29.41 Favored 'Trans proline' 0 CA--C 1.543 0.962 0 C-N-CA 123.264 2.643 . . . . 0.0 112.015 179.261 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 80.6 Cg_exo -45.69 -42.9 19.09 Favored 'Trans proline' 0 CA--C 1.538 0.72 0 C-N-CA 124.319 3.346 . . . . 0.0 115.844 179.883 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 17.4 t-80 -70.77 -15.22 62.66 Favored 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 114.938 1.458 . . . . 0.0 114.938 -179.786 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 81.1 mt -112.55 -18.17 12.46 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 124.562 1.145 . . . . 0.0 112.975 178.622 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 57.4 mtpt -54.09 -35.76 62.45 Favored 'General case' 0 N--CA 1.478 0.941 0 CA-C-N 119.83 1.195 . . . . 0.0 111.593 174.852 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 22.4 m -62.83 -45.63 91.72 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 124.081 0.952 . . . . 0.0 111.374 175.691 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 76.2 mt-30 -64.21 -46.93 81.71 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 123.634 0.774 . . . . 0.0 110.711 177.449 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 92.4 mt -61.42 -45.8 92.77 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 124.205 1.002 . . . . 0.0 112.549 179.244 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 7.5 pt-20 -66.03 -37.01 84.79 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-N 119.91 1.232 . . . . 0.0 111.98 177.972 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 61.9 mt -61.59 -40.74 87.65 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 CA-C-N 119.215 0.916 . . . . 0.0 110.131 176.304 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 79.5 m-20 -67.59 -47.03 70.87 Favored 'General case' 0 CA--C 1.546 0.819 0 O-C-N 121.918 -0.489 . . . . 0.0 110.803 175.477 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.954 0 C-N-CA 125.114 1.34 . . . . 0.0 113.62 -179.278 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.543 0.696 0 N-CA-C 114.743 1.386 . . . . 0.0 114.743 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 83.5 mt -93.12 -18.52 22.49 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 126.362 1.865 . . . . 0.0 114.555 -176.605 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 2.6 m -73.71 75.3 1.56 Allowed 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 124.645 1.178 . . . . 0.0 111.863 -178.847 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -75.65 146.07 40.56 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 128.391 2.676 . . . . 0.0 111.094 -178.456 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 12.0 mt-10 -76.04 153.0 36.76 Favored 'General case' 0 N--CA 1.472 0.667 0 O-C-N 120.215 -1.553 . . . . 0.0 112.835 178.386 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 10.8 m -84.4 154.43 3.63 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.73 0 C-N-CA 122.748 0.419 . . . . 0.0 110.279 173.904 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 48.8 t -71.41 139.18 49.63 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-O 121.23 0.538 . . . . 0.0 110.361 176.609 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 3.8 mpt_? -68.59 -38.39 80.61 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 125.306 1.443 . . . . 0.0 112.452 -177.635 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 17.0 mm-40 -74.63 -33.78 62.64 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 123.918 0.887 . . . . 0.0 110.927 178.489 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 51.1 t80 -64.71 -22.78 67.06 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 123.801 0.841 . . . . 0.0 112.065 175.315 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 76.9 mt-30 -59.12 -22.58 61.09 Favored 'General case' 0 N--CA 1.477 0.882 0 O-C-N 121.568 -0.707 . . . . 0.0 112.872 175.526 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -116.62 14.26 15.41 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 125.741 1.616 . . . . 0.0 111.91 177.24 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 58.36 37.75 88.48 Favored Glycine 0 CA--C 1.534 1.227 0 C-N-CA 125.333 1.444 . . . . 0.0 114.228 -179.61 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 5.5 t -127.73 9.61 6.47 Favored 'General case' 0 N--CA 1.479 1.023 0 N-CA-C 114.632 1.345 . . . . 0.0 114.632 -175.279 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 34.6 t -62.7 134.61 56.57 Favored 'General case' 0 CA--C 1.55 0.947 0 O-C-N 120.927 -1.108 . . . . 0.0 111.021 175.729 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 27.8 m -79.37 2.79 20.34 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 125.69 1.596 . . . . 0.0 115.293 -177.358 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 71.2 mtm-85 -132.62 146.93 63.53 Favored Pre-proline 0 N--CA 1.474 0.775 0 C-N-CA 125.033 1.333 . . . . 0.0 113.733 -174.876 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 95.0 Cg_endo -71.01 166.87 27.75 Favored 'Trans proline' 0 CA--C 1.545 1.047 0 C-N-CA 122.337 2.024 . . . . 0.0 109.792 170.738 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -53.9 -32.4 53.22 Favored 'General case' 0 N--CA 1.477 0.924 0 O-C-N 121.157 -0.965 . . . . 0.0 112.79 177.681 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 26.9 p -71.16 -8.28 52.46 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 125.876 1.671 . . . . 0.0 115.147 178.158 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 20.5 mt-10 -125.14 -25.81 3.77 Favored 'General case' 0 N--CA 1.476 0.854 0 N-CA-C 115.439 1.644 . . . . 0.0 115.439 -177.587 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 4.2 t -70.16 164.23 24.65 Favored 'General case' 0 CA--C 1.548 0.878 0 N-CA-C 115.154 1.539 . . . . 0.0 115.154 -177.01 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 75.0 mmtt -81.31 -10.55 59.55 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 127.272 2.229 . . . . 0.0 113.25 179.949 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 73.7 m-85 -139.15 175.66 9.36 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 126.878 2.071 . . . . 0.0 110.196 179.497 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -86.11 150.13 24.64 Favored 'General case' 0 CA--C 1.546 0.805 0 O-C-N 121.213 -0.93 . . . . 0.0 113.458 -177.655 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 61.5 m170 -122.17 90.62 49.02 Favored Pre-proline 0 CA--C 1.554 1.128 0 C-N-CA 125.573 1.549 . . . . 0.0 111.056 179.222 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 30.8 Cg_endo -62.36 161.35 27.64 Favored 'Trans proline' 0 C--N 1.355 0.878 0 C-N-CA 123.62 2.88 . . . . 0.0 114.878 -178.874 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 52.5 p -113.44 -174.21 2.42 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 125.655 1.582 . . . . 0.0 112.265 177.439 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 58.0 mtmt -52.55 -25.4 10.36 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 126.873 2.069 . . . . 0.0 115.512 178.981 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 42.7 m -109.07 -19.83 13.23 Favored 'General case' 0 N--CA 1.478 0.968 0 N-CA-C 114.827 1.418 . . . . 0.0 114.827 -179.07 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 63.8 m -62.82 133.72 55.16 Favored 'General case' 0 CA--C 1.541 0.611 0 CA-C-N 119.471 1.032 . . . . 0.0 113.419 -179.107 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 35.5 mt-30 -81.92 139.14 34.81 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 123.41 0.684 . . . . 0.0 110.888 175.769 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 12.0 t -131.49 138.71 52.44 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.794 0 C-N-CA 125.413 1.485 . . . . 0.0 110.59 -177.275 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -145.69 132.75 20.33 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 125.093 1.357 . . . . 0.0 111.128 177.879 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 63.1 t30 42.78 37.14 0.97 Allowed 'General case' 0 CA--C 1.552 1.021 0 C-N-CA 126.684 1.994 . . . . 0.0 116.105 177.89 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 84.25 17.18 65.23 Favored Glycine 0 CA--C 1.536 1.402 0 O-C-N 120.998 -1.064 . . . . 0.0 114.848 -179.62 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 64.1 mtt180 -136.48 160.28 39.24 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 125.617 1.567 . . . . 0.0 111.736 -179.546 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 3.2 m -138.79 139.31 41.02 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.491 0 C-N-CA 127.63 2.372 . . . . 0.0 110.392 -176.459 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 59.1 mt -87.19 129.08 39.23 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.78 0 O-C-N 121.118 -0.988 . . . . 0.0 109.716 -179.788 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -75.13 149.87 38.92 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 124.185 0.994 . . . . 0.0 111.74 178.14 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 18.8 t -68.93 99.87 1.12 Allowed 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 124.682 1.193 . . . . 0.0 113.061 -177.045 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 33.2 p90 -61.83 -38.0 86.55 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 115.071 -0.968 . . . . 0.0 110.229 175.064 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 70.0 m-20 -62.22 -44.28 96.93 Favored 'General case' 0 CA--C 1.537 0.452 0 O-C-N 121.755 -0.591 . . . . 0.0 110.612 176.962 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 41.6 t -63.94 -41.79 97.51 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-N 119.631 1.105 . . . . 0.0 111.509 177.516 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 31.3 mt -63.57 -40.53 97.21 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 123.774 0.83 . . . . 0.0 112.875 176.286 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 32.2 mmmt -82.87 -9.07 59.49 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 124.878 1.271 . . . . 0.0 113.845 179.589 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 80.84 38.18 17.01 Favored Glycine 0 CA--C 1.537 1.463 0 C-N-CA 124.722 1.154 . . . . 0.0 114.103 179.571 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 50.3 ttp180 -120.75 -19.47 7.35 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 126.631 1.972 . . . . 0.0 114.83 -176.525 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 4.8 t . . . . . 0 CA--C 1.546 0.796 0 CA-C-N 119.311 0.96 . . . . 0.0 113.562 -177.789 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 7.9 t . . . . . 0 CA--C 1.542 0.67 0 CA-C-O 121.655 0.74 . . . . 0.0 111.465 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 25.7 mtmt -80.46 0.78 32.03 Favored 'General case' 0 N--CA 1.474 0.771 0 N-CA-C 114.007 1.114 . . . . 0.0 114.007 -177.532 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 80.8 m-85 -125.58 154.35 42.36 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 125.127 1.371 . . . . 0.0 111.394 -175.127 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -76.69 113.15 14.02 Favored 'General case' 0 CA--C 1.533 0.312 0 O-C-N 121.654 -0.654 . . . . 0.0 112.265 -176.258 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 8.3 m170 -64.49 127.08 91.9 Favored Pre-proline 0 CA--C 1.545 0.768 0 N-CA-C 106.892 -1.521 . . . . 0.0 106.892 172.48 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 89.7 Cg_endo -72.97 120.73 6.79 Favored 'Trans proline' 0 CA--C 1.546 1.075 0 C-N-CA 122.401 2.067 . . . . 0.0 114.06 -170.757 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 94.3 Cg_endo -77.05 153.41 32.31 Favored 'Trans proline' 0 CA--C 1.544 1.001 0 C-N-CA 123.206 2.604 . . . . 0.0 111.973 178.297 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_exo -46.27 -41.45 22.28 Favored 'Trans proline' 0 CA--C 1.538 0.706 0 C-N-CA 124.156 3.237 . . . . 0.0 115.753 179.449 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 57.3 m80 -72.4 -13.7 61.52 Favored 'General case' 0 N--CA 1.475 0.805 0 N-CA-C 115.181 1.548 . . . . 0.0 115.181 179.605 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 92.1 mt -114.13 -17.21 11.96 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 124.426 1.091 . . . . 0.0 112.949 177.565 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 56.0 mtpt -54.89 -38.91 68.16 Favored 'General case' 0 N--CA 1.478 0.944 0 CA-C-N 119.931 1.241 . . . . 0.0 111.85 174.944 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 4.7 m -63.02 -38.51 91.48 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 123.728 0.811 . . . . 0.0 111.777 176.753 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 92.5 mm-40 -69.95 -49.57 50.49 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 123.175 0.59 . . . . 0.0 109.721 177.638 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 95.4 mt -58.47 -47.04 85.37 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 124.134 0.974 . . . . 0.0 113.056 178.767 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -62.97 -32.25 73.54 Favored 'General case' 0 N--CA 1.475 0.811 0 CA-C-N 119.932 1.242 . . . . 0.0 112.444 178.759 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 57.0 mt -74.73 -42.58 47.63 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.584 0 C-N-CA 123.858 0.863 . . . . 0.0 110.269 175.783 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 26.5 m120 -60.64 -36.17 78.01 Favored 'General case' 0 CA--C 1.543 0.692 0 CA-C-N 119.406 1.003 . . . . 0.0 110.423 174.75 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 1.295 0 C-N-CA 125.18 1.371 . . . . 0.0 113.643 176.56 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 2.5 p90 . . . . . 0 N--CA 1.476 0.857 0 N-CA-C 114.308 1.225 . . . . 0.0 114.308 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 94.8 mt -105.03 -10.13 17.4 Favored 'General case' 0 CA--C 1.539 0.522 0 N-CA-C 116.269 1.952 . . . . 0.0 116.269 -172.263 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 4.0 m -75.01 79.7 2.2 Favored 'General case' 0 N--CA 1.479 1.015 0 CA-C-N 120.474 1.488 . . . . 0.0 112.208 -179.044 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -75.68 144.59 41.53 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 127.066 2.146 . . . . 0.0 112.41 -177.908 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 10.3 mt-10 -74.89 150.96 38.99 Favored 'General case' 0 N--CA 1.474 0.771 0 O-C-N 120.688 -1.258 . . . . 0.0 111.916 176.577 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 15.9 m -82.06 150.89 4.3 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.795 0 N-CA-C 109.816 -0.439 . . . . 0.0 109.816 174.362 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 53.5 t -63.82 130.7 45.23 Favored 'General case' 0 C--O 1.237 0.43 0 CA-C-O 122.552 1.168 . . . . 0.0 111.349 177.671 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 3.3 mpt_? -68.45 -25.3 64.93 Favored 'General case' 0 N--CA 1.465 0.296 0 C-N-CA 124.716 1.207 . . . . 0.0 112.244 -178.582 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -84.21 -37.61 21.6 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 123.125 0.57 . . . . 0.0 110.017 177.303 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 63.5 t80 -62.0 -31.24 71.6 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 124.823 1.249 . . . . 0.0 110.884 174.982 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 12.4 mm100 -62.98 -15.81 57.44 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 123.928 0.891 . . . . 0.0 113.294 175.264 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 6.2 mpt_? -120.32 13.4 11.91 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 126.605 1.962 . . . . 0.0 111.464 177.058 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 57.96 35.82 77.84 Favored Glycine 0 CA--C 1.533 1.197 0 C-N-CA 125.396 1.474 . . . . 0.0 114.375 179.888 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 6.4 t -131.13 11.04 5.0 Favored 'General case' 0 N--CA 1.477 0.91 0 N-CA-C 115.128 1.529 . . . . 0.0 115.128 -175.527 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 44.3 t -60.7 136.57 58.11 Favored 'General case' 0 CA--C 1.548 0.891 0 CA-C-N 119.091 0.86 . . . . 0.0 110.523 176.078 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 80.2 p -93.01 6.37 48.15 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 125.541 1.537 . . . . 0.0 114.394 -178.235 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 57.2 mtm-85 -129.64 151.49 78.14 Favored Pre-proline 0 N--CA 1.474 0.76 0 C-N-CA 125.253 1.421 . . . . 0.0 113.795 -173.946 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 95.1 Cg_endo -74.59 163.88 35.01 Favored 'Trans proline' 0 CA--C 1.542 0.88 0 C-N-CA 122.429 2.086 . . . . 0.0 109.419 172.338 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 -54.62 -28.11 44.29 Favored 'General case' 0 N--CA 1.475 0.821 0 N-CA-C 113.407 0.891 . . . . 0.0 113.407 176.477 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 22.1 p -73.85 -17.43 61.06 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 125.57 1.548 . . . . 0.0 115.126 178.948 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -115.65 -31.08 5.96 Favored 'General case' 0 N--CA 1.478 0.939 0 N-CA-C 114.295 1.22 . . . . 0.0 114.295 -179.277 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 4.7 t -56.77 147.11 23.91 Favored 'General case' 0 CA--C 1.545 0.756 0 CA-C-O 122.735 1.255 . . . . 0.0 113.887 -175.63 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 39.6 mmtm -81.88 4.83 20.92 Favored 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 126.475 1.91 . . . . 0.0 113.145 -177.706 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 75.6 m-85 -143.76 170.18 16.35 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 128.633 2.773 . . . . 0.0 108.631 175.913 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -84.24 153.53 23.55 Favored 'General case' 0 CA--C 1.547 0.863 0 N-CA-C 114.526 1.306 . . . . 0.0 114.526 -177.048 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 65.0 m170 -124.58 90.66 50.61 Favored Pre-proline 0 CA--C 1.55 0.943 0 C-N-CA 126.203 1.801 . . . . 0.0 110.361 178.048 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 34.7 Cg_endo -64.0 148.53 91.56 Favored 'Trans proline' 0 CA--C 1.539 0.754 0 C-N-CA 123.31 2.674 . . . . 0.0 114.483 -177.535 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 52.9 p -86.72 -175.88 5.58 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 125.114 1.366 . . . . 0.0 112.228 175.847 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 58.0 mtmt -60.72 -20.04 60.2 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 125.556 1.542 . . . . 0.0 113.472 173.645 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 49.1 m -109.11 -20.81 12.87 Favored 'General case' 0 N--CA 1.477 0.897 0 N-CA-C 114.436 1.273 . . . . 0.0 114.436 -179.594 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 84.5 m -63.94 134.87 55.89 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 119.498 1.044 . . . . 0.0 113.193 179.878 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 35.7 mt-30 -81.45 142.1 33.27 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 123.181 0.592 . . . . 0.0 111.253 176.669 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 11.8 t -132.34 138.16 52.87 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.865 0 C-N-CA 125.404 1.481 . . . . 0.0 110.573 -177.748 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -146.21 132.66 19.68 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 125.298 1.439 . . . . 0.0 111.391 178.194 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 62.5 t30 41.26 37.94 0.7 Allowed 'General case' 0 CA--C 1.553 1.073 0 C-N-CA 126.99 2.116 . . . . 0.0 116.578 177.16 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 87.77 13.73 64.32 Favored Glycine 0 CA--C 1.535 1.335 0 O-C-N 120.997 -1.064 . . . . 0.0 115.188 179.777 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 56.0 mtt180 -136.56 164.16 28.85 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 125.421 1.488 . . . . 0.0 111.432 179.39 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 5.2 m -134.34 176.81 8.0 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 C-N-CA 129.127 2.971 . . . . 0.0 107.493 179.623 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 59.1 mt -126.71 130.07 71.57 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.833 0 CA-C-N 119.78 1.173 . . . . 0.0 108.786 179.589 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -73.04 147.62 44.89 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 123.758 0.823 . . . . 0.0 111.931 177.873 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 13.9 t -69.75 99.37 1.34 Allowed 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 125.067 1.347 . . . . 0.0 113.35 -176.432 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 26.4 p90 -61.92 -37.94 86.56 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 115.191 -0.913 . . . . 0.0 110.013 174.34 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 70.3 m-20 -61.44 -43.09 99.47 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 123.099 0.559 . . . . 0.0 110.851 177.193 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 44.6 t -64.66 -43.23 94.26 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-N 119.506 1.048 . . . . 0.0 111.566 177.911 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 34.3 mt -65.39 -36.99 85.65 Favored 'General case' 0 CA--C 1.542 0.665 0 N-CA-C 113.378 0.881 . . . . 0.0 113.378 177.124 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 29.7 mmmt -88.17 -5.62 58.32 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 125.197 1.399 . . . . 0.0 114.509 -178.32 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 81.02 39.84 12.48 Favored Glycine 0 CA--C 1.536 1.38 0 C-N-CA 124.506 1.05 . . . . 0.0 114.384 178.221 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 71.9 ttt-85 -123.64 -21.52 5.21 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 126.546 1.939 . . . . 0.0 114.695 -176.63 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 5.5 t . . . . . 0 CA--C 1.545 0.765 0 CA-C-N 119.431 1.014 . . . . 0.0 113.387 -177.396 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 9.0 t . . . . . 0 CA--C 1.544 0.744 0 CA-C-O 121.531 0.681 . . . . 0.0 111.607 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 31.8 mtmt -84.17 2.33 40.21 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 124.62 1.168 . . . . 0.0 113.63 -177.87 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 84.4 m-85 -125.08 154.36 41.5 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 125.384 1.473 . . . . 0.0 111.908 -175.521 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -78.07 114.72 17.22 Favored 'General case' 0 N--CA 1.465 0.318 0 C-N-CA 123.989 0.915 . . . . 0.0 112.155 -176.619 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 11.0 m170 -70.2 115.17 31.73 Favored Pre-proline 0 CA--C 1.546 0.8 0 N-CA-C 108.094 -1.076 . . . . 0.0 108.094 174.654 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 81.1 Cg_exo -48.89 114.07 1.12 Allowed 'Trans proline' 0 CA--C 1.543 0.928 0 C-N-CA 124.621 3.547 . . . . 0.0 116.794 -174.757 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_endo -77.02 155.78 33.9 Favored 'Trans proline' 0 CA--C 1.546 1.114 0 C-N-CA 122.658 2.238 . . . . 0.0 111.479 175.965 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 92.9 Cg_exo -43.58 -45.79 10.44 Favored 'Trans proline' 0 CA--C 1.539 0.73 0 C-N-CA 124.861 3.707 . . . . 0.0 116.531 -179.777 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -73.53 -12.61 60.83 Favored 'General case' 0 N--CA 1.478 0.971 0 N-CA-C 114.676 1.362 . . . . 0.0 114.676 -179.431 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 87.0 mt -112.64 -19.56 12.02 Favored 'General case' 0 N--CA 1.475 0.789 0 CA-C-N 119.458 1.026 . . . . 0.0 113.71 -179.717 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 54.3 mtpt -52.69 -39.66 62.17 Favored 'General case' 0 N--CA 1.48 1.035 0 CA-C-N 119.908 1.231 . . . . 0.0 111.426 174.252 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 24.7 m -63.19 -41.59 99.21 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 124.781 1.232 . . . . 0.0 111.92 176.926 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 16.9 mm100 -68.57 -44.39 74.54 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 123.56 0.744 . . . . 0.0 110.521 179.206 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 81.0 mt -62.31 -46.63 87.89 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 123.376 0.67 . . . . 0.0 112.235 177.769 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -64.21 -29.78 70.87 Favored 'General case' 0 N--CA 1.476 0.854 0 CA-C-N 120.361 1.437 . . . . 0.0 113.106 178.147 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 63.9 mt -71.15 -44.88 73.77 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.69 0 O-C-N 121.354 -0.841 . . . . 0.0 109.242 174.854 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 75.7 m-20 -62.15 -36.72 82.68 Favored 'General case' 0 CA--C 1.542 0.639 0 O-C-N 121.644 -0.66 . . . . 0.0 110.955 175.773 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.93 0 C-N-CA 124.513 1.054 . . . . 0.0 111.494 177.95 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.476 0.858 0 CA-C-O 120.804 0.335 . . . . 0.0 111.29 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 92.5 mt -89.76 -8.45 52.17 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 126.615 1.966 . . . . 0.0 114.268 -179.146 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 18.2 m -81.15 80.52 7.59 Favored 'General case' 0 N--CA 1.475 0.781 0 CA-C-O 122.13 0.966 . . . . 0.0 110.477 -178.625 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -75.77 145.21 40.95 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 128.613 2.765 . . . . 0.0 111.983 -178.232 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 52.8 mt-10 -72.33 150.99 43.02 Favored 'General case' 0 N--CA 1.47 0.564 0 O-C-N 120.487 -1.383 . . . . 0.0 112.615 176.899 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 16.8 m -86.69 156.49 3.3 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.971 0 C-N-CA 123.506 0.723 . . . . 0.0 111.418 174.359 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 49.1 t -77.66 129.69 35.88 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-O 121.607 0.718 . . . . 0.0 110.649 177.238 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 4.2 mpt_? -66.64 -28.99 68.92 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 124.418 1.087 . . . . 0.0 113.247 -177.462 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -78.13 -40.21 38.83 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 123.443 0.697 . . . . 0.0 109.518 177.79 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 64.3 t80 -63.24 -35.07 79.11 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 124.486 1.115 . . . . 0.0 111.298 175.957 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 13.8 mm100 -62.12 -15.31 44.65 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 124.227 1.011 . . . . 0.0 113.38 175.424 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 11.8 mtp-105 -120.76 12.67 11.41 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 127.233 2.213 . . . . 0.0 112.28 179.569 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 57.99 34.69 73.15 Favored Glycine 0 CA--C 1.536 1.354 0 C-N-CA 125.086 1.327 . . . . 0.0 113.9 -179.771 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 7.3 t -129.88 13.36 5.8 Favored 'General case' 0 N--CA 1.475 0.801 0 N-CA-C 114.906 1.447 . . . . 0.0 114.906 -175.196 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 6.5 t -69.53 171.7 8.45 Favored 'General case' 0 CA--C 1.556 1.182 0 O-C-N 121.413 -0.804 . . . . 0.0 110.542 173.823 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 50.7 m -135.45 13.57 3.49 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 125.059 1.344 . . . . 0.0 114.457 -176.796 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 51.0 mtt85 -135.45 145.97 55.81 Favored Pre-proline 0 N--CA 1.47 0.553 0 C-N-CA 125.301 1.44 . . . . 0.0 112.756 -176.349 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_endo -69.69 165.34 31.21 Favored 'Trans proline' 0 CA--C 1.545 1.06 0 C-N-CA 121.943 1.762 . . . . 0.0 109.744 171.323 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -54.6 -30.25 54.09 Favored 'General case' 0 N--CA 1.477 0.91 0 O-C-N 121.124 -0.985 . . . . 0.0 112.678 177.882 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 29.9 p -72.37 -8.43 54.93 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 126.268 1.827 . . . . 0.0 115.135 177.792 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 27.0 mm-40 -124.61 -24.86 4.1 Favored 'General case' 0 N--CA 1.476 0.868 0 N-CA-C 115.53 1.678 . . . . 0.0 115.53 -175.993 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 1.4 t -73.45 170.33 15.34 Favored 'General case' 0 CA--C 1.545 0.753 0 N-CA-C 115.361 1.615 . . . . 0.0 115.361 -175.921 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 13.0 mmmm -85.24 -13.16 50.74 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 126.807 2.043 . . . . 0.0 113.285 -179.377 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 56.7 m-85 -140.02 174.86 10.09 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 126.761 2.025 . . . . 0.0 109.598 179.001 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -83.65 151.04 25.51 Favored 'General case' 0 CA--C 1.545 0.784 0 N-CA-C 114.177 1.177 . . . . 0.0 114.177 -177.034 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 64.2 m170 -121.86 87.27 46.59 Favored Pre-proline 0 CA--C 1.553 1.068 0 C-N-CA 126.158 1.783 . . . . 0.0 110.888 179.572 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 39.5 Cg_endo -64.4 150.54 88.08 Favored 'Trans proline' 0 CA--C 1.54 0.808 0 C-N-CA 123.568 2.845 . . . . 0.0 114.912 -177.797 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 53.4 p -88.01 -174.93 4.9 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 124.945 1.298 . . . . 0.0 111.985 175.578 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 63.0 mttp -62.01 -18.67 61.28 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 125.523 1.529 . . . . 0.0 113.368 173.421 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 25.1 m -109.12 -22.4 12.14 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.917 1.287 . . . . 0.0 114.153 -179.079 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 89.6 m -63.58 138.35 58.47 Favored 'General case' 0 CA--C 1.542 0.651 0 CA-C-N 119.394 0.997 . . . . 0.0 113.175 179.586 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 16.3 mt-30 -80.66 136.2 36.17 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 124.663 1.185 . . . . 0.0 111.466 179.004 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 9.2 t -129.75 136.25 59.49 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.816 0 C-N-CA 124.958 1.303 . . . . 0.0 110.913 -178.084 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -146.99 131.8 18.01 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 125.286 1.435 . . . . 0.0 111.79 178.185 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 62.5 t30 39.46 39.3 0.47 Allowed 'General case' 0 CA--C 1.554 1.106 0 C-N-CA 127.28 2.232 . . . . 0.0 116.863 176.63 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 90.58 11.55 62.11 Favored Glycine 0 CA--C 1.536 1.374 0 O-C-N 121.101 -1.0 . . . . 0.0 115.393 179.465 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 42.1 mtm180 -136.17 164.9 26.98 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 125.53 1.532 . . . . 0.0 112.358 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 5.2 m -137.2 151.21 26.64 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.642 0 C-N-CA 128.12 2.568 . . . . 0.0 109.135 -179.93 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 17.2 mt -100.5 130.68 49.38 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.78 0 O-C-N 121.191 -0.943 . . . . 0.0 110.181 -178.306 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -78.31 149.79 33.41 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 123.946 0.898 . . . . 0.0 111.99 178.637 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 19.2 t -71.79 99.21 2.12 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 125.242 1.417 . . . . 0.0 113.039 -176.362 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 24.3 p90 -60.88 -36.83 80.21 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 123.574 0.75 . . . . 0.0 110.514 174.76 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 73.6 m-20 -61.3 -38.24 86.1 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 123.397 0.679 . . . . 0.0 111.199 177.338 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 31.2 p -64.72 -41.37 96.02 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 119.5 1.045 . . . . 0.0 112.216 178.058 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 38.5 mt -69.7 -40.74 76.13 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 124.575 1.15 . . . . 0.0 112.04 177.613 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 30.9 mmmt -76.31 -11.87 59.98 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 124.464 1.106 . . . . 0.0 113.71 178.482 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 78.5 35.75 31.96 Favored Glycine 0 CA--C 1.537 1.457 0 C-N-CA 124.563 1.078 . . . . 0.0 113.43 -179.508 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 50.8 ttp180 -116.66 -19.85 9.8 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 126.623 1.969 . . . . 0.0 114.378 -176.67 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 5.1 t . . . . . 0 CA--C 1.545 0.784 0 CA-C-N 119.078 0.854 . . . . 0.0 112.949 -177.879 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 4.2 t . . . . . 0 CA--C 1.542 0.647 0 CA-C-O 122.038 0.923 . . . . 0.0 112.518 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 33.8 mtmt -84.88 6.97 22.61 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 125.556 1.542 . . . . 0.0 113.636 -177.399 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 84.8 m-85 -129.14 151.88 49.33 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 125.192 1.397 . . . . 0.0 112.258 -174.589 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -77.2 118.61 19.88 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 123.723 0.809 . . . . 0.0 112.096 -176.992 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 11.2 m170 -71.4 115.91 41.96 Favored Pre-proline 0 CA--C 1.548 0.876 0 N-CA-C 108.045 -1.094 . . . . 0.0 108.045 174.381 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_exo -47.3 112.18 0.5 Allowed 'Trans proline' 0 CA--C 1.543 0.969 0 C-N-CA 125.015 3.81 . . . . 0.0 115.507 -176.231 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -75.68 148.82 33.19 Favored 'Trans proline' 0 CA--C 1.542 0.887 0 C-N-CA 122.052 1.835 . . . . 0.0 110.366 176.866 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_exo -47.32 -37.64 25.1 Favored 'Trans proline' 0 CA--C 1.539 0.748 0 C-N-CA 123.723 2.949 . . . . 0.0 115.193 179.433 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 6.8 t-80 -72.04 -16.94 62.05 Favored 'General case' 0 N--CA 1.472 0.659 0 N-CA-C 115.177 1.547 . . . . 0.0 115.177 179.778 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 90.9 mt -115.22 -15.78 11.6 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 124.735 1.214 . . . . 0.0 112.898 177.791 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 52.9 mtpt -53.98 -34.36 59.58 Favored 'General case' 0 N--CA 1.475 0.78 0 CA-C-N 119.662 1.119 . . . . 0.0 111.384 174.37 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 27.5 m -61.82 -47.13 86.47 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-N 118.723 0.692 . . . . 0.0 111.462 175.381 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 93.3 mm-40 -66.23 -43.56 86.28 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 123.772 0.829 . . . . 0.0 111.316 178.04 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 76.3 mt -62.53 -45.49 92.75 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 123.896 0.879 . . . . 0.0 111.984 178.085 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 5.3 pt-20 -66.11 -36.48 83.27 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-N 119.459 1.027 . . . . 0.0 112.153 177.859 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 51.2 mt -61.11 -39.84 83.75 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 CA-C-N 119.509 1.05 . . . . 0.0 110.386 177.193 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 29.4 m-80 -70.76 -43.5 68.66 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 123.216 0.606 . . . . 0.0 111.4 175.436 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.533 1.179 0 C-N-CA 124.242 0.925 . . . . 0.0 113.71 -179.665 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.542 0.666 0 N-CA-C 113.814 1.042 . . . . 0.0 113.814 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 82.6 mt -91.77 -16.6 26.6 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 127.021 2.128 . . . . 0.0 114.994 -176.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 7.0 m -77.41 77.14 3.94 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 124.314 1.046 . . . . 0.0 111.543 -177.096 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 13.0 tp -75.62 143.76 42.11 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 128.757 2.823 . . . . 0.0 112.007 -178.375 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 10.1 mt-10 -73.32 150.5 41.85 Favored 'General case' 0 N--CA 1.474 0.743 0 O-C-N 120.448 -1.407 . . . . 0.0 112.886 178.788 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 16.0 m -84.48 154.66 3.62 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.838 0 C-N-CA 122.805 0.442 . . . . 0.0 111.673 176.256 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 44.8 t -74.98 131.02 40.35 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-O 121.192 0.52 . . . . 0.0 109.829 175.316 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 4.5 mpt_? -68.29 -37.34 80.55 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 125.623 1.569 . . . . 0.0 112.976 -176.836 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 15.9 mm-40 -76.65 -33.54 58.31 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 123.848 0.859 . . . . 0.0 111.151 179.334 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 78.3 t80 -63.3 -27.79 69.57 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 123.964 0.906 . . . . 0.0 111.287 174.923 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 52.9 mm-40 -63.59 -19.6 64.97 Favored 'General case' 0 N--CA 1.476 0.858 0 N-CA-C 112.855 0.687 . . . . 0.0 112.855 175.307 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 6.7 mpt_? -111.85 10.67 20.76 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 126.404 1.882 . . . . 0.0 111.645 177.008 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 58.05 36.34 80.97 Favored Glycine 0 CA--C 1.534 1.26 0 C-N-CA 125.542 1.544 . . . . 0.0 114.216 -179.879 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 6.1 t -132.54 13.46 4.51 Favored 'General case' 0 N--CA 1.479 0.983 0 N-CA-C 115.143 1.534 . . . . 0.0 115.143 -175.031 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 39.6 t -59.9 131.77 51.88 Favored 'General case' 0 CA--C 1.55 0.967 0 O-C-N 121.379 -0.825 . . . . 0.0 111.157 176.984 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 21.8 m -73.95 1.89 9.81 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 125.985 1.714 . . . . 0.0 115.217 -177.347 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 63.4 mtm-85 -132.49 148.67 70.55 Favored Pre-proline 0 N--CA 1.474 0.75 0 C-N-CA 125.657 1.583 . . . . 0.0 112.867 -175.466 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -67.81 162.21 40.54 Favored 'Trans proline' 0 CA--C 1.542 0.923 0 C-N-CA 121.92 1.747 . . . . 0.0 109.425 171.674 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 17.2 m-20 -53.45 -25.44 16.1 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 125.025 1.33 . . . . 0.0 114.205 -177.437 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 16.8 p -83.84 -12.75 55.12 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 127.342 2.257 . . . . 0.0 115.317 178.855 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 16.2 mt-10 -111.5 -22.77 11.1 Favored 'General case' 0 N--CA 1.478 0.943 0 N-CA-C 115.291 1.589 . . . . 0.0 115.291 -176.835 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 3.8 t -66.92 164.85 16.63 Favored 'General case' 0 CA--C 1.545 0.769 0 N-CA-C 114.059 1.133 . . . . 0.0 114.059 -178.571 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 44.1 mmtm -100.58 6.66 44.22 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 126.541 1.937 . . . . 0.0 113.6 -176.94 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 51.9 m-85 -141.3 167.57 21.86 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 127.64 2.376 . . . . 0.0 108.448 173.503 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -80.08 148.04 31.19 Favored 'General case' 0 CA--C 1.544 0.75 0 O-C-N 120.94 -1.1 . . . . 0.0 113.584 -176.372 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 20.6 m170 -120.27 87.86 40.79 Favored Pre-proline 0 CA--C 1.554 1.097 0 C-N-CA 125.79 1.636 . . . . 0.0 110.563 -179.366 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -59.67 146.08 96.35 Favored 'Trans proline' 0 C--N 1.354 0.863 0 C-N-CA 123.442 2.761 . . . . 0.0 114.871 -178.032 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 48.1 p -82.86 -178.78 7.23 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 124.305 1.042 . . . . 0.0 112.474 175.942 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -59.8 -19.85 53.19 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 125.698 1.599 . . . . 0.0 113.599 173.934 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 51.8 m -109.23 -15.59 14.25 Favored 'General case' 0 N--CA 1.476 0.828 0 N-CA-C 114.888 1.44 . . . . 0.0 114.888 -179.259 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 78.8 m -65.67 159.52 24.76 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-N 119.896 1.225 . . . . 0.0 114.046 179.459 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 41.1 mt-30 -119.37 140.81 49.76 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 125.257 1.423 . . . . 0.0 111.063 178.15 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 1.1 m -131.79 149.87 33.29 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.576 0 C-N-CA 125.118 1.367 . . . . 0.0 112.546 -177.388 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 -144.59 139.13 27.92 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 125.929 1.692 . . . . 0.0 110.455 176.445 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 89.4 m-20 45.54 34.83 1.77 Allowed 'General case' 0 CA--C 1.554 1.124 0 N-CA-C 115.464 1.653 . . . . 0.0 115.464 176.18 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 81.07 19.81 66.41 Favored Glycine 0 CA--C 1.536 1.359 0 C-N-CA 124.243 0.925 . . . . 0.0 114.781 -179.363 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 44.3 mtt180 -137.33 160.83 37.94 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 125.145 1.378 . . . . 0.0 112.311 -179.067 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 3.3 m -137.41 142.63 36.39 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.648 0 C-N-CA 127.817 2.447 . . . . 0.0 109.972 -177.075 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 43.4 mt -91.26 126.34 43.94 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.567 0 O-C-N 121.386 -0.821 . . . . 0.0 109.871 -178.504 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -70.05 146.15 51.19 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 123.954 0.901 . . . . 0.0 111.334 177.689 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 29.4 t -67.08 100.22 0.74 Allowed 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 124.675 1.19 . . . . 0.0 112.244 -178.122 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 32.9 p90 -61.3 -37.8 84.51 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 115.017 -0.992 . . . . 0.0 110.017 175.557 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 70.9 m-20 -61.89 -44.63 96.41 Favored 'General case' 0 CA--C 1.539 0.55 0 O-C-N 121.8 -0.562 . . . . 0.0 110.475 176.746 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 43.3 t -63.57 -46.11 87.36 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 119.748 1.158 . . . . 0.0 111.247 177.763 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 34.4 mt -61.16 -40.75 95.02 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 124.059 0.944 . . . . 0.0 113.42 176.759 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 31.3 mmmt -81.23 -12.88 59.01 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 124.78 1.232 . . . . 0.0 113.746 179.297 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 85.66 38.08 9.07 Favored Glycine 0 CA--C 1.539 1.539 0 C-N-CA 124.681 1.134 . . . . 0.0 114.336 179.438 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 47.8 ttp180 -121.86 -20.76 6.28 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 126.716 2.006 . . . . 0.0 114.764 -176.705 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 5.0 t . . . . . 0 CA--C 1.544 0.742 0 CA-C-N 119.442 1.019 . . . . 0.0 113.349 -177.835 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 7.8 t . . . . . 0 CA--C 1.544 0.733 0 CA-C-O 121.219 0.533 . . . . 0.0 111.272 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 27.0 mtmt -83.47 0.83 44.62 Favored 'General case' 0 N--CA 1.477 0.899 0 N-CA-C 113.731 1.011 . . . . 0.0 113.731 -177.856 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 84.7 m-85 -122.82 154.0 38.81 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 125.203 1.401 . . . . 0.0 111.438 -175.778 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -75.56 112.32 11.78 Favored 'General case' 0 CA--C 1.531 0.242 0 N-CA-C 113.513 0.931 . . . . 0.0 113.513 -175.548 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 12.0 m170 -69.05 117.36 51.04 Favored Pre-proline 0 CA--C 1.545 0.777 0 N-CA-C 105.111 -2.181 . . . . 0.0 105.111 169.972 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -71.41 132.51 20.84 Favored 'Trans proline' 0 CA--C 1.541 0.849 0 C-N-CA 121.821 1.68 . . . . 0.0 114.719 -169.948 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 86.7 Cg_endo -77.16 153.88 32.24 Favored 'Trans proline' 0 CA--C 1.544 0.979 0 C-N-CA 123.39 2.727 . . . . 0.0 111.501 178.18 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 98.6 Cg_exo -44.81 -39.96 14.25 Favored 'Trans proline' 0 CA--C 1.539 0.771 0 C-N-CA 124.561 3.507 . . . . 0.0 116.11 179.902 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 72.7 m80 -73.4 -14.38 61.26 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 115.138 1.533 . . . . 0.0 115.138 179.796 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 92.8 mt -116.04 -16.29 11.07 Favored 'General case' 0 N--CA 1.474 0.725 0 C-N-CA 124.817 1.247 . . . . 0.0 113.383 179.814 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 61.2 mtpt -54.5 -36.68 64.45 Favored 'General case' 0 N--CA 1.48 1.033 0 CA-C-N 119.572 1.078 . . . . 0.0 111.11 172.569 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 19.6 m -63.97 -42.73 97.16 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 124.644 1.178 . . . . 0.0 111.65 176.211 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 89.9 mm-40 -66.85 -43.73 82.85 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 123.543 0.737 . . . . 0.0 110.51 178.827 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 93.8 mt -63.32 -43.46 97.73 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-O 118.405 -0.807 . . . . 0.0 112.401 177.378 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -65.81 -35.81 81.73 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-N 120.339 1.427 . . . . 0.0 111.827 176.58 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 66.7 mt -62.48 -42.48 95.87 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.845 0 CA-C-N 119.034 0.834 . . . . 0.0 109.677 175.25 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 82.4 m-20 -63.92 -44.49 92.74 Favored 'General case' 0 CA--C 1.544 0.743 0 O-C-N 121.658 -0.651 . . . . 0.0 110.537 174.927 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.865 0 C-N-CA 125.328 1.442 . . . . 0.0 112.452 179.294 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.476 0.867 0 N-CA-C 113.982 1.105 . . . . 0.0 113.982 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 65.4 mt -98.44 -11.92 21.88 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 126.344 1.858 . . . . 0.0 115.454 -175.479 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 4.8 m -77.09 75.66 3.66 Favored 'General case' 0 N--CA 1.478 0.944 0 CA-C-O 122.366 1.079 . . . . 0.0 110.949 -179.788 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 12.2 tp -75.98 143.24 41.64 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 128.027 2.531 . . . . 0.0 112.455 -177.757 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -68.44 148.78 50.14 Favored 'General case' 0 N--CA 1.474 0.755 0 O-C-N 120.729 -1.232 . . . . 0.0 112.255 177.578 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 20.9 m -82.68 149.95 4.48 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.827 0 C-N-CA 122.927 0.491 . . . . 0.0 110.286 173.142 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.406 ' HB2' ' CE1' ' A' ' 38' ' ' HIS . 48.1 t -67.31 123.4 20.24 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-O 122.352 1.073 . . . . 0.0 111.463 178.071 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 2.7 mpt_? -64.39 -28.74 69.89 Favored 'General case' 0 N--CA 1.467 0.41 0 C-N-CA 124.965 1.306 . . . . 0.0 113.372 -175.903 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 11.5 mm-40 -82.93 -38.87 22.2 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 123.18 0.592 . . . . 0.0 110.138 177.839 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 81.1 t80 -61.65 -31.98 72.12 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 124.669 1.188 . . . . 0.0 111.042 174.772 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 12.6 mm100 -61.56 -16.86 51.81 Favored 'General case' 0 CA--C 1.545 0.771 0 N-CA-C 113.429 0.9 . . . . 0.0 113.429 175.698 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 5.6 mpt_? -121.69 14.04 10.88 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 126.338 1.855 . . . . 0.0 111.727 177.737 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 58.61 36.1 83.9 Favored Glycine 0 CA--C 1.535 1.289 0 C-N-CA 125.16 1.362 . . . . 0.0 114.183 -179.984 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 6.9 t -128.63 16.73 6.42 Favored 'General case' 0 N--CA 1.477 0.896 0 N-CA-C 114.489 1.292 . . . . 0.0 114.489 -176.005 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 9.1 t -67.31 173.98 3.58 Favored 'General case' 0 CA--C 1.558 1.264 0 O-C-N 121.633 -0.667 . . . . 0.0 110.858 173.985 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 90.7 p -136.24 9.43 3.22 Favored 'General case' 0 N--CA 1.477 0.902 0 N-CA-C 115.359 1.614 . . . . 0.0 115.359 -176.241 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 65.6 mtm-85 -132.69 153.61 81.16 Favored Pre-proline 0 N--CA 1.475 0.793 0 C-N-CA 125.941 1.696 . . . . 0.0 112.13 -178.449 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_endo -73.51 161.81 41.45 Favored 'Trans proline' 0 CA--C 1.541 0.827 0 C-N-CA 122.0 1.8 . . . . 0.0 109.109 173.109 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 -53.9 -28.44 36.55 Favored 'General case' 0 N--CA 1.473 0.709 0 N-CA-C 113.241 0.83 . . . . 0.0 113.241 177.69 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 27.2 p -72.1 -20.16 61.69 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 125.933 1.693 . . . . 0.0 115.069 178.887 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -114.84 -30.7 6.35 Favored 'General case' 0 N--CA 1.477 0.892 0 N-CA-C 114.295 1.221 . . . . 0.0 114.295 -178.014 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . 0.406 ' HB3' ' CE1' ' A' ' 38' ' ' HIS . 3.1 t -59.04 158.1 9.11 Favored 'General case' 0 CA--C 1.549 0.905 0 N-CA-C 114.675 1.361 . . . . 0.0 114.675 -175.654 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 36.7 mmtm -86.89 -0.31 56.28 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 126.773 2.029 . . . . 0.0 115.102 -173.095 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 75.3 m-85 -144.29 168.41 20.15 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 127.015 2.126 . . . . 0.0 109.388 175.692 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -73.7 150.69 41.06 Favored 'General case' 0 CA--C 1.548 0.871 0 O-C-N 120.414 -1.428 . . . . 0.0 113.842 -177.052 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . 0.406 ' CE1' ' HB2' ' A' ' 19' ' ' CYS . 7.1 m80 -127.33 84.16 64.15 Favored Pre-proline 0 CA--C 1.55 0.945 0 C-N-CA 125.451 1.5 . . . . 0.0 110.782 -177.415 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 35.2 Cg_endo -63.87 150.44 88.41 Favored 'Trans proline' 0 C--N 1.353 0.779 0 C-N-CA 123.636 2.891 . . . . 0.0 115.146 -177.078 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 54.1 p -89.35 -176.25 5.01 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 125.109 1.363 . . . . 0.0 111.695 174.536 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 60.9 mtpt -59.6 -21.9 61.05 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 125.516 1.526 . . . . 0.0 113.605 174.274 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 40.0 m -109.14 -16.13 14.16 Favored 'General case' 0 N--CA 1.477 0.923 0 N-CA-C 114.716 1.376 . . . . 0.0 114.716 -179.346 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 92.3 m -64.88 136.28 56.68 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-N 119.465 1.03 . . . . 0.0 112.218 179.462 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 42.0 tt0 -81.53 126.3 31.52 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 124.669 1.188 . . . . 0.0 110.502 179.165 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 18.7 t -119.75 134.65 62.59 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.941 0 C-N-CA 125.927 1.691 . . . . 0.0 109.688 -178.37 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -144.06 130.17 19.61 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 125.128 1.371 . . . . 0.0 111.331 -179.057 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 61.9 t30 42.75 37.01 0.93 Allowed 'General case' 0 CA--C 1.553 1.082 0 C-N-CA 126.989 2.115 . . . . 0.0 116.526 177.885 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 88.1 14.35 62.62 Favored Glycine 0 CA--C 1.536 1.35 0 O-C-N 121.103 -0.998 . . . . 0.0 114.929 179.653 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 31.1 mtt180 -138.52 167.56 21.67 Favored 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 126.101 1.76 . . . . 0.0 111.95 -179.57 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 4.4 m -140.03 146.56 24.71 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.571 0 C-N-CA 127.119 2.167 . . . . 0.0 108.911 -179.892 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 26.1 mt -95.72 127.98 47.3 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.814 0 O-C-N 121.108 -0.995 . . . . 0.0 109.611 -179.071 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -73.27 151.66 41.28 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 123.462 0.705 . . . . 0.0 111.683 177.44 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 13.2 t -73.46 98.87 2.85 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 124.421 1.089 . . . . 0.0 113.064 -176.881 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 30.0 p90 -61.66 -38.22 86.95 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 123.942 0.897 . . . . 0.0 110.139 174.843 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 66.1 m-20 -61.08 -42.38 98.39 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 123.011 0.524 . . . . 0.0 110.509 176.978 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 47.6 t -64.4 -42.37 96.14 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-N 119.519 1.054 . . . . 0.0 111.441 177.425 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 31.0 mt -63.73 -40.38 96.59 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 123.763 0.825 . . . . 0.0 112.921 176.399 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 31.4 mmmt -81.35 -9.46 59.74 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 124.763 1.225 . . . . 0.0 114.017 179.486 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 79.41 37.16 24.86 Favored Glycine 0 CA--C 1.536 1.4 0 C-N-CA 124.477 1.037 . . . . 0.0 113.525 -179.644 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 72.8 ttt-85 -117.19 -24.02 7.66 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 127.163 2.185 . . . . 0.0 113.966 -176.826 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 5.8 t . . . . . 0 CA--C 1.544 0.716 0 CA-C-O 121.768 0.794 . . . . 0.0 112.734 -177.92 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 7.4 t . . . . . 0 CA--C 1.543 0.68 0 CA-C-O 121.58 0.705 . . . . 0.0 111.876 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 30.4 mtmt -85.25 1.28 48.92 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 124.578 1.151 . . . . 0.0 113.308 -178.558 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 87.3 m-85 -115.13 147.65 39.98 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 124.191 0.997 . . . . 0.0 111.469 -175.402 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -73.42 112.79 9.82 Favored 'General case' 0 N--CA 1.465 0.287 0 C-N-CA 123.473 0.709 . . . . 0.0 111.9 -176.18 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 12.1 m170 -68.71 114.02 19.74 Favored Pre-proline 0 CA--C 1.547 0.831 0 N-CA-C 107.487 -1.301 . . . . 0.0 107.487 174.285 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 67.7 Cg_exo -47.93 112.56 0.59 Allowed 'Trans proline' 0 CA--C 1.543 0.943 0 C-N-CA 124.842 3.694 . . . . 0.0 117.153 -173.691 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -76.69 153.55 34.03 Favored 'Trans proline' 0 CA--C 1.547 1.149 0 C-N-CA 122.068 1.845 . . . . 0.0 111.734 176.215 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 81.4 Cg_exo -42.27 -49.52 6.02 Favored 'Trans proline' 0 CA--C 1.539 0.73 0 C-N-CA 125.046 3.831 . . . . 0.0 116.823 -179.059 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 1.7 t60 -66.8 -29.94 70.01 Favored 'General case' 0 N--CA 1.478 0.954 0 N-CA-C 113.585 0.957 . . . . 0.0 113.585 -179.393 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 85.5 mt -93.64 -21.35 19.44 Favored 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 114.026 1.121 . . . . 0.0 114.026 -178.058 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 54.1 mtpt -53.5 -38.87 64.12 Favored 'General case' 0 N--CA 1.48 1.037 0 CA-C-N 120.204 1.366 . . . . 0.0 111.611 175.397 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 29.7 m -62.73 -43.98 97.4 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 124.937 1.295 . . . . 0.0 111.561 175.855 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 94.5 mm-40 -66.21 -43.04 87.86 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 123.622 0.769 . . . . 0.0 110.933 178.33 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 88.1 mt -62.02 -50.44 72.02 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 123.876 0.87 . . . . 0.0 111.554 177.632 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -62.61 -28.85 70.18 Favored 'General case' 0 N--CA 1.476 0.843 0 CA-C-N 120.025 1.284 . . . . 0.0 113.489 178.919 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 61.2 mt -70.23 -43.59 78.53 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.727 0 C-N-CA 123.723 0.809 . . . . 0.0 109.743 174.892 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 24.8 m-80 -66.2 -35.97 81.84 Favored 'General case' 0 CA--C 1.542 0.647 0 O-C-N 121.352 -0.842 . . . . 0.0 110.958 175.453 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.532 1.109 0 C-N-CA 124.487 1.041 . . . . 0.0 112.158 177.247 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.542 0.669 0 N-CA-C 113.473 0.916 . . . . 0.0 113.473 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 95.0 mt -91.67 -14.92 29.28 Favored 'General case' 0 N--CA 1.467 0.376 0 C-N-CA 126.064 1.746 . . . . 0.0 114.429 -177.802 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 12.8 m -75.83 78.93 2.75 Favored 'General case' 0 N--CA 1.475 0.791 0 CA-C-N 119.508 1.049 . . . . 0.0 110.785 -179.208 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 10.6 tp -75.52 141.42 43.03 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 128.021 2.528 . . . . 0.0 111.985 -176.352 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 53.0 mt-10 -71.77 151.32 43.62 Favored 'General case' 0 N--CA 1.472 0.642 0 O-C-N 120.933 -1.104 . . . . 0.0 112.452 178.623 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 16.9 m -86.71 156.54 3.29 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.904 0 C-N-CA 123.107 0.563 . . . . 0.0 111.201 174.487 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 42.2 t -75.89 132.09 40.09 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-O 121.725 0.774 . . . . 0.0 110.677 176.685 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 3.8 mpt_? -66.62 -28.17 68.28 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 124.641 1.176 . . . . 0.0 113.167 -177.79 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -84.47 -36.13 22.49 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 118.36 0.527 . . . . 0.0 110.415 178.62 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 59.1 t80 -62.69 -31.28 72.14 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 123.686 0.794 . . . . 0.0 110.835 173.565 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 12.2 mm100 -62.48 -17.93 60.7 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 124.028 0.931 . . . . 0.0 113.334 175.387 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 1.7 mpp_? -118.16 13.12 13.73 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 126.417 1.887 . . . . 0.0 111.673 176.159 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 58.76 36.04 84.78 Favored Glycine 0 CA--C 1.533 1.218 0 C-N-CA 125.12 1.343 . . . . 0.0 113.894 -179.572 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 6.4 t -130.08 15.27 5.71 Favored 'General case' 0 N--CA 1.477 0.91 0 N-CA-C 114.827 1.418 . . . . 0.0 114.827 -175.333 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 8.8 t -67.99 169.8 9.39 Favored 'General case' 0 CA--C 1.557 1.212 0 CA-C-N 118.865 0.757 . . . . 0.0 110.454 173.435 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 50.5 m -132.23 13.58 4.65 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 125.302 1.441 . . . . 0.0 114.394 -176.09 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 75.5 mtm-85 -135.8 144.87 50.53 Favored Pre-proline 0 N--CA 1.472 0.63 0 C-N-CA 125.493 1.517 . . . . 0.0 112.337 -177.184 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_endo -69.37 165.72 29.55 Favored 'Trans proline' 0 CA--C 1.544 0.986 0 C-N-CA 121.955 1.77 . . . . 0.0 109.697 171.472 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -54.27 -31.31 53.43 Favored 'General case' 0 N--CA 1.478 0.939 0 O-C-N 121.196 -0.94 . . . . 0.0 112.468 177.554 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 24.6 p -70.15 -10.9 60.25 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 126.496 1.918 . . . . 0.0 115.141 177.47 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 44.6 mm-40 -122.83 -29.91 3.91 Favored 'General case' 0 N--CA 1.476 0.841 0 N-CA-C 115.184 1.55 . . . . 0.0 115.184 -177.003 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 3.4 t -66.99 164.75 17.02 Favored 'General case' 0 CA--C 1.546 0.81 0 N-CA-C 115.123 1.527 . . . . 0.0 115.123 -175.364 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -80.96 -12.31 59.41 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 126.777 2.031 . . . . 0.0 113.433 -179.632 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 60.5 m-85 -139.81 176.55 8.65 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 126.556 1.943 . . . . 0.0 110.173 179.408 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -84.58 148.49 26.44 Favored 'General case' 0 CA--C 1.547 0.845 0 O-C-N 121.134 -0.979 . . . . 0.0 113.361 -177.214 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 66.8 m170 -119.64 87.98 38.2 Favored Pre-proline 0 CA--C 1.55 0.958 0 C-N-CA 125.847 1.659 . . . . 0.0 111.177 179.385 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_endo -62.92 144.41 93.19 Favored 'Trans proline' 0 CA--C 1.539 0.759 0 C-N-CA 123.458 2.772 . . . . 0.0 114.45 -178.323 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 45.1 p -81.78 -175.09 5.39 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 124.438 1.095 . . . . 0.0 111.941 175.233 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 61.2 mtpt -60.12 -21.3 61.38 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 125.359 1.464 . . . . 0.0 113.152 173.198 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 46.1 m -109.27 -21.03 12.74 Favored 'General case' 0 N--CA 1.478 0.951 0 N-CA-C 114.548 1.314 . . . . 0.0 114.548 -179.958 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 81.9 m -61.59 135.6 57.7 Favored 'General case' 0 CA--C 1.544 0.718 0 CA-C-N 119.653 1.115 . . . . 0.0 112.352 179.39 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 38.4 tt0 -79.2 129.46 34.48 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.695 1.198 . . . . 0.0 111.091 179.993 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 13.7 t -122.87 133.45 68.94 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.037 0 C-N-CA 125.692 1.597 . . . . 0.0 110.025 -178.268 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 50.7 mt-10 -145.16 129.05 17.38 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 125.156 1.382 . . . . 0.0 111.813 -178.594 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 61.7 t30 39.66 38.82 0.46 Allowed 'General case' 0 CA--C 1.553 1.08 0 C-N-CA 127.572 2.349 . . . . 0.0 117.273 176.735 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 93.79 9.64 59.63 Favored Glycine 0 CA--C 1.535 1.3 0 O-C-N 120.955 -1.091 . . . . 0.0 115.168 178.961 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 31.7 mtt180 -137.69 170.91 15.24 Favored 'General case' 0 N--CA 1.466 0.331 0 C-N-CA 125.682 1.593 . . . . 0.0 111.827 179.591 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 5.3 m -135.85 171.95 16.38 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.675 0 C-N-CA 128.876 2.87 . . . . 0.0 107.324 177.593 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 38.7 mt -122.29 129.04 75.62 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.941 0 CA-C-N 120.209 1.368 . . . . 0.0 109.099 -179.927 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -73.72 146.08 44.67 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 124.176 0.99 . . . . 0.0 111.636 178.458 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 15.5 t -70.3 100.47 1.72 Allowed 'General case' 0 C--O 1.24 0.584 0 C-N-CA 124.972 1.309 . . . . 0.0 113.133 -176.918 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 31.3 p90 -61.51 -38.57 87.85 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 115.281 -0.872 . . . . 0.0 110.207 175.021 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 73.7 m-20 -61.38 -42.11 98.18 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 123.116 0.566 . . . . 0.0 110.855 177.433 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 48.4 t -64.31 -42.22 96.45 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 119.452 1.024 . . . . 0.0 111.472 177.538 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 29.9 mt -64.94 -40.89 95.71 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 123.636 0.774 . . . . 0.0 112.862 176.397 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 31.4 mmmt -79.51 -10.44 59.8 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 124.703 1.201 . . . . 0.0 113.872 179.087 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 80.25 37.52 21.08 Favored Glycine 0 CA--C 1.537 1.409 0 C-N-CA 124.642 1.115 . . . . 0.0 113.712 -179.932 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 50.5 ttp180 -120.24 -19.82 7.55 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 126.822 2.049 . . . . 0.0 114.507 -176.614 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 6.2 t . . . . . 0 CA--C 1.545 0.774 0 CA-C-N 119.247 0.93 . . . . 0.0 112.603 -178.376 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 8.1 t . . . . . 0 CA--C 1.544 0.737 0 CA-C-O 121.602 0.715 . . . . 0.0 111.866 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 27.4 mtmt -84.12 2.09 41.1 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 124.607 1.163 . . . . 0.0 113.374 -178.588 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 80.6 m-85 -117.65 149.19 41.12 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 124.334 1.053 . . . . 0.0 111.591 -174.763 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -76.09 117.75 18.12 Favored 'General case' 0 N--CA 1.464 0.253 0 C-N-CA 123.516 0.727 . . . . 0.0 111.293 -176.49 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 15.3 m170 -72.25 114.32 28.48 Favored Pre-proline 0 CA--C 1.549 0.907 0 N-CA-C 107.46 -1.311 . . . . 0.0 107.46 174.602 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 63.6 Cg_exo -47.27 115.9 1.55 Allowed 'Trans proline' 0 CA--C 1.543 0.96 0 C-N-CA 124.855 3.703 . . . . 0.0 116.522 -174.433 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -76.3 149.36 31.47 Favored 'Trans proline' 0 CA--C 1.542 0.887 0 C-N-CA 121.906 1.737 . . . . 0.0 110.472 175.955 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 84.6 Cg_exo -47.05 -39.32 25.41 Favored 'Trans proline' 0 CA--C 1.537 0.671 0 C-N-CA 123.868 3.045 . . . . 0.0 115.192 179.547 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 12.6 t-80 -69.8 -17.76 63.42 Favored 'General case' 0 N--CA 1.473 0.698 0 N-CA-C 114.99 1.478 . . . . 0.0 114.99 179.473 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 84.3 mt -114.19 -16.87 12.0 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 124.64 1.176 . . . . 0.0 112.848 178.742 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 54.2 mtpt -54.65 -36.2 64.3 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-N 119.725 1.148 . . . . 0.0 111.449 174.103 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 25.1 m -63.21 -43.73 97.31 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 123.635 0.774 . . . . 0.0 111.455 176.168 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 16.4 mm100 -67.5 -44.84 77.5 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 123.664 0.786 . . . . 0.0 110.75 178.129 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 81.7 mt -61.74 -48.69 79.57 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 124.2 1.0 . . . . 0.0 112.233 177.921 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -63.85 -35.67 81.39 Favored 'General case' 0 N--CA 1.474 0.741 0 CA-C-N 119.886 1.221 . . . . 0.0 112.733 179.725 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 60.2 mt -64.23 -45.49 96.09 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.763 0 CA-C-N 118.802 0.728 . . . . 0.0 110.062 176.203 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 32.2 m-80 -65.85 -37.88 87.35 Favored 'General case' 0 CA--C 1.542 0.672 0 O-C-N 121.696 -0.627 . . . . 0.0 111.354 175.956 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.846 0 C-N-CA 124.502 1.048 . . . . 0.0 111.981 177.653 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.475 0.781 0 N-CA-C 113.051 0.76 . . . . 0.0 113.051 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 86.8 mt -89.37 -14.65 35.12 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 126.127 1.771 . . . . 0.0 114.375 -178.227 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 6.8 m -78.03 75.86 4.56 Favored 'General case' 0 N--CA 1.477 0.907 0 CA-C-N 119.289 0.95 . . . . 0.0 111.008 -178.958 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 12.0 tp -75.66 145.88 40.67 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 127.531 2.332 . . . . 0.0 112.374 -178.227 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 15.9 mt-10 -75.24 150.9 38.48 Favored 'General case' 0 N--CA 1.472 0.638 0 O-C-N 120.602 -1.311 . . . . 0.0 112.752 179.29 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 13.0 m -83.52 155.56 3.75 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 C-N-CA 122.787 0.435 . . . . 0.0 111.596 176.29 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 42.6 t -72.89 129.5 38.28 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-O 122.063 0.935 . . . . 0.0 110.608 176.046 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 3.9 mpt_? -67.82 -27.82 67.05 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 124.925 1.29 . . . . 0.0 113.211 -177.542 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 15.8 mm-40 -84.13 -36.38 22.97 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 123.297 0.639 . . . . 0.0 110.11 178.423 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 72.7 t80 -63.27 -30.93 71.98 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 124.214 1.005 . . . . 0.0 110.917 174.19 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 12.6 mm100 -62.17 -16.03 50.16 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 123.886 0.874 . . . . 0.0 113.045 174.899 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 6.5 mpt_? -119.4 12.84 12.56 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 126.72 2.008 . . . . 0.0 111.622 176.684 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 58.22 36.12 81.18 Favored Glycine 0 CA--C 1.534 1.249 0 C-N-CA 125.479 1.514 . . . . 0.0 114.565 179.742 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 6.4 t -132.07 12.25 4.69 Favored 'General case' 0 N--CA 1.478 0.962 0 N-CA-C 115.202 1.556 . . . . 0.0 115.202 -175.384 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 31.0 t -61.03 131.84 51.91 Favored 'General case' 0 CA--C 1.548 0.897 0 O-C-N 121.175 -0.953 . . . . 0.0 110.783 176.53 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 75.4 p -83.18 6.67 18.52 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 125.94 1.696 . . . . 0.0 114.645 -178.04 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 75.3 mtm-85 -127.38 152.87 76.97 Favored Pre-proline 0 N--CA 1.473 0.685 0 C-N-CA 125.851 1.661 . . . . 0.0 113.476 -175.69 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo -72.66 160.61 46.03 Favored 'Trans proline' 0 CA--C 1.54 0.79 0 C-N-CA 122.098 1.865 . . . . 0.0 109.053 172.461 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 16.7 m-20 -55.3 -22.12 17.46 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 124.759 1.223 . . . . 0.0 113.822 -178.71 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 14.9 p -83.55 -22.08 32.48 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 127.306 2.242 . . . . 0.0 115.5 179.296 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -101.51 -31.9 10.65 Favored 'General case' 0 N--CA 1.477 0.883 0 CA-C-N 119.742 1.155 . . . . 0.0 113.839 -177.519 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 4.3 t -56.67 150.31 16.07 Favored 'General case' 0 CA--C 1.545 0.763 0 N-CA-C 115.007 1.484 . . . . 0.0 115.007 -174.105 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 13.4 mptt -81.9 -2.24 50.58 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 127.046 2.139 . . . . 0.0 113.134 -177.241 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 63.8 m-85 -138.79 169.8 17.14 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 127.461 2.304 . . . . 0.0 109.587 174.622 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -80.37 149.06 30.36 Favored 'General case' 0 CA--C 1.547 0.857 0 N-CA-C 114.382 1.253 . . . . 0.0 114.382 -175.948 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 21.2 m170 -121.07 86.78 42.88 Favored Pre-proline 0 CA--C 1.556 1.178 0 C-N-CA 125.99 1.716 . . . . 0.0 111.173 -179.179 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 35.2 Cg_endo -65.25 150.01 87.93 Favored 'Trans proline' 0 CA--C 1.539 0.771 0 C-N-CA 123.279 2.653 . . . . 0.0 114.671 -178.8 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 46.1 p -88.4 -175.34 4.96 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 124.476 1.11 . . . . 0.0 111.536 174.19 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 62.8 mttp -61.21 -18.53 58.72 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 125.379 1.471 . . . . 0.0 113.388 173.221 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 47.8 m -109.19 -20.99 12.78 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 125.078 1.351 . . . . 0.0 114.645 -178.783 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 71.6 m -63.58 137.55 58.16 Favored 'General case' 0 CA--C 1.543 0.701 0 CA-C-N 119.304 0.956 . . . . 0.0 113.32 -179.883 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 4.3 tm0? -82.88 134.28 35.09 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 124.774 1.23 . . . . 0.0 111.257 178.817 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -139.07 145.06 28.11 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.677 0 C-N-CA 125.251 1.42 . . . . 0.0 112.259 179.775 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -147.27 140.6 25.36 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 126.019 1.727 . . . . 0.0 110.911 176.802 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 61.1 t30 41.4 38.13 0.78 Allowed 'General case' 0 CA--C 1.553 1.073 0 C-N-CA 126.585 1.954 . . . . 0.0 116.166 177.53 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 84.53 16.65 65.76 Favored Glycine 0 CA--C 1.537 1.424 0 O-C-N 121.091 -1.006 . . . . 0.0 115.358 -179.938 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 55.5 mtt85 -136.92 160.87 37.6 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 124.913 1.285 . . . . 0.0 112.043 -179.945 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 5.8 m -135.89 150.1 28.24 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.698 0 C-N-CA 128.034 2.533 . . . . 0.0 109.847 -177.512 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 40.4 mt -98.84 127.63 51.25 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.75 0 O-C-N 121.28 -0.887 . . . . 0.0 109.992 -179.055 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -73.44 147.43 44.2 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 124.268 1.027 . . . . 0.0 111.716 177.6 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 17.9 t -69.26 100.08 1.26 Allowed 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 124.93 1.292 . . . . 0.0 112.784 -177.392 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 30.2 p90 -61.57 -38.47 87.63 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 115.23 -0.895 . . . . 0.0 110.163 175.183 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 71.1 m-20 -61.47 -42.69 99.17 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 123.127 0.571 . . . . 0.0 110.761 177.29 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 47.6 t -64.11 -42.32 96.93 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-N 119.491 1.041 . . . . 0.0 111.574 177.669 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 28.6 mt -65.46 -40.57 93.35 Favored 'General case' 0 CA--C 1.543 0.674 0 O-C-N 121.436 -0.79 . . . . 0.0 112.881 176.625 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 31.3 mmmt -79.84 -11.31 59.83 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 124.679 1.191 . . . . 0.0 113.928 179.167 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 82.17 37.79 14.53 Favored Glycine 0 CA--C 1.537 1.409 0 C-N-CA 124.577 1.085 . . . . 0.0 113.959 179.76 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 50.5 ttp180 -121.23 -18.29 7.44 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 126.652 1.981 . . . . 0.0 114.518 -176.646 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 6.0 t . . . . . 0 CA--C 1.545 0.765 0 CA-C-N 119.298 0.954 . . . . 0.0 112.747 -178.331 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 8.4 t . . . . . 0 CA--C 1.545 0.754 0 CA-C-O 121.716 0.77 . . . . 0.0 112.28 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 36.1 mtmt -85.02 5.63 28.6 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 125.324 1.45 . . . . 0.0 113.612 -177.281 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 84.4 m-85 -126.57 155.34 42.6 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 124.87 1.268 . . . . 0.0 112.061 -175.532 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -76.99 114.94 16.34 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 123.679 0.792 . . . . 0.0 112.267 -176.598 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 10.7 m170 -71.5 113.62 21.2 Favored Pre-proline 0 CA--C 1.546 0.807 0 N-CA-C 107.605 -1.257 . . . . 0.0 107.605 173.539 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 89.3 Cg_exo -50.1 111.36 0.51 Allowed 'Trans proline' 0 CA--C 1.542 0.901 0 C-N-CA 124.801 3.667 . . . . 0.0 117.226 -173.871 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 97.1 Cg_endo -76.34 152.97 35.2 Favored 'Trans proline' 0 CA--C 1.547 1.15 0 C-N-CA 122.109 1.873 . . . . 0.0 111.109 175.254 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 91.6 Cg_exo -43.95 -44.92 11.87 Favored 'Trans proline' 0 CA--C 1.538 0.717 0 C-N-CA 124.755 3.637 . . . . 0.0 116.308 -179.51 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 25.6 m170 -74.76 -5.82 45.45 Favored 'General case' 0 N--CA 1.478 0.95 0 N-CA-C 115.111 1.523 . . . . 0.0 115.111 -179.523 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 95.5 mt -116.16 -21.24 9.49 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 124.852 1.261 . . . . 0.0 113.122 177.198 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 57.4 mtpt -54.09 -35.46 62.13 Favored 'General case' 0 N--CA 1.477 0.922 0 CA-C-N 119.752 1.16 . . . . 0.0 111.439 175.304 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 23.0 m -63.62 -46.82 83.98 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 124.798 1.239 . . . . 0.0 111.416 174.902 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 75.1 mt-30 -62.51 -44.98 95.03 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.64 0.776 . . . . 0.0 110.884 177.708 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 82.2 mt -61.77 -50.18 73.41 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 124.205 1.002 . . . . 0.0 111.861 177.998 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 7.5 pt-20 -63.6 -35.16 79.59 Favored 'General case' 0 N--CA 1.474 0.726 0 CA-C-N 119.838 1.199 . . . . 0.0 112.895 179.279 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 60.4 mt -60.62 -41.21 87.18 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.795 0 CA-C-N 119.269 0.941 . . . . 0.0 110.063 176.369 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 12.7 t-20 -69.67 -45.0 69.36 Favored 'General case' 0 CA--C 1.545 0.783 0 O-C-N 121.827 -0.545 . . . . 0.0 110.595 175.316 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 1.273 0 C-N-CA 125.171 1.367 . . . . 0.0 113.357 177.726 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.474 0.772 0 N-CA-C 113.818 1.044 . . . . 0.0 113.818 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 87.1 mt -88.81 -8.9 53.54 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 127.26 2.224 . . . . 0.0 113.797 -179.418 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 4.1 m -77.43 76.94 3.97 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-O 122.738 1.256 . . . . 0.0 110.366 -179.632 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -75.65 142.26 42.62 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 128.428 2.691 . . . . 0.0 111.716 -177.139 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 51.8 mt-10 -70.89 149.86 46.33 Favored 'General case' 0 N--CA 1.471 0.612 0 O-C-N 120.718 -1.239 . . . . 0.0 112.08 176.927 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 16.5 m -84.1 155.2 3.66 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.921 0 C-N-CA 123.163 0.585 . . . . 0.0 111.191 174.555 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 42.3 t -74.76 133.56 41.96 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-O 121.861 0.839 . . . . 0.0 110.841 176.861 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 3.4 mpt_? -67.95 -26.96 66.21 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 124.994 1.317 . . . . 0.0 113.437 -177.562 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 7.8 mm-40 -87.86 -32.9 18.75 Favored 'General case' 0 N--CA 1.465 0.32 0 C-N-CA 123.053 0.541 . . . . 0.0 110.701 178.427 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 64.2 t80 -64.15 -31.69 72.98 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 123.513 0.725 . . . . 0.0 110.212 172.93 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 12.0 mm100 -61.61 -24.21 66.54 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 123.669 0.788 . . . . 0.0 112.541 174.382 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 28.0 mtm105 -103.48 -2.36 26.98 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 125.967 1.707 . . . . 0.0 112.575 177.649 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 72.58 35.86 59.02 Favored Glycine 0 CA--C 1.533 1.191 0 C-N-CA 126.223 1.868 . . . . 0.0 113.983 179.927 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 5.3 t -137.15 10.62 3.03 Favored 'General case' 0 N--CA 1.48 1.053 0 N-CA-C 116.122 1.897 . . . . 0.0 116.122 -175.033 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 28.9 t -60.77 131.73 51.61 Favored 'General case' 0 CA--C 1.55 0.971 0 CA-C-N 119.723 1.147 . . . . 0.0 111.518 177.545 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 29.0 m -80.16 5.14 15.26 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 125.811 1.644 . . . . 0.0 114.894 -177.581 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 79.1 mtm-85 -129.69 145.22 56.12 Favored Pre-proline 0 N--CA 1.475 0.798 0 C-N-CA 125.243 1.417 . . . . 0.0 113.491 -175.28 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 93.5 Cg_endo -70.22 166.79 27.01 Favored 'Trans proline' 0 CA--C 1.543 0.959 0 C-N-CA 122.251 1.967 . . . . 0.0 109.803 171.382 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 7.1 p-10 -54.61 -28.76 48.83 Favored 'General case' 0 N--CA 1.475 0.821 0 O-C-N 121.031 -1.043 . . . . 0.0 113.507 177.088 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 35.0 p -75.52 -9.25 58.42 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 125.472 1.509 . . . . 0.0 114.995 178.874 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 25.5 mm-40 -122.12 -25.16 4.96 Favored 'General case' 0 N--CA 1.477 0.901 0 N-CA-C 115.763 1.764 . . . . 0.0 115.763 -175.748 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 4.3 t -71.02 164.55 25.33 Favored 'General case' 0 CA--C 1.545 0.788 0 N-CA-C 115.181 1.549 . . . . 0.0 115.181 -175.164 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -83.33 -13.29 55.37 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 126.888 2.075 . . . . 0.0 113.428 -179.805 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 59.5 m-85 -136.76 171.79 13.98 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 127.093 2.157 . . . . 0.0 110.105 179.068 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -81.26 151.96 27.85 Favored 'General case' 0 CA--C 1.545 0.757 0 N-CA-C 114.555 1.317 . . . . 0.0 114.555 -176.15 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 67.7 m170 -124.25 85.32 55.3 Favored Pre-proline 0 CA--C 1.553 1.072 0 C-N-CA 126.315 1.846 . . . . 0.0 110.638 -179.788 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_endo -63.42 151.71 83.62 Favored 'Trans proline' 0 C--N 1.352 0.762 0 C-N-CA 123.606 2.871 . . . . 0.0 115.166 -177.43 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 59.6 p -84.77 -176.31 6.16 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 124.785 1.234 . . . . 0.0 111.93 174.492 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 67.7 mttm -63.24 -18.34 63.43 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 125.477 1.511 . . . . 0.0 113.407 173.686 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 70.8 p -109.26 -21.23 12.65 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 125.368 1.467 . . . . 0.0 114.696 -178.92 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 84.0 m -63.68 138.89 58.68 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 119.463 1.029 . . . . 0.0 113.581 179.522 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 24.3 mt-30 -78.79 136.82 37.47 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 124.808 1.243 . . . . 0.0 111.449 178.242 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 11.2 t -130.23 135.4 60.88 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.687 0 C-N-CA 124.789 1.235 . . . . 0.0 110.478 -179.484 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -145.91 132.72 20.06 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 125.149 1.379 . . . . 0.0 111.202 178.236 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 63.2 t30 41.16 38.39 0.73 Allowed 'General case' 0 CA--C 1.552 1.038 0 C-N-CA 126.951 2.1 . . . . 0.0 116.419 177.622 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 87.26 14.99 63.11 Favored Glycine 0 CA--C 1.536 1.377 0 O-C-N 121.071 -1.018 . . . . 0.0 115.136 179.892 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 30.0 mtt180 -137.01 163.75 30.0 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 125.452 1.501 . . . . 0.0 112.702 -179.664 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 6.2 m -137.6 141.35 39.51 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.562 0 C-N-CA 127.87 2.468 . . . . 0.0 109.91 -179.243 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 49.8 mt -90.2 142.29 13.14 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.964 0 O-C-N 121.092 -1.005 . . . . 0.0 108.991 178.591 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -90.8 152.28 20.85 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 123.54 0.736 . . . . 0.0 112.693 -179.718 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 3.7 t -70.29 88.87 0.64 Allowed 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.997 1.719 . . . . 0.0 111.398 -177.061 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 28.9 p90 -57.7 -36.86 72.55 Favored 'General case' 0 N--CA 1.469 0.508 0 O-C-N 121.341 -0.849 . . . . 0.0 111.934 179.374 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 66.8 m-20 -59.48 -30.79 68.79 Favored 'General case' 0 CA--C 1.542 0.648 0 O-C-N 121.807 -0.558 . . . . 0.0 111.66 177.269 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 47.9 t -71.28 -41.46 69.99 Favored 'General case' 0 N--CA 1.469 0.513 0 O-C-N 120.744 -1.223 . . . . 0.0 111.104 177.054 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 48.3 mt -66.94 -40.25 87.53 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 123.912 0.885 . . . . 0.0 112.49 175.731 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 14.2 mmmm -78.48 -8.4 58.49 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 125.078 1.351 . . . . 0.0 114.591 -179.381 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 76.05 49.59 8.47 Favored Glycine 0 CA--C 1.534 1.219 0 CA-C-N 118.786 0.721 . . . . 0.0 112.26 -179.222 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.13 -21.8 1.19 Allowed 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 125.981 1.713 . . . . 0.0 115.588 -174.843 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 7.4 t . . . . . 0 CA--C 1.546 0.816 0 N-CA-C 114.362 1.245 . . . . 0.0 114.362 -174.159 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 59.0 m . . . . . 0 CA--C 1.537 0.471 0 CA-C-O 121.84 0.829 . . . . 0.0 111.138 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 35.2 mtmt -115.51 15.65 16.66 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 125.788 1.635 . . . . 0.0 111.144 176.457 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 68.7 m-85 -139.03 150.43 45.79 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 127.714 2.405 . . . . 0.0 111.381 -174.683 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -73.63 122.06 21.69 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 124.598 1.159 . . . . 0.0 112.874 -178.406 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 4.0 m170 -72.92 117.59 61.06 Favored Pre-proline 0 CA--C 1.547 0.83 0 N-CA-C 107.609 -1.256 . . . . 0.0 107.609 171.455 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 90.1 Cg_exo -48.89 111.47 0.48 Allowed 'Trans proline' 0 CA--C 1.545 1.045 0 C-N-CA 124.475 3.45 . . . . 0.0 116.238 -176.301 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 68.1 Cg_endo -74.53 154.1 44.68 Favored 'Trans proline' 0 CA--C 1.542 0.893 0 C-N-CA 122.391 2.061 . . . . 0.0 111.048 176.38 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -54.95 -34.66 87.21 Favored 'Trans proline' 0 CA--C 1.536 0.59 0 C-N-CA 123.532 2.821 . . . . 0.0 114.682 -177.413 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 19.4 t-80 -75.66 -13.44 60.33 Favored 'General case' 0 N--CA 1.474 0.734 0 N-CA-C 114.519 1.303 . . . . 0.0 114.519 178.308 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 87.7 mt -115.55 -14.6 11.5 Favored 'General case' 0 N--CA 1.474 0.769 0 N-CA-C 113.948 1.092 . . . . 0.0 113.948 178.461 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 56.0 mtpt -54.55 -32.71 58.88 Favored 'General case' 0 N--CA 1.475 0.78 0 CA-C-N 119.728 1.149 . . . . 0.0 110.638 173.103 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 17.4 m -62.89 -42.98 99.97 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 124.648 1.179 . . . . 0.0 111.585 175.208 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 -66.65 -47.23 73.19 Favored 'General case' 0 CA--C 1.536 0.438 0 O-C-N 121.419 -0.801 . . . . 0.0 110.093 176.663 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 44.3 mt -61.92 -39.15 91.03 Favored 'General case' 0 N--CA 1.471 0.584 0 N-CA-C 113.183 0.809 . . . . 0.0 113.183 178.287 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 17.7 mm-40 -53.49 -54.29 39.28 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 124.733 1.213 . . . . 0.0 110.443 174.485 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 69.5 mt -68.45 -37.52 77.93 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.402 0 C-N-CA 126.032 1.733 . . . . 0.0 111.197 -176.186 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 72.8 m-20 -63.13 -44.26 96.09 Favored 'General case' 0 CA--C 1.542 0.66 0 O-C-N 121.623 -0.673 . . . . 0.0 110.294 173.081 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.913 0 C-N-CA 124.431 1.015 . . . . 0.0 112.421 179.326 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.475 0.798 0 N-CA-C 112.785 0.661 . . . . 0.0 112.785 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 85.7 mt -95.06 -20.34 19.4 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 127.269 2.228 . . . . 0.0 114.081 -177.649 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 4.5 m -73.19 73.69 1.26 Allowed 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 125.251 1.42 . . . . 0.0 112.029 -178.957 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 10.2 tp -75.67 145.25 41.12 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 127.137 2.175 . . . . 0.0 112.098 -178.751 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 11.2 mt-10 -72.95 152.19 41.51 Favored 'General case' 0 N--CA 1.471 0.588 0 O-C-N 120.589 -1.319 . . . . 0.0 112.865 179.146 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 18.0 m -85.21 156.18 3.49 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.852 0 C-N-CA 123.333 0.653 . . . . 0.0 111.446 175.559 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 42.6 t -75.69 128.06 34.39 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-O 121.61 0.719 . . . . 0.0 110.44 176.741 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 4.3 mpt_? -66.82 -27.64 67.72 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 124.384 1.073 . . . . 0.0 113.141 -177.658 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -78.92 -40.75 31.27 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.457 0.703 . . . . 0.0 109.518 177.803 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 63.8 t80 -62.79 -35.28 79.36 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 124.752 1.221 . . . . 0.0 111.2 175.745 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 50.3 mm-40 -62.04 -15.92 48.12 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 124.408 1.083 . . . . 0.0 113.406 175.248 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 12.0 mtp-105 -120.82 12.71 11.37 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 127.06 2.144 . . . . 0.0 112.266 -179.852 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 58.06 34.62 73.37 Favored Glycine 0 CA--C 1.535 1.285 0 C-N-CA 125.061 1.315 . . . . 0.0 113.845 -179.791 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 7.6 t -129.87 14.1 5.82 Favored 'General case' 0 N--CA 1.475 0.796 0 N-CA-C 114.597 1.332 . . . . 0.0 114.597 -175.342 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 6.8 t -68.57 173.35 5.14 Favored 'General case' 0 CA--C 1.556 1.176 0 O-C-N 121.409 -0.807 . . . . 0.0 110.837 174.133 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 91.6 p -139.4 9.34 2.47 Favored 'General case' 0 N--CA 1.477 0.878 0 N-CA-C 115.097 1.517 . . . . 0.0 115.097 -176.825 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 48.3 mtt85 -130.86 145.47 57.85 Favored Pre-proline 0 N--CA 1.47 0.569 0 C-N-CA 125.596 1.558 . . . . 0.0 112.116 -177.589 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -69.05 166.44 26.72 Favored 'Trans proline' 0 CA--C 1.543 0.958 0 C-N-CA 121.962 1.775 . . . . 0.0 109.735 171.973 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -54.24 -29.79 47.88 Favored 'General case' 0 N--CA 1.476 0.862 0 O-C-N 121.129 -0.982 . . . . 0.0 113.054 176.946 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 31.7 p -73.1 -7.63 52.17 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 125.991 1.717 . . . . 0.0 115.004 178.317 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 21.8 mt-10 -127.39 -24.33 3.37 Favored 'General case' 0 N--CA 1.476 0.838 0 N-CA-C 116.059 1.874 . . . . 0.0 116.059 -176.167 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 1.1 t -71.71 164.64 25.59 Favored 'General case' 0 CA--C 1.543 0.691 0 N-CA-C 115.415 1.635 . . . . 0.0 115.415 -176.538 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -81.62 -10.81 59.33 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 126.591 1.956 . . . . 0.0 113.717 -178.598 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 63.1 m-85 -140.06 174.0 10.96 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 126.549 1.939 . . . . 0.0 110.336 179.507 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -80.11 150.02 30.4 Favored 'General case' 0 CA--C 1.548 0.871 0 N-CA-C 113.349 0.87 . . . . 0.0 113.349 -176.957 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 65.8 m170 -123.42 86.14 52.19 Favored Pre-proline 0 CA--C 1.553 1.092 0 C-N-CA 126.049 1.74 . . . . 0.0 110.965 -179.327 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_endo -63.82 152.64 79.75 Favored 'Trans proline' 0 CA--C 1.541 0.842 0 C-N-CA 123.704 2.936 . . . . 0.0 114.998 -177.894 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 39.2 p -92.32 -174.44 3.72 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 124.99 1.316 . . . . 0.0 112.096 175.563 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -62.09 -17.02 56.32 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 125.693 1.597 . . . . 0.0 113.559 173.31 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 61.2 m -109.07 -25.71 10.54 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 124.719 1.208 . . . . 0.0 114.081 -179.744 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 75.2 m -60.56 129.52 41.98 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 123.861 0.864 . . . . 0.0 113.137 -179.618 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 33.9 mt-30 -77.05 141.62 40.21 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 123.161 0.584 . . . . 0.0 110.978 176.115 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 14.5 t -129.48 139.59 51.3 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 C-N-CA 125.438 1.495 . . . . 0.0 110.604 -177.695 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 74.1 mm-40 -145.32 129.35 17.49 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 125.213 1.405 . . . . 0.0 111.49 179.943 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 63.3 t30 42.88 37.23 1.03 Allowed 'General case' 0 CA--C 1.555 1.138 0 N-CA-C 116.298 1.962 . . . . 0.0 116.298 176.684 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 85.58 17.18 62.49 Favored Glycine 0 CA--C 1.536 1.399 0 O-C-N 120.975 -1.078 . . . . 0.0 114.813 -179.407 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 60.8 mtt180 -138.72 162.01 35.75 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 125.842 1.657 . . . . 0.0 111.472 -179.1 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 4.9 m -138.35 142.25 35.7 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.626 0 C-N-CA 126.949 2.1 . . . . 0.0 109.938 -177.869 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 31.8 mt -90.36 129.28 41.46 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.766 0 O-C-N 121.289 -0.882 . . . . 0.0 110.337 -178.048 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -75.53 149.24 38.43 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 124.16 0.984 . . . . 0.0 111.733 177.868 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 15.2 t -69.45 99.52 1.25 Allowed 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 124.876 1.27 . . . . 0.0 112.985 -176.696 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 32.1 p90 -61.66 -38.56 88.19 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 115.165 -0.925 . . . . 0.0 110.154 175.108 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 69.9 m-20 -61.26 -41.78 97.52 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 123.17 0.588 . . . . 0.0 111.033 177.187 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 48.2 t -64.63 -41.65 96.03 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-N 119.48 1.036 . . . . 0.0 111.462 177.678 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 31.2 mt -66.5 -41.63 88.6 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 123.804 0.841 . . . . 0.0 112.882 176.504 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 31.4 mmmt -77.77 -10.97 59.82 Favored 'General case' 0 N--CA 1.478 0.966 0 C-N-CA 124.668 1.187 . . . . 0.0 113.71 179.158 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 81.14 38.39 15.44 Favored Glycine 0 CA--C 1.537 1.412 0 C-N-CA 124.605 1.098 . . . . 0.0 113.803 179.644 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 50.9 ttp180 -121.97 -20.78 6.22 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 126.551 1.94 . . . . 0.0 114.555 -176.592 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 5.4 t . . . . . 0 CA--C 1.544 0.728 0 CA-C-N 119.318 0.963 . . . . 0.0 112.973 -178.286 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 7.4 t . . . . . 0 CA--C 1.545 0.751 0 CA-C-O 121.625 0.726 . . . . 0.0 112.167 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 30.4 mtmt -84.64 4.49 32.15 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 125.07 1.348 . . . . 0.0 114.089 -177.374 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 86.8 m-85 -127.24 155.71 43.03 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 124.823 1.249 . . . . 0.0 112.173 -175.304 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -77.31 114.43 16.12 Favored 'General case' 0 N--CA 1.467 0.412 0 C-N-CA 123.699 0.799 . . . . 0.0 112.079 -177.306 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 9.3 m170 -69.57 115.16 30.09 Favored Pre-proline 0 CA--C 1.546 0.805 0 N-CA-C 107.741 -1.207 . . . . 0.0 107.741 173.849 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 92.9 Cg_exo -49.71 114.1 1.22 Allowed 'Trans proline' 0 CA--C 1.543 0.967 0 C-N-CA 124.554 3.503 . . . . 0.0 116.238 -174.887 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -77.42 149.76 27.81 Favored 'Trans proline' 0 CA--C 1.542 0.923 0 C-N-CA 122.114 1.876 . . . . 0.0 110.435 175.876 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 88.5 Cg_exo -46.87 -39.47 24.48 Favored 'Trans proline' 0 CA--C 1.539 0.739 0 C-N-CA 123.895 3.064 . . . . 0.0 115.437 -179.968 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 12.7 t-80 -70.71 -17.78 62.82 Favored 'General case' 0 N--CA 1.472 0.666 0 N-CA-C 115.08 1.511 . . . . 0.0 115.08 179.774 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 76.3 mt -113.32 -16.36 12.51 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 124.597 1.159 . . . . 0.0 113.009 178.143 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 53.6 mtpt -54.72 -34.73 62.82 Favored 'General case' 0 N--CA 1.478 0.964 0 CA-C-N 119.742 1.156 . . . . 0.0 111.533 174.365 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 23.0 m -63.75 -43.72 95.62 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 123.461 0.705 . . . . 0.0 111.329 175.805 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 91.1 mm-40 -67.22 -45.7 76.03 Favored 'General case' 0 N--CA 1.469 0.514 0 O-C-N 121.458 -0.776 . . . . 0.0 111.002 177.598 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 81.8 mt -61.82 -49.86 74.59 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 124.376 1.07 . . . . 0.0 112.285 178.467 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.35 -35.84 82.2 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-N 119.541 1.064 . . . . 0.0 112.735 -179.598 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 59.4 mt -62.58 -44.29 99.24 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.785 0 CA-C-N 118.759 0.709 . . . . 0.0 109.851 174.582 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 13.3 t-20 -63.98 -39.8 94.94 Favored 'General case' 0 CA--C 1.546 0.814 0 O-C-N 121.677 -0.639 . . . . 0.0 110.5 175.78 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.532 1.115 0 C-N-CA 124.858 1.218 . . . . 0.0 112.259 176.564 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.475 0.808 0 N-CA-C 112.923 0.712 . . . . 0.0 112.923 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 83.9 mt -85.13 -13.89 48.75 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 126.816 2.046 . . . . 0.0 114.017 -178.714 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 11.1 m -77.97 79.17 4.44 Favored 'General case' 0 N--CA 1.475 0.821 0 CA-C-O 122.442 1.115 . . . . 0.0 110.398 -178.538 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -75.64 140.78 42.76 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 128.492 2.717 . . . . 0.0 111.363 -177.612 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 14.5 mt-10 -74.47 151.49 39.56 Favored 'General case' 0 N--CA 1.472 0.664 0 O-C-N 120.49 -1.381 . . . . 0.0 112.179 177.917 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 13.9 m -83.46 155.77 3.76 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.765 0 C-N-CA 122.848 0.459 . . . . 0.0 110.605 175.372 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 40.5 t -75.0 130.12 38.82 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-O 121.646 0.736 . . . . 0.0 110.648 177.096 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 3.5 mpt_? -67.59 -28.68 67.97 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 124.355 1.062 . . . . 0.0 113.207 -177.32 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -82.26 -33.06 29.34 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 118.262 0.483 . . . . 0.0 110.831 178.436 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 72.9 t80 -64.96 -35.92 82.72 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 123.702 0.801 . . . . 0.0 109.657 172.938 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 60.2 mm-40 -65.01 -18.6 65.44 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 124.132 0.973 . . . . 0.0 112.591 173.786 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 47.9 mtp180 -106.67 3.26 26.59 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 126.481 1.912 . . . . 0.0 112.494 178.523 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 62.61 34.04 88.38 Favored Glycine 0 CA--C 1.537 1.417 0 C-N-CA 125.197 1.379 . . . . 0.0 113.606 -178.077 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 5.3 t -138.12 16.09 2.82 Favored 'General case' 0 N--CA 1.478 0.937 0 N-CA-C 115.464 1.653 . . . . 0.0 115.464 -174.854 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 7.5 t -64.71 168.79 5.69 Favored 'General case' 0 CA--C 1.558 1.277 0 CA-C-N 119.275 0.943 . . . . 0.0 111.441 175.647 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 50.7 m -128.95 7.2 5.54 Favored 'General case' 0 N--CA 1.48 1.046 0 N-CA-C 115.562 1.69 . . . . 0.0 115.562 -175.289 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 87.9 mtt180 -137.07 145.68 51.4 Favored Pre-proline 0 N--CA 1.474 0.748 0 C-N-CA 125.527 1.531 . . . . 0.0 111.921 -178.874 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 74.6 Cg_endo -69.26 167.66 23.13 Favored 'Trans proline' 0 CA--C 1.544 1.005 0 C-N-CA 122.231 1.954 . . . . 0.0 110.141 172.49 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -54.38 -31.19 54.24 Favored 'General case' 0 N--CA 1.48 1.038 0 O-C-N 121.079 -1.013 . . . . 0.0 112.492 177.543 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 23.5 p -71.33 -6.94 43.73 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 126.318 1.847 . . . . 0.0 114.982 177.206 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 29.4 mt-10 -132.56 -21.44 2.24 Favored 'General case' 0 N--CA 1.476 0.836 0 N-CA-C 116.342 1.979 . . . . 0.0 116.342 -176.27 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 3.7 t -72.19 169.87 15.23 Favored 'General case' 0 CA--C 1.552 1.037 0 CA-C-N 119.935 1.243 . . . . 0.0 114.214 -177.977 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 56.0 mtmt -88.26 -10.66 48.91 Favored 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 126.518 1.927 . . . . 0.0 114.081 -178.516 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 66.7 m-85 -139.33 171.63 13.99 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 127.301 2.24 . . . . 0.0 109.389 177.02 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -82.38 150.86 26.91 Favored 'General case' 0 CA--C 1.546 0.809 0 N-CA-C 114.644 1.349 . . . . 0.0 114.644 -175.894 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 57.4 m170 -122.88 88.28 50.52 Favored Pre-proline 0 CA--C 1.552 1.028 0 C-N-CA 126.017 1.727 . . . . 0.0 110.577 179.073 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 26.5 Cg_endo -61.79 148.06 93.92 Favored 'Trans proline' 0 C--N 1.352 0.731 0 C-N-CA 123.148 2.565 . . . . 0.0 114.569 -178.315 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 59.7 p -82.48 -178.92 7.24 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 124.405 1.082 . . . . 0.0 111.908 175.055 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 31.2 mmmt -61.43 -17.36 53.98 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 125.445 1.498 . . . . 0.0 113.352 173.383 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 50.5 m -109.2 -17.94 13.73 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 125.016 1.326 . . . . 0.0 114.535 -178.686 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 83.5 m -69.27 154.14 42.52 Favored 'General case' 0 CA--C 1.543 0.676 0 CA-C-N 119.704 1.138 . . . . 0.0 112.682 177.833 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 39.0 mt-30 -110.13 141.21 43.33 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 124.483 1.113 . . . . 0.0 111.466 178.807 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -133.38 148.34 30.97 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.558 0 C-N-CA 125.054 1.342 . . . . 0.0 112.632 -177.48 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -146.01 140.79 27.09 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 125.934 1.694 . . . . 0.0 110.524 177.015 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 7.3 t-20 46.51 30.7 1.14 Allowed 'General case' 0 CA--C 1.553 1.069 0 C-N-CA 126.083 1.753 . . . . 0.0 115.245 179.207 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 82.09 22.81 58.54 Favored Glycine 0 CA--C 1.537 1.425 0 O-C-N 121.044 -1.035 . . . . 0.0 114.19 -178.253 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 53.2 mtt85 -138.13 160.64 38.87 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 125.249 1.42 . . . . 0.0 112.088 -178.446 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 4.4 m -136.78 138.59 46.01 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.514 0 C-N-CA 127.733 2.413 . . . . 0.0 109.886 -176.99 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 20.6 mt -88.48 129.77 39.09 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.558 0 O-C-N 121.306 -0.871 . . . . 0.0 109.63 -179.033 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -75.39 147.2 40.21 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 123.84 0.856 . . . . 0.0 111.067 178.054 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 11.8 t -69.23 98.79 1.07 Allowed 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 124.489 1.115 . . . . 0.0 112.538 -177.094 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 30.8 p90 -60.91 -38.18 84.82 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.104 175.645 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 70.1 m-20 -62.14 -36.65 82.44 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 123.571 0.748 . . . . 0.0 111.695 177.098 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 29.6 t -66.67 -42.12 87.07 Favored 'General case' 0 CA--C 1.539 0.558 0 CA-C-N 119.613 1.097 . . . . 0.0 111.146 176.461 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 31.8 mt -67.75 -39.89 84.17 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 123.82 0.848 . . . . 0.0 112.836 176.573 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . 0.45 ' HE2' ' HA ' ' A' ' 58' ' ' LYS . 10.0 mmpt? -80.82 -7.55 59.45 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 125.034 1.334 . . . . 0.0 114.161 -179.397 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 78.26 39.45 22.86 Favored Glycine 0 CA--C 1.536 1.366 0 C-N-CA 124.428 1.013 . . . . 0.0 113.837 179.021 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 34.7 ttm105 -120.73 -27.42 5.07 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 126.805 2.042 . . . . 0.0 113.755 -177.17 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 7.2 t . . . . . 0 CA--C 1.544 0.741 0 CA-C-N 118.991 0.814 . . . . 0.0 112.229 -178.293 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 4.2 t . . . . . 0 CA--C 1.545 0.771 0 CA-C-O 121.271 0.557 . . . . 0.0 111.159 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 32.5 mtmt -117.55 2.7 12.4 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 125.723 1.609 . . . . 0.0 113.533 -177.304 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 88.4 m-85 -123.45 151.74 42.37 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 125.95 1.7 . . . . 0.0 110.461 -176.987 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -75.08 115.42 14.69 Favored 'General case' 0 N--CA 1.467 0.396 0 O-C-N 121.595 -0.69 . . . . 0.0 112.017 -176.331 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 14.4 m170 -70.53 114.0 22.77 Favored Pre-proline 0 CA--C 1.547 0.857 0 N-CA-C 108.199 -1.038 . . . . 0.0 108.199 175.161 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 66.4 Cg_exo -46.96 109.53 0.22 Allowed 'Trans proline' 0 CA--C 1.544 1.01 0 C-N-CA 125.074 3.849 . . . . 0.0 117.143 -174.168 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_endo -77.59 151.59 28.89 Favored 'Trans proline' 0 CA--C 1.544 1.013 0 C-N-CA 122.815 2.343 . . . . 0.0 111.35 176.462 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_exo -47.26 -40.67 27.94 Favored 'Trans proline' 0 CA--C 1.539 0.769 0 C-N-CA 123.916 3.077 . . . . 0.0 115.496 179.059 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 8.3 m-70 -70.64 -15.79 62.76 Favored 'General case' 0 N--CA 1.476 0.866 0 N-CA-C 114.87 1.433 . . . . 0.0 114.87 178.98 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 85.7 mt -116.42 -15.21 10.94 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 124.116 0.966 . . . . 0.0 113.562 178.956 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 54.9 mtpt -55.73 -32.32 63.26 Favored 'General case' 0 N--CA 1.475 0.808 0 CA-C-N 119.736 1.153 . . . . 0.0 110.527 172.944 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 21.5 m -62.82 -45.45 92.57 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 124.206 1.002 . . . . 0.0 111.227 174.811 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 77.6 mt-30 -64.94 -46.54 81.17 Favored 'General case' 0 CA--C 1.54 0.57 0 O-C-N 121.39 -0.819 . . . . 0.0 110.518 176.636 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 85.1 mt -61.92 -39.8 93.3 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 124.33 1.052 . . . . 0.0 112.711 178.164 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 20.1 mm-40 -55.71 -53.64 54.13 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 124.89 1.276 . . . . 0.0 110.428 174.975 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 62.3 mt -67.68 -38.63 80.71 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.428 0 C-N-CA 125.711 1.605 . . . . 0.0 111.074 -175.97 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 54.7 m-20 -62.32 -43.46 98.76 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 123.157 0.583 . . . . 0.0 110.394 172.65 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.527 0.832 0 C-N-CA 124.209 0.909 . . . . 0.0 111.81 178.558 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.476 0.875 0 N-CA-C 114.687 1.366 . . . . 0.0 114.687 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 67.8 mt -86.09 -10.32 55.12 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 126.72 2.008 . . . . 0.0 114.091 -177.463 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 3.6 m -75.76 76.24 2.72 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 124.752 1.221 . . . . 0.0 110.922 -178.698 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 13.7 tp -75.43 140.76 43.1 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 127.684 2.394 . . . . 0.0 111.51 -177.099 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 47.1 mp0 -67.53 150.88 48.26 Favored 'General case' 0 CA--C 1.543 0.683 0 O-C-N 120.569 -1.332 . . . . 0.0 111.977 178.396 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 21.2 m -87.08 149.58 4.06 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.075 0 C-N-CA 122.915 0.486 . . . . 0.0 111.054 174.588 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.434 ' SG ' ' NZ ' ' A' ' 35' ' ' LYS . 46.9 t -70.89 134.72 47.5 Favored 'General case' 0 CA--C 1.538 0.493 0 O-C-N 121.621 -0.675 . . . . 0.0 110.782 177.035 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 3.7 mpt_? -71.75 -33.39 68.62 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 125.521 1.528 . . . . 0.0 112.721 -178.09 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 34.9 mt-10 -73.91 -38.0 64.46 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 123.731 0.812 . . . . 0.0 110.498 178.539 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 76.8 t80 -63.15 -28.7 70.24 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 124.804 1.242 . . . . 0.0 111.922 177.237 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 53.4 mm-40 -64.04 -19.97 65.59 Favored 'General case' 0 N--CA 1.477 0.9 0 N-CA-C 112.982 0.734 . . . . 0.0 112.982 175.978 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 6.8 mpt_? -110.8 9.36 22.59 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 125.987 1.715 . . . . 0.0 111.865 177.732 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 58.47 35.05 77.92 Favored Glycine 0 CA--C 1.533 1.186 0 C-N-CA 125.065 1.317 . . . . 0.0 114.094 -179.831 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 6.4 t -129.24 8.81 5.58 Favored 'General case' 0 N--CA 1.478 0.959 0 N-CA-C 114.51 1.3 . . . . 0.0 114.51 -175.76 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 12.4 t -60.34 136.66 58.11 Favored 'General case' 0 CA--C 1.55 0.962 0 C-N-CA 123.555 0.742 . . . . 0.0 111.305 177.61 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 33.1 m -80.6 -1.96 44.36 Favored 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 115.984 1.846 . . . . 0.0 115.984 -176.302 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 23.1 mtm-85 -134.21 151.71 76.94 Favored Pre-proline 0 N--CA 1.479 0.991 0 C-N-CA 124.971 1.308 . . . . 0.0 113.277 -174.702 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 89.7 Cg_endo -71.22 167.7 25.45 Favored 'Trans proline' 0 CA--C 1.544 0.983 0 C-N-CA 122.553 2.169 . . . . 0.0 109.924 172.306 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -53.16 -28.52 26.69 Favored 'General case' 0 N--CA 1.475 0.808 0 N-CA-C 114.518 1.303 . . . . 0.0 114.518 178.776 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 12.4 p -75.99 -14.81 60.23 Favored 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 115.024 1.49 . . . . 0.0 115.024 179.057 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -121.42 -18.39 7.31 Favored 'General case' 0 N--CA 1.476 0.843 0 N-CA-C 116.711 2.115 . . . . 0.0 116.711 -173.122 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 2.9 t -72.81 172.23 11.2 Favored 'General case' 0 CA--C 1.55 0.966 0 N-CA-C 116.349 1.981 . . . . 0.0 116.349 -176.763 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.434 ' NZ ' ' SG ' ' A' ' 19' ' ' CYS . 7.0 ptpp? -75.2 -22.69 57.82 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 129.543 3.137 . . . . 0.0 115.274 -178.347 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 11.5 m-85 -144.08 176.36 9.36 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 126.678 1.991 . . . . 0.0 110.268 -176.632 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -77.26 147.57 36.23 Favored 'General case' 0 CA--C 1.548 0.894 0 O-C-N 121.137 -0.977 . . . . 0.0 113.428 -176.577 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 55.0 m170 -120.68 87.36 41.85 Favored Pre-proline 0 CA--C 1.552 1.037 0 C-N-CA 125.843 1.657 . . . . 0.0 110.623 179.854 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_endo -61.57 146.57 96.8 Favored 'Trans proline' 0 CA--C 1.539 0.768 0 C-N-CA 123.552 2.835 . . . . 0.0 115.014 -177.683 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 53.6 p -84.64 -174.7 5.42 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 125.148 1.379 . . . . 0.0 112.266 175.714 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -60.75 -22.12 63.71 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 125.712 1.605 . . . . 0.0 113.67 174.355 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 66.7 p -109.16 -19.75 13.23 Favored 'General case' 0 N--CA 1.478 0.94 0 N-CA-C 114.413 1.264 . . . . 0.0 114.413 179.444 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 98.4 m -60.51 129.87 43.77 Favored 'General case' 0 CA--C 1.542 0.667 0 CA-C-N 119.723 1.147 . . . . 0.0 112.54 179.296 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 48.6 tt0 -83.46 133.76 34.89 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 124.815 1.246 . . . . 0.0 110.395 178.904 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 21.5 t -116.9 141.94 32.9 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.929 0 C-N-CA 125.525 1.53 . . . . 0.0 109.939 -177.719 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 74.5 mm-40 -142.63 125.67 16.29 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 125.239 1.416 . . . . 0.0 111.303 -179.175 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 63.6 t30 42.17 38.16 1.06 Allowed 'General case' 0 CA--C 1.555 1.152 0 N-CA-C 116.708 2.114 . . . . 0.0 116.708 175.718 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 88.62 14.9 60.74 Favored Glycine 0 CA--C 1.536 1.398 0 O-C-N 120.869 -1.144 . . . . 0.0 115.082 -179.656 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 48.3 mtt-85 -139.82 168.48 19.73 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 126.341 1.857 . . . . 0.0 112.099 -178.988 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 3.5 m -139.85 138.17 38.6 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.539 0 C-N-CA 126.947 2.099 . . . . 0.0 109.491 179.636 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 70.8 mt -86.21 135.66 24.57 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.783 0 O-C-N 120.992 -1.068 . . . . 0.0 109.451 179.955 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -80.75 150.08 29.4 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 123.66 0.784 . . . . 0.0 112.454 178.687 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 7.5 t -70.09 94.16 0.86 Allowed 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 126.183 1.793 . . . . 0.0 110.135 -179.479 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 29.5 p90 -56.41 -37.66 70.48 Favored 'General case' 0 N--CA 1.471 0.587 0 O-C-N 121.069 -1.019 . . . . 0.0 112.118 -179.738 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 -60.45 -29.16 68.85 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 123.452 0.701 . . . . 0.0 112.276 177.623 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 47.8 p -71.14 -37.87 72.27 Favored 'General case' 0 N--CA 1.471 0.58 0 O-C-N 121.079 -1.013 . . . . 0.0 111.757 177.035 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 69.8 mt -74.16 -42.82 59.32 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.416 1.086 . . . . 0.0 111.876 176.74 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 31.2 mmmt -74.13 -11.96 60.45 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 124.766 1.227 . . . . 0.0 113.795 179.836 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 80.48 41.22 11.65 Favored Glycine 0 CA--C 1.536 1.355 0 C-N-CA 124.449 1.023 . . . . 0.0 114.052 178.462 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 48.4 ttp180 -127.06 -18.65 4.55 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 126.264 1.826 . . . . 0.0 114.834 -176.694 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 8.4 t . . . . . 0 CA--C 1.548 0.87 0 CA-C-N 119.286 0.948 . . . . 0.0 112.538 -179.818 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 3.8 m . . . . . 0 CA--C 1.54 0.583 0 N-CA-C 113.495 0.924 . . . . 0.0 113.495 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 22.6 mtmt -78.29 6.94 7.19 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 123.152 0.581 . . . . 0.0 111.918 173.485 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 58.0 m-85 -127.55 150.85 49.51 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 126.698 1.999 . . . . 0.0 111.214 -174.149 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -79.17 126.89 31.33 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 124.048 0.939 . . . . 0.0 113.285 -175.445 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 38.1 m170 -75.5 115.49 46.15 Favored Pre-proline 0 CA--C 1.548 0.872 0 N-CA-C 106.717 -1.586 . . . . 0.0 106.717 170.496 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 81.7 Cg_exo -53.2 122.52 11.31 Favored 'Trans proline' 0 CA--C 1.543 0.955 0 C-N-CA 123.659 2.906 . . . . 0.0 115.146 -175.552 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_endo -77.91 155.03 30.2 Favored 'Trans proline' 0 CA--C 1.542 0.908 0 C-N-CA 122.226 1.951 . . . . 0.0 111.119 177.5 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 80.4 Cg_exo -45.32 -37.12 13.68 Favored 'Trans proline' 0 CA--C 1.538 0.724 0 C-N-CA 124.306 3.337 . . . . 0.0 115.848 179.214 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 76.4 m80 -78.66 -13.21 59.94 Favored 'General case' 0 N--CA 1.474 0.729 0 N-CA-C 115.336 1.606 . . . . 0.0 115.336 -179.898 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 50.8 mt -118.7 -9.64 10.16 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.617 1.167 . . . . 0.0 113.252 177.732 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 56.3 mtpt -55.84 -39.2 71.08 Favored 'General case' 0 N--CA 1.481 1.096 0 CA-C-N 120.293 1.406 . . . . 0.0 110.098 171.209 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 20.4 m -62.63 -41.44 99.02 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 124.423 1.089 . . . . 0.0 111.463 175.026 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 47.2 tp60 -66.2 -42.34 88.94 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 124.311 1.044 . . . . 0.0 110.929 178.185 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 27.6 mt -67.74 -42.3 82.07 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-O 118.516 -0.754 . . . . 0.0 112.597 178.054 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 3.1 pt-20 -64.01 -36.83 85.28 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-N 119.869 1.213 . . . . 0.0 111.056 175.665 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 64.2 mt -63.06 -42.91 98.43 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.721 0 CA-C-N 118.97 0.805 . . . . 0.0 109.812 175.332 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 60.0 m-20 -60.97 -48.14 83.2 Favored 'General case' 0 CA--C 1.545 0.783 0 CA-C-N 118.495 0.589 . . . . 0.0 110.28 175.724 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.471 0.991 0 C-N-CA 124.955 1.265 . . . . 0.0 112.51 179.076 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.544 0.738 0 N-CA-C 112.992 0.738 . . . . 0.0 112.992 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 71.3 mt -98.08 -18.3 18.61 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 126.536 1.934 . . . . 0.0 114.659 -177.119 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 6.5 m -77.19 77.76 3.73 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 124.508 1.123 . . . . 0.0 110.68 -178.01 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -75.7 143.43 42.13 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 129.022 2.929 . . . . 0.0 111.843 -177.758 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 52.3 mt-10 -71.08 151.29 44.67 Favored 'General case' 0 N--CA 1.472 0.651 0 O-C-N 120.695 -1.253 . . . . 0.0 112.386 177.212 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 15.7 m -84.11 155.79 3.66 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.03 0 C-N-CA 123.277 0.631 . . . . 0.0 111.286 174.04 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 52.8 t -75.59 133.34 40.95 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-O 121.852 0.834 . . . . 0.0 111.199 176.924 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 3.1 mpt_? -69.59 -26.62 64.54 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 124.716 1.207 . . . . 0.0 112.91 -178.876 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -82.79 -36.54 25.53 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 122.966 0.506 . . . . 0.0 109.906 177.353 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 61.3 t80 -65.27 -34.41 78.27 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 124.245 1.018 . . . . 0.0 110.344 175.161 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 12.0 mm100 -63.11 -14.2 45.62 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 124.527 1.131 . . . . 0.0 112.86 173.791 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 81.9 mtt85 -119.16 10.17 11.99 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 127.091 2.156 . . . . 0.0 112.083 -179.845 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 57.34 35.14 70.01 Favored Glycine 0 CA--C 1.534 1.26 0 C-N-CA 125.528 1.537 . . . . 0.0 114.304 -179.637 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 4.8 t -134.65 6.08 3.45 Favored 'General case' 0 N--CA 1.477 0.91 0 N-CA-C 115.205 1.557 . . . . 0.0 115.205 -174.604 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 17.6 t -58.82 128.65 38.28 Favored 'General case' 0 CA--C 1.547 0.835 0 O-C-N 120.938 -1.101 . . . . 0.0 111.037 177.374 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 78.5 p -83.92 6.55 21.31 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 125.616 1.567 . . . . 0.0 114.346 -178.371 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 61.6 mtm-85 -131.35 145.22 56.7 Favored Pre-proline 0 N--CA 1.471 0.618 0 C-N-CA 125.421 1.488 . . . . 0.0 113.979 -172.991 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 98.1 Cg_endo -70.29 166.19 29.08 Favored 'Trans proline' 0 CA--C 1.544 1.001 0 C-N-CA 122.225 1.95 . . . . 0.0 109.816 171.074 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -54.28 -29.23 46.44 Favored 'General case' 0 N--CA 1.476 0.843 0 O-C-N 121.142 -0.973 . . . . 0.0 113.423 176.692 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 30.6 p -73.82 -13.22 60.9 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 125.873 1.669 . . . . 0.0 115.092 178.9 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 29.9 mm-40 -115.94 -29.85 6.23 Favored 'General case' 0 N--CA 1.478 0.926 0 N-CA-C 115.182 1.549 . . . . 0.0 115.182 -177.073 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 4.1 t -65.12 166.5 9.48 Favored 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 115.499 1.666 . . . . 0.0 115.499 -173.883 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.36 -13.03 47.67 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 127.391 2.277 . . . . 0.0 112.524 -179.324 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 57.8 m-85 -137.67 175.97 9.12 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 126.383 1.873 . . . . 0.0 110.237 -179.296 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -83.55 150.89 25.67 Favored 'General case' 0 CA--C 1.544 0.726 0 N-CA-C 113.725 1.009 . . . . 0.0 113.725 -177.487 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 66.0 m170 -122.19 85.85 46.99 Favored Pre-proline 0 CA--C 1.55 0.975 0 C-N-CA 126.116 1.766 . . . . 0.0 111.001 -179.624 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_endo -63.09 144.93 93.52 Favored 'Trans proline' 0 C--N 1.351 0.709 0 C-N-CA 123.402 2.735 . . . . 0.0 114.694 -177.841 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 59.9 p -82.83 -175.76 5.96 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 124.608 1.163 . . . . 0.0 111.906 174.909 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 75.2 mmtt -61.1 -19.91 62.02 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 125.497 1.519 . . . . 0.0 113.481 173.524 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 68.6 p -109.17 -18.22 13.67 Favored 'General case' 0 N--CA 1.477 0.884 0 N-CA-C 114.863 1.431 . . . . 0.0 114.863 -179.594 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 91.2 m -62.74 139.66 58.69 Favored 'General case' 0 CA--C 1.543 0.694 0 CA-C-N 119.576 1.08 . . . . 0.0 113.723 -179.61 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 47.2 tp60 -80.76 130.03 34.85 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 125.422 1.489 . . . . 0.0 110.371 178.235 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 9.9 t -126.52 137.2 58.53 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.022 0 C-N-CA 125.324 1.45 . . . . 0.0 110.509 -178.012 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -147.07 130.89 17.04 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 125.293 1.437 . . . . 0.0 111.745 178.512 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 62.2 t30 40.12 38.85 0.55 Allowed 'General case' 0 CA--C 1.553 1.065 0 C-N-CA 127.211 2.204 . . . . 0.0 116.758 176.802 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 90.12 11.54 62.96 Favored Glycine 0 CA--C 1.537 1.42 0 O-C-N 121.016 -1.053 . . . . 0.0 115.299 179.41 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 44.7 mtm180 -135.91 164.36 28.13 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 125.622 1.569 . . . . 0.0 112.038 179.78 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 8.2 m -139.29 149.19 23.09 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.573 0 C-N-CA 127.581 2.352 . . . . 0.0 109.413 -179.628 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 40.2 mt -97.54 129.42 47.69 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.913 0 O-C-N 121.018 -1.051 . . . . 0.0 110.651 -177.527 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -74.58 145.76 43.1 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 124.125 0.97 . . . . 0.0 111.406 177.206 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 13.2 t -69.47 99.61 1.27 Allowed 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 124.828 1.251 . . . . 0.0 113.175 -176.683 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 41.3 p90 -61.89 -38.92 90.15 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 115.157 -0.929 . . . . 0.0 110.29 175.299 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 65.9 m-20 -60.79 -41.3 95.3 Favored 'General case' 0 CA--C 1.54 0.577 0 O-C-N 121.787 -0.571 . . . . 0.0 110.836 176.78 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 43.8 t -65.09 -41.76 94.72 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-N 119.548 1.067 . . . . 0.0 111.347 177.269 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 31.1 mt -65.41 -41.9 93.13 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 124.009 0.923 . . . . 0.0 112.923 176.492 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 31.4 mmmt -78.33 -12.59 60.01 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 124.948 1.299 . . . . 0.0 113.753 179.325 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 84.03 39.27 9.45 Favored Glycine 0 CA--C 1.536 1.395 0 C-N-CA 124.639 1.114 . . . . 0.0 114.078 179.281 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 50.4 tpt85 -123.09 -23.3 4.97 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 126.44 1.896 . . . . 0.0 114.879 -177.075 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 6.5 t . . . . . 0 CA--C 1.543 0.709 0 CA-C-N 119.437 1.017 . . . . 0.0 112.895 -176.829 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 8.0 t . . . . . 0 CA--C 1.546 0.801 0 CA-C-O 121.482 0.658 . . . . 0.0 112.219 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 26.1 mtmt -90.12 4.08 51.46 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 124.42 1.088 . . . . 0.0 113.365 -179.297 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 85.3 m-85 -120.91 148.85 43.5 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 122.052 0.93 . . . . 0.0 112.375 -174.409 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -73.01 114.27 10.97 Favored 'General case' 0 N--CA 1.464 0.271 0 C-N-CA 123.896 0.878 . . . . 0.0 111.566 -176.879 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 13.2 m170 -71.37 114.61 29.34 Favored Pre-proline 0 CA--C 1.548 0.87 0 N-CA-C 107.382 -1.34 . . . . 0.0 107.382 174.557 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 65.9 Cg_exo -48.74 116.45 2.14 Favored 'Trans proline' 0 CA--C 1.542 0.921 0 C-N-CA 124.611 3.54 . . . . 0.0 116.975 -174.096 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -75.99 149.36 32.71 Favored 'Trans proline' 0 CA--C 1.545 1.044 0 C-N-CA 122.265 1.977 . . . . 0.0 110.518 174.937 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_exo -46.16 -41.04 21.79 Favored 'Trans proline' 0 CA--C 1.537 0.674 0 C-N-CA 124.068 3.179 . . . . 0.0 115.685 -179.789 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 13.8 t-80 -69.38 -17.28 63.66 Favored 'General case' 0 N--CA 1.474 0.765 0 N-CA-C 114.984 1.476 . . . . 0.0 114.984 179.761 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 93.2 mt -112.85 -16.95 12.63 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 124.367 1.067 . . . . 0.0 113.029 178.197 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 54.7 mtpt -54.56 -37.43 65.45 Favored 'General case' 0 N--CA 1.478 0.973 0 CA-C-N 119.791 1.178 . . . . 0.0 111.623 174.798 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 21.9 m -62.24 -41.76 98.72 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 123.731 0.812 . . . . 0.0 111.495 176.469 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 16.5 mm100 -69.67 -45.33 68.6 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 123.734 0.814 . . . . 0.0 110.898 178.324 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 89.4 mt -62.69 -46.2 89.25 Favored 'General case' 0 N--CA 1.466 0.345 0 C-N-CA 124.077 0.951 . . . . 0.0 112.423 178.738 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -64.91 -36.94 85.98 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-N 119.651 1.114 . . . . 0.0 112.28 178.97 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 63.7 mt -65.21 -45.43 93.82 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.707 0 CA-C-N 118.803 0.729 . . . . 0.0 110.064 176.176 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 24.5 m-80 -64.01 -38.82 92.48 Favored 'General case' 0 CA--C 1.54 0.587 0 O-C-N 121.627 -0.67 . . . . 0.0 111.456 176.645 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.907 0 C-N-CA 123.948 0.785 . . . . 0.0 111.959 177.977 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 1.8 p90 . . . . . 0 N--CA 1.474 0.73 0 N-CA-C 114.468 1.284 . . . . 0.0 114.468 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 88.4 mt -95.84 -18.19 20.56 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 125.688 1.595 . . . . 0.0 114.766 -175.849 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 2.5 m -75.44 77.35 2.49 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 124.454 1.102 . . . . 0.0 111.898 -178.604 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -75.86 144.63 41.1 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 127.178 2.191 . . . . 0.0 111.534 -179.822 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 11.5 mt-10 -73.57 151.11 41.03 Favored 'General case' 0 N--CA 1.472 0.668 0 O-C-N 120.563 -1.336 . . . . 0.0 111.402 176.014 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 12.3 m -82.82 145.88 7.85 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.789 0 N-CA-C 108.543 -0.91 . . . . 0.0 108.543 173.237 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 42.0 t -60.21 127.52 32.25 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-O 121.687 0.756 . . . . 0.0 111.213 179.643 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 3.6 mpt_? -60.06 -31.69 70.23 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 124.976 1.311 . . . . 0.0 112.94 -176.585 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 28.9 mm-40 -81.44 -34.86 31.23 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 123.343 0.657 . . . . 0.0 110.777 177.782 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 51.3 t80 -63.99 -24.92 67.9 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 124.364 1.066 . . . . 0.0 111.383 173.942 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 80.7 mt-30 -58.86 -23.9 61.45 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 123.533 0.733 . . . . 0.0 112.919 176.003 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -117.24 13.06 14.56 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 125.508 1.523 . . . . 0.0 111.943 176.895 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 62.06 37.5 94.55 Favored Glycine 0 CA--C 1.533 1.204 0 C-N-CA 125.014 1.293 . . . . 0.0 113.986 -178.937 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 7.2 t -127.24 18.46 7.03 Favored 'General case' 0 N--CA 1.479 1.001 0 N-CA-C 114.688 1.366 . . . . 0.0 114.688 -176.28 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 14.5 t -67.32 172.04 5.26 Favored 'General case' 0 CA--C 1.558 1.279 0 O-C-N 121.572 -0.705 . . . . 0.0 110.319 172.733 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 90.4 p -132.26 8.48 4.33 Favored 'General case' 0 N--CA 1.477 0.897 0 N-CA-C 115.088 1.514 . . . . 0.0 115.088 -176.001 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 62.3 mtm-85 -133.23 146.84 62.64 Favored Pre-proline 0 N--CA 1.471 0.62 0 C-N-CA 125.557 1.543 . . . . 0.0 112.424 -178.098 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 77.6 Cg_endo -69.28 166.74 25.96 Favored 'Trans proline' 0 CA--C 1.543 0.963 0 C-N-CA 121.95 1.767 . . . . 0.0 109.61 171.352 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -53.9 -30.98 48.49 Favored 'General case' 0 N--CA 1.477 0.879 0 O-C-N 121.034 -1.041 . . . . 0.0 112.91 176.781 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 40.5 p -72.94 -6.52 45.79 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 125.93 1.692 . . . . 0.0 115.015 178.637 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 18.5 mt-10 -128.08 -24.17 3.2 Favored 'General case' 0 N--CA 1.477 0.907 0 N-CA-C 115.333 1.605 . . . . 0.0 115.333 -177.773 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 3.1 t -70.18 166.28 20.3 Favored 'General case' 0 CA--C 1.546 0.791 0 N-CA-C 114.979 1.474 . . . . 0.0 114.979 -176.556 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 13.2 mmmm -83.37 -11.42 57.64 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 127.057 2.143 . . . . 0.0 113.1 179.557 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 77.0 m-85 -140.43 173.79 11.16 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 126.417 1.887 . . . . 0.0 110.763 -178.125 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -80.17 152.94 28.93 Favored 'General case' 0 CA--C 1.545 0.778 0 O-C-N 121.224 -0.923 . . . . 0.0 113.224 -178.642 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 61.3 m170 -127.04 90.16 50.13 Favored Pre-proline 0 CA--C 1.552 1.039 0 C-N-CA 125.718 1.607 . . . . 0.0 110.307 179.398 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 33.9 Cg_endo -63.19 165.76 16.31 Favored 'Trans proline' 0 CA--C 1.541 0.85 0 C-N-CA 123.685 2.923 . . . . 0.0 114.903 -178.223 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 85.7 p -128.1 -174.22 3.15 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 126.385 1.874 . . . . 0.0 112.687 178.928 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 61.9 pttt -38.53 -37.51 0.32 Allowed 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 128.823 2.849 . . . . 0.0 117.902 -178.216 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 33.1 p -109.19 -16.4 14.09 Favored 'General case' 0 N--CA 1.476 0.842 0 N-CA-C 115.028 1.492 . . . . 0.0 115.028 -177.898 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 80.4 m -61.21 128.3 35.73 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 124.319 1.048 . . . . 0.0 113.33 -177.764 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 44.6 tt0 -81.71 128.96 34.53 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 125.329 1.452 . . . . 0.0 110.008 178.105 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 17.6 t -122.42 134.07 66.74 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.918 0 C-N-CA 125.489 1.515 . . . . 0.0 109.663 -178.226 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -142.92 130.83 21.64 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 125.142 1.377 . . . . 0.0 110.703 -179.576 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 46.1 36.14 2.95 Favored 'General case' 0 CA--C 1.555 1.148 0 C-N-CA 126.177 1.791 . . . . 0.0 115.169 179.47 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 80.54 19.41 68.62 Favored Glycine 0 CA--C 1.537 1.429 0 O-C-N 120.969 -1.082 . . . . 0.0 114.66 -179.592 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 45.3 mtt180 -137.14 161.25 36.66 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 125.901 1.68 . . . . 0.0 111.179 -179.292 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 3.0 m -138.17 137.75 43.96 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.512 0 C-N-CA 127.143 2.177 . . . . 0.0 109.647 -176.877 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 75.8 mt -87.67 131.04 36.37 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.743 0 O-C-N 121.083 -1.011 . . . . 0.0 109.294 179.273 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -73.84 149.27 41.71 Favored 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 123.91 0.884 . . . . 0.0 111.926 177.694 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 8.0 t -67.38 95.64 0.46 Allowed 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 125.19 1.396 . . . . 0.0 111.681 -177.909 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 22.2 p90 -58.16 -36.63 73.3 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 123.673 0.789 . . . . 0.0 111.176 177.817 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 73.1 m-20 -61.02 -34.89 75.55 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 123.099 0.56 . . . . 0.0 111.863 177.137 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 25.3 p -68.51 -41.61 79.74 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-N 119.019 0.827 . . . . 0.0 111.666 177.4 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 38.5 mt -71.5 -40.24 70.32 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 125.183 1.393 . . . . 0.0 113.187 178.165 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . 0.411 ' HE2' ' HA ' ' A' ' 58' ' ' LYS . 11.3 mmpt? -83.46 -10.23 58.5 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 124.794 1.238 . . . . 0.0 114.122 -179.21 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 82.02 39.19 11.88 Favored Glycine 0 CA--C 1.536 1.396 0 C-N-CA 124.319 0.961 . . . . 0.0 114.725 177.773 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 6.9 tpm_? -124.41 -9.78 7.47 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 126.186 1.794 . . . . 0.0 113.863 -178.272 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 CA--C 1.544 0.712 0 CA-C-N 119.22 0.918 . . . . 0.0 112.544 -177.349 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 38.9 m . . . . . 0 CA--C 1.54 0.592 0 N-CA-C 113.696 0.998 . . . . 0.0 113.696 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 24.6 mtmt -88.81 7.79 32.29 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 123.817 0.847 . . . . 0.0 111.682 173.375 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 63.7 m-85 -127.14 148.72 50.16 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 125.818 1.647 . . . . 0.0 111.641 -172.488 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -74.17 117.19 15.69 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 124.168 0.987 . . . . 0.0 113.06 -175.951 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 6.3 m170 -65.21 129.96 94.62 Favored Pre-proline 0 CA--C 1.547 0.835 0 N-CA-C 106.612 -1.625 . . . . 0.0 106.612 170.776 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 83.3 Cg_endo -72.11 120.6 6.91 Favored 'Trans proline' 0 CA--C 1.545 1.057 0 C-N-CA 122.562 2.175 . . . . 0.0 113.142 -172.338 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -75.66 150.85 35.92 Favored 'Trans proline' 0 CA--C 1.541 0.87 0 C-N-CA 122.884 2.39 . . . . 0.0 111.063 178.021 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 84.9 Cg_exo -47.23 -39.01 26.64 Favored 'Trans proline' 0 CA--C 1.537 0.668 0 C-N-CA 123.863 3.042 . . . . 0.0 115.257 179.592 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 7.5 t-80 -69.36 -17.72 63.72 Favored 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 115.057 1.503 . . . . 0.0 115.057 179.452 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 93.4 mt -114.55 -15.61 11.99 Favored 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 124.854 1.262 . . . . 0.0 112.953 178.224 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 57.0 mtpt -54.89 -35.4 64.07 Favored 'General case' 0 N--CA 1.477 0.876 0 CA-C-N 119.736 1.153 . . . . 0.0 111.149 173.591 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 15.3 m -63.3 -41.23 98.94 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 123.902 0.881 . . . . 0.0 111.699 175.917 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 91.0 mm-40 -70.4 -44.44 67.98 Favored 'General case' 0 N--CA 1.468 0.452 0 O-C-N 121.268 -0.895 . . . . 0.0 111.05 177.281 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 95.5 mt -62.5 -40.48 96.86 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 123.748 0.819 . . . . 0.0 111.529 177.629 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 8.2 mm-40 -52.02 -56.12 16.28 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 124.884 1.274 . . . . 0.0 110.639 174.331 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 72.9 mt -68.79 -45.66 80.62 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.25 0 C-N-CA 125.798 1.639 . . . . 0.0 111.977 -173.781 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 38.5 m-80 -64.25 -34.64 78.57 Favored 'General case' 0 CA--C 1.542 0.645 0 CA-C-N 119.069 0.85 . . . . 0.0 111.501 175.878 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.886 0 C-N-CA 123.684 0.659 . . . . 0.0 111.663 176.738 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.542 0.662 0 N-CA-C 113.376 0.88 . . . . 0.0 113.376 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 94.7 mt -91.93 -17.52 25.06 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 126.061 1.744 . . . . 0.0 114.762 -177.32 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 17.1 m -78.49 74.7 5.02 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 124.567 1.147 . . . . 0.0 111.534 -177.717 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 10.4 tp -75.8 147.63 39.05 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 127.399 2.28 . . . . 0.0 112.039 -178.647 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 9.5 mt-10 -73.46 150.84 41.35 Favored 'General case' 0 N--CA 1.473 0.684 0 O-C-N 120.54 -1.35 . . . . 0.0 113.095 179.351 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 17.9 m -82.67 153.25 3.93 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.768 0 C-N-CA 122.833 0.453 . . . . 0.0 111.212 175.201 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 48.2 t -74.29 135.43 42.6 Favored 'General case' 0 CA--C 1.539 0.526 0 N-CA-C 109.766 -0.457 . . . . 0.0 109.766 174.911 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 5.3 mpt_? -71.99 -41.21 67.93 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 125.203 1.401 . . . . 0.0 112.856 -177.087 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 17.1 mm-40 -72.69 -33.72 66.7 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 124.414 1.086 . . . . 0.0 111.773 179.969 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 83.5 t80 -62.18 -26.62 68.44 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 124.093 0.957 . . . . 0.0 111.759 175.29 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 77.4 mm-40 -60.61 -20.92 61.96 Favored 'General case' 0 N--CA 1.478 0.926 0 N-CA-C 113.637 0.977 . . . . 0.0 113.637 176.79 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -117.06 13.72 14.85 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 125.693 1.597 . . . . 0.0 112.106 177.083 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 59.14 36.8 90.2 Favored Glycine 0 CA--C 1.533 1.203 0 C-N-CA 125.092 1.329 . . . . 0.0 114.145 -179.78 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 7.2 t -127.54 13.18 7.0 Favored 'General case' 0 N--CA 1.479 1.01 0 N-CA-C 114.48 1.289 . . . . 0.0 114.48 -175.941 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 27.9 t -62.96 137.6 58.31 Favored 'General case' 0 CA--C 1.551 1.004 0 O-C-N 121.435 -0.79 . . . . 0.0 111.749 177.283 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 32.7 m -77.46 -2.99 38.14 Favored 'General case' 0 N--CA 1.475 0.814 0 N-CA-C 115.604 1.705 . . . . 0.0 115.604 -177.501 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 87.3 mtt180 -135.25 148.23 65.49 Favored Pre-proline 0 N--CA 1.475 0.797 0 C-N-CA 125.687 1.595 . . . . 0.0 112.561 -176.825 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -68.96 166.09 27.77 Favored 'Trans proline' 0 CA--C 1.543 0.959 0 C-N-CA 122.241 1.961 . . . . 0.0 110.132 173.348 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 7.4 p-10 -53.51 -28.66 32.34 Favored 'General case' 0 N--CA 1.475 0.792 0 N-CA-C 114.18 1.178 . . . . 0.0 114.18 178.817 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 12.6 p -77.94 -8.91 58.76 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 125.809 1.644 . . . . 0.0 115.02 178.452 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 39.5 mm-40 -124.9 -19.97 5.1 Favored 'General case' 0 N--CA 1.477 0.895 0 N-CA-C 116.315 1.968 . . . . 0.0 116.315 -172.908 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 4.7 t -69.73 170.13 11.53 Favored 'General case' 0 CA--C 1.551 1.011 0 N-CA-C 114.988 1.477 . . . . 0.0 114.988 -177.05 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -89.15 -6.99 56.56 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 127.877 2.471 . . . . 0.0 113.785 -179.762 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 56.2 m-85 -140.41 169.73 17.12 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 126.23 1.812 . . . . 0.0 110.507 178.328 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -78.61 145.93 34.43 Favored 'General case' 0 CA--C 1.548 0.866 0 O-C-N 121.12 -0.987 . . . . 0.0 113.3 -176.753 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 21.4 m170 -120.38 89.23 43.56 Favored Pre-proline 0 CA--C 1.555 1.141 0 C-N-CA 126.047 1.739 . . . . 0.0 110.535 -178.386 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -67.2 173.24 8.84 Favored 'Trans proline' 0 CA--C 1.542 0.924 0 C-N-CA 123.789 2.993 . . . . 0.0 114.943 -178.651 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 73.8 p -129.28 -178.9 4.85 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 126.089 1.756 . . . . 0.0 111.234 175.212 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 29.9 mtpp -49.89 -31.73 12.86 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 126.42 1.888 . . . . 0.0 115.203 -179.884 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 17.5 m -92.76 -25.63 18.09 Favored 'General case' 0 N--CA 1.477 0.913 0 N-CA-C 114.324 1.231 . . . . 0.0 114.324 -178.619 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 59.2 m -63.16 143.06 58.12 Favored 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 114.615 1.339 . . . . 0.0 114.615 -176.793 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 22.2 mt-30 -85.04 132.33 34.34 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 124.944 1.298 . . . . 0.0 110.844 176.689 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 12.8 t -129.11 135.28 62.36 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.731 0 C-N-CA 124.919 1.288 . . . . 0.0 110.677 -178.454 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -146.31 131.88 18.79 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 125.057 1.343 . . . . 0.0 111.234 178.218 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 63.0 t30 41.98 37.71 0.89 Allowed 'General case' 0 CA--C 1.553 1.076 0 C-N-CA 126.835 2.054 . . . . 0.0 116.379 177.405 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 85.78 16.17 64.1 Favored Glycine 0 CA--C 1.536 1.386 0 O-C-N 120.944 -1.098 . . . . 0.0 114.987 -179.751 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 66.5 mtt180 -136.02 161.15 36.47 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 125.6 1.56 . . . . 0.0 111.388 -179.633 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 3.1 m -139.21 144.24 29.64 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.62 0 C-N-CA 127.433 2.293 . . . . 0.0 109.562 -176.965 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 8.7 mt -94.81 126.72 47.18 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.764 0 O-C-N 121.385 -0.822 . . . . 0.0 110.811 -176.746 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -71.15 147.53 48.27 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 124.311 1.045 . . . . 0.0 112.032 178.186 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 23.7 t -70.27 99.87 1.61 Allowed 'General case' 0 C--O 1.24 0.563 0 C-N-CA 125.06 1.344 . . . . 0.0 112.301 -177.894 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 41.0 p90 -61.68 -38.18 86.84 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 115.413 -0.812 . . . . 0.0 110.316 175.531 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 62.2 m-20 -60.72 -44.33 96.77 Favored 'General case' 0 CA--C 1.539 0.545 0 O-C-N 121.856 -0.527 . . . . 0.0 110.444 176.402 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 37.7 t -64.48 -42.91 95.59 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 119.761 1.164 . . . . 0.0 111.447 177.51 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 30.7 mt -62.13 -40.46 96.0 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 124.179 0.992 . . . . 0.0 113.049 176.625 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 31.2 mmmt -83.19 -9.46 59.15 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 124.99 1.316 . . . . 0.0 113.856 179.266 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 81.82 38.36 14.04 Favored Glycine 0 CA--C 1.536 1.402 0 C-N-CA 124.642 1.115 . . . . 0.0 114.269 179.281 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 19.7 tpp180 -120.46 -22.4 6.47 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 126.568 1.947 . . . . 0.0 114.67 -176.893 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 5.4 t . . . . . 0 CA--C 1.546 0.789 0 CA-C-N 119.277 0.944 . . . . 0.0 113.372 -177.391 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 7.0 t . . . . . 0 CA--C 1.544 0.734 0 CA-C-O 121.691 0.758 . . . . 0.0 112.276 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 32.2 mtmt -84.8 8.15 18.26 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 124.742 1.217 . . . . 0.0 114.137 -176.971 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 89.0 m-85 -128.61 157.74 40.43 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 125.696 1.598 . . . . 0.0 111.488 -177.066 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -79.5 114.02 18.11 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 124.122 0.969 . . . . 0.0 112.289 -177.015 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 10.4 m170 -68.62 119.17 66.97 Favored Pre-proline 0 CA--C 1.545 0.764 0 N-CA-C 105.7 -1.963 . . . . 0.0 105.7 170.966 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -71.46 128.86 14.99 Favored 'Trans proline' 0 CA--C 1.542 0.906 0 C-N-CA 121.865 1.71 . . . . 0.0 114.556 -169.906 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 97.6 Cg_endo -78.69 155.22 27.3 Favored 'Trans proline' 0 CA--C 1.543 0.929 0 C-N-CA 123.403 2.735 . . . . 0.0 112.116 178.751 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 82.9 Cg_exo -45.97 -39.81 19.91 Favored 'Trans proline' 0 CA--C 1.54 0.782 0 C-N-CA 124.454 3.436 . . . . 0.0 115.976 179.385 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 18.3 m-70 -71.48 -15.71 62.33 Favored 'General case' 0 N--CA 1.477 0.89 0 N-CA-C 114.965 1.468 . . . . 0.0 114.965 179.356 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 78.6 mt -115.36 -18.06 11.13 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 124.468 1.107 . . . . 0.0 113.109 -179.776 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 59.2 mtpt -54.56 -38.23 66.41 Favored 'General case' 0 N--CA 1.476 0.849 0 CA-C-N 119.661 1.119 . . . . 0.0 111.328 173.872 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 25.0 m -62.58 -42.66 99.69 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 124.115 0.966 . . . . 0.0 111.673 176.235 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 89.4 mm-40 -67.25 -44.58 79.05 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 123.739 0.815 . . . . 0.0 110.807 178.323 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 93.2 mt -62.24 -46.54 88.41 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 123.992 0.917 . . . . 0.0 112.341 178.417 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -65.14 -30.48 71.41 Favored 'General case' 0 N--CA 1.476 0.838 0 CA-C-N 120.044 1.293 . . . . 0.0 113.191 178.863 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 64.1 mt -71.73 -43.49 70.04 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.757 0 O-C-N 121.367 -0.833 . . . . 0.0 109.583 175.744 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 22.8 m-80 -64.96 -33.72 76.7 Favored 'General case' 0 CA--C 1.542 0.654 0 O-C-N 121.683 -0.636 . . . . 0.0 111.289 174.826 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.848 0 C-N-CA 124.518 1.056 . . . . 0.0 111.414 177.193 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 74.9 mtm . . . . . 0 CA--C 1.538 0.49 0 N-CA-C 113.67 0.989 . . . . 0.0 113.67 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -49.48 -22.73 1.29 Allowed 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 127.397 2.279 . . . . 0.0 116.449 -178.582 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 31.2 m -133.76 19.67 1.32 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.875 0 C-N-CA 125.841 1.656 . . . . 0.0 112.635 -178.547 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 72.7 p -149.42 -22.25 0.28 Allowed 'General case' 0 N--CA 1.477 0.883 0 N-CA-C 116.527 2.047 . . . . 0.0 116.527 -177.572 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 19.2 t -139.39 -32.15 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.236 0 CA-C-N 119.816 1.189 . . . . 0.0 113.255 -178.865 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 22.9 p -129.81 107.26 16.86 Favored Pre-proline 0 N--CA 1.478 0.949 0 C-N-CA 124.714 1.206 . . . . 0.0 111.939 -178.367 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 83.0 Cg_endo -74.36 -13.28 23.0 Favored 'Trans proline' 0 CA--C 1.539 0.762 0 C-N-CA 123.144 2.562 . . . . 0.0 114.592 -178.659 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 18.1 tt -75.41 41.67 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.554 1.128 0 C-N-CA 127.453 2.301 . . . . 0.0 112.428 178.152 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 19.0 ptt-85 -62.21 -16.32 52.51 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 126.341 1.856 . . . . 0.0 115.732 -178.905 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 1.4 p30 -150.98 172.76 15.19 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 124.965 1.306 . . . . 0.0 112.681 178.13 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 29.6 p -135.49 30.79 3.17 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 126.588 1.955 . . . . 0.0 111.613 -178.798 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 8.7 ptpp? -47.37 -32.58 5.03 Favored 'General case' 0 N--CA 1.482 1.162 0 N-CA-C 116.208 1.929 . . . . 0.0 116.208 -175.4 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -94.27 -20.72 19.54 Favored 'General case' 0 CA--C 1.541 0.624 0 N-CA-C 113.936 1.087 . . . . 0.0 113.936 -178.876 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 81.8 mt -95.06 -22.25 18.03 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 125.894 1.677 . . . . 0.0 114.344 -177.174 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 4.6 m -73.53 74.67 1.46 Allowed 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 125.035 1.334 . . . . 0.0 111.206 -179.238 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 8.5 tp -75.65 142.66 42.53 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 127.234 2.213 . . . . 0.0 111.64 -177.62 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 12.8 mt-10 -72.17 152.15 42.46 Favored 'General case' 0 N--CA 1.47 0.548 0 O-C-N 120.684 -1.26 . . . . 0.0 112.796 179.613 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 14.9 m -84.01 153.44 3.72 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.811 0 C-N-CA 122.737 0.415 . . . . 0.0 110.483 175.093 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 34.9 t -73.48 134.01 43.79 Favored 'General case' 0 CA--C 1.539 0.528 0 N-CA-C 109.724 -0.472 . . . . 0.0 109.724 175.77 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 5.7 mpt_? -68.99 -43.18 75.39 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 124.898 1.279 . . . . 0.0 112.675 -176.958 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 12.8 mm-40 -70.41 -34.49 72.58 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 124.461 1.105 . . . . 0.0 111.947 -179.549 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 78.3 t80 -61.92 -27.0 68.51 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 124.145 0.978 . . . . 0.0 111.753 175.553 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 71.7 mm-40 -61.86 -21.5 64.72 Favored 'General case' 0 N--CA 1.478 0.93 0 N-CA-C 113.734 1.013 . . . . 0.0 113.734 177.185 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -118.62 13.66 13.41 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 125.521 1.528 . . . . 0.0 112.054 177.375 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 59.83 37.11 92.03 Favored Glycine 0 CA--C 1.533 1.165 0 C-N-CA 124.821 1.2 . . . . 0.0 113.933 -179.207 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 6.1 t -124.93 16.26 8.57 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 124.563 1.145 . . . . 0.0 113.66 -176.446 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 12.4 t -66.0 169.96 6.15 Favored 'General case' 0 CA--C 1.558 1.26 0 C-N-CA 124.245 1.018 . . . . 0.0 111.048 173.978 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 94.5 p -128.82 4.01 5.42 Favored 'General case' 0 N--CA 1.477 0.918 0 N-CA-C 115.673 1.731 . . . . 0.0 115.673 -175.646 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 53.1 mtt-85 -133.39 147.29 64.26 Favored Pre-proline 0 N--CA 1.474 0.744 0 C-N-CA 126.12 1.768 . . . . 0.0 111.027 179.403 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 93.5 Cg_endo -72.64 167.73 26.35 Favored 'Trans proline' 0 CA--C 1.541 0.836 0 C-N-CA 122.251 1.968 . . . . 0.0 109.929 175.42 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -53.91 -30.12 44.89 Favored 'General case' 0 N--CA 1.474 0.766 0 O-C-N 121.32 -0.863 . . . . 0.0 112.936 176.329 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 28.1 p -73.95 -10.21 59.41 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 125.536 1.534 . . . . 0.0 115.059 178.427 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -135.25 -13.4 2.08 Favored 'General case' 0 N--CA 1.478 0.952 0 N-CA-C 116.818 2.155 . . . . 0.0 116.818 -176.132 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 5.1 t -70.62 162.3 29.18 Favored 'General case' 0 CA--C 1.552 1.024 0 CA-C-N 120.553 1.524 . . . . 0.0 113.709 -178.969 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -77.01 -12.19 59.9 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 126.78 2.032 . . . . 0.0 114.106 -179.814 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 62.0 m-85 -137.92 172.87 12.3 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 126.191 1.797 . . . . 0.0 110.571 179.287 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -80.67 149.94 29.58 Favored 'General case' 0 CA--C 1.549 0.915 0 O-C-N 121.147 -0.97 . . . . 0.0 113.097 -177.311 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 65.3 m170 -124.81 89.9 51.78 Favored Pre-proline 0 CA--C 1.552 1.021 0 C-N-CA 125.828 1.651 . . . . 0.0 111.243 -179.097 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 31.1 Cg_endo -62.08 143.05 94.38 Favored 'Trans proline' 0 CA--C 1.542 0.907 0 C-N-CA 123.11 2.54 . . . . 0.0 112.729 179.542 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 45.8 p -80.13 -84.94 0.09 Allowed 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 124.799 1.24 . . . . 0.0 113.678 -178.732 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 35.7 mtmm -144.49 -55.87 0.35 Allowed 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 126.979 2.112 . . . . 0.0 111.579 -179.054 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 35.3 m -76.27 -17.95 59.22 Favored 'General case' 0 N--CA 1.477 0.914 0 N-CA-C 113.234 0.828 . . . . 0.0 113.234 178.184 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 73.9 m -57.34 124.19 18.02 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 124.801 1.24 . . . . 0.0 112.341 179.942 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 56.8 tt0 -87.67 134.85 33.58 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 124.869 1.267 . . . . 0.0 110.566 179.169 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 1.6 m -124.3 148.32 28.57 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.599 0 C-N-CA 125.315 1.446 . . . . 0.0 110.937 179.85 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 70.9 mm-40 -141.32 133.57 28.02 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 125.302 1.441 . . . . 0.0 110.152 179.312 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 63.1 t30 44.23 35.8 1.36 Allowed 'General case' 0 CA--C 1.555 1.144 0 N-CA-C 116.002 1.853 . . . . 0.0 116.002 177.963 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 83.9 20.14 60.06 Favored Glycine 0 CA--C 1.538 1.512 0 O-C-N 120.914 -1.116 . . . . 0.0 114.823 -179.246 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 43.1 mtt180 -139.34 163.46 32.43 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 125.703 1.601 . . . . 0.0 111.843 -178.69 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 2.9 m -137.29 135.13 47.27 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.692 0 C-N-CA 126.942 2.097 . . . . 0.0 110.276 -177.719 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 78.4 mt -83.9 125.85 40.18 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.546 0 O-C-N 121.541 -0.724 . . . . 0.0 109.855 -179.202 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -70.72 143.66 51.21 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 123.8 0.84 . . . . 0.0 110.447 176.358 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 17.2 t -65.08 98.86 0.32 Allowed 'General case' 0 C--O 1.239 0.536 0 C-N-CA 124.494 1.117 . . . . 0.0 113.091 -176.921 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 33.4 p90 -62.37 -37.36 85.42 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 115.188 -0.915 . . . . 0.0 109.971 175.391 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 70.7 m-20 -61.46 -43.61 98.56 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 118.522 0.601 . . . . 0.0 110.394 176.339 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 40.2 t -64.88 -43.32 93.3 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 119.773 1.169 . . . . 0.0 111.488 177.336 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 25.8 mt -64.64 -42.73 95.26 Favored 'General case' 0 CA--C 1.543 0.699 0 N-CA-C 113.555 0.946 . . . . 0.0 113.555 177.246 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 31.0 mmmt -80.59 -18.63 47.68 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 124.713 1.205 . . . . 0.0 113.836 -179.427 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 96.21 41.32 3.76 Favored Glycine 0 CA--C 1.537 1.454 0 C-N-CA 124.582 1.087 . . . . 0.0 114.943 177.911 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 50.5 tpt85 -126.75 -22.3 3.91 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 126.247 1.819 . . . . 0.0 115.213 -177.343 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 5.0 t -65.13 141.9 58.54 Favored 'General case' 0 CA--C 1.545 0.775 0 CA-C-N 119.997 1.271 . . . . 0.0 113.714 -175.737 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 80.4 p -152.65 8.83 0.45 Allowed 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 126.798 2.039 . . . . 0.0 113.177 -179.892 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 77.7 mtm-85 -69.93 162.99 26.98 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 126.2 1.8 . . . . 0.0 113.861 -178.641 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -119.39 -1.77 10.7 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 125.845 1.658 . . . . 0.0 112.312 176.181 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 16.3 m120 -143.35 36.75 1.35 Allowed 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 128.058 2.543 . . . . 0.0 109.973 179.305 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 9.1 t -52.54 126.54 19.86 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 125.217 1.407 . . . . 0.0 111.409 -178.442 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 23.6 mtmt -82.43 1.03 39.43 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 123.922 0.889 . . . . 0.0 113.242 -178.645 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 76.4 m-85 -120.37 150.01 41.43 Favored 'General case' 0 C--N 1.326 -0.429 0 C-N-CA 124.581 1.152 . . . . 0.0 111.611 -174.413 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -75.09 111.66 10.54 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 123.411 0.685 . . . . 0.0 111.99 -176.323 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 11.5 m170 -65.26 119.83 62.49 Favored Pre-proline 0 CA--C 1.545 0.787 0 N-CA-C 105.212 -2.144 . . . . 0.0 105.212 171.413 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -69.06 125.18 12.18 Favored 'Trans proline' 0 CA--C 1.543 0.94 0 C-N-CA 122.028 1.819 . . . . 0.0 114.528 -169.803 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 90.3 Cg_endo -78.02 154.87 29.7 Favored 'Trans proline' 0 CA--C 1.542 0.882 0 C-N-CA 123.403 2.735 . . . . 0.0 111.734 178.851 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 81.2 Cg_exo -47.47 -41.74 29.09 Favored 'Trans proline' 0 CA--C 1.538 0.723 0 C-N-CA 123.905 3.07 . . . . 0.0 115.176 179.287 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 6.4 t60 -65.35 -22.82 66.86 Favored 'General case' 0 N--CA 1.476 0.843 0 N-CA-C 114.437 1.273 . . . . 0.0 114.437 179.267 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 67.7 mt -111.11 -17.89 13.13 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 124.332 1.053 . . . . 0.0 113.027 -179.608 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 25.5 mtpp -55.96 -38.55 70.51 Favored 'General case' 0 N--CA 1.475 0.816 0 CA-C-N 120.144 1.338 . . . . 0.0 110.882 173.678 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 24.0 m -59.27 -43.3 92.51 Favored 'General case' 0 N--CA 1.474 0.734 0 CA-C-N 118.621 0.646 . . . . 0.0 110.933 176.62 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 17.4 mm100 -67.71 -47.88 68.1 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 123.537 0.735 . . . . 0.0 111.101 177.647 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 88.4 mt -60.76 -40.82 93.93 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 124.168 0.987 . . . . 0.0 112.618 178.462 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -55.34 -52.75 62.49 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 124.416 1.087 . . . . 0.0 110.6 175.226 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 73.3 mt -69.61 -37.94 75.45 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.436 0 C-N-CA 125.81 1.644 . . . . 0.0 111.386 -176.27 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 93.1 m-20 -63.82 -40.64 97.09 Favored 'General case' 0 CA--C 1.543 0.675 0 O-C-N 121.586 -0.696 . . . . 0.0 110.372 173.87 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -67.27 -48.68 57.28 Favored Glycine 0 CA--C 1.529 0.918 0 C-N-CA 124.139 0.876 . . . . 0.0 111.679 177.657 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 71.5 mtp180 -54.8 -31.56 59.16 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 124.709 1.204 . . . . 0.0 112.716 176.517 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 54.7 t30 -70.08 -9.18 54.59 Favored 'General case' 0 CA--C 1.552 1.045 0 N-CA-C 114.085 1.143 . . . . 0.0 114.085 176.891 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 11.1 t-20 -130.73 -34.73 1.5 Allowed 'General case' 0 CA--C 1.543 0.686 0 N-CA-C 114.628 1.344 . . . . 0.0 114.628 -179.331 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 8.2 mp -57.91 -22.15 47.06 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 124.534 1.134 . . . . 0.0 113.567 178.339 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 32.1 pt -66.17 -9.23 8.25 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 C-N-CA 126.481 1.912 . . . . 0.0 114.451 176.534 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 37.0 tt0 -141.17 133.29 27.87 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 124.546 1.139 . . . . 0.0 111.725 -179.422 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -154.27 152.67 30.57 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 125.395 1.478 . . . . 0.0 110.578 178.921 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 55.7 tptt -137.11 -22.34 1.18 Allowed 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 125.764 1.625 . . . . 0.0 113.754 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 34.0 t-20 . . . . . 0 CA--C 1.542 0.657 0 C-N-CA 124.985 1.314 . . . . 0.0 111.109 179.423 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.5 ptt? . . . . . 0 CA--C 1.544 0.748 0 N-CA-C 114.068 1.136 . . . . 0.0 114.068 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -151.37 166.64 30.38 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 125.921 1.689 . . . . 0.0 111.929 -179.996 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 35.8 m -128.75 -0.3 3.12 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.245 0 C-N-CA 125.194 1.398 . . . . 0.0 114.033 -179.475 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 11.8 t -155.82 163.48 39.76 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 125.718 1.607 . . . . 0.0 110.95 178.29 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 8.8 p -154.08 -23.52 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.48 1.047 0 C-N-CA 124.987 1.315 . . . . 0.0 113.926 -179.687 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 36.4 p -66.41 149.08 98.3 Favored Pre-proline 0 N--CA 1.476 0.831 0 N-CA-C 113.984 1.105 . . . . 0.0 113.984 -179.003 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 64.3 Cg_endo -75.94 -177.46 3.65 Favored 'Trans proline' 0 CA--C 1.546 1.114 0 C-N-CA 123.554 2.836 . . . . 0.0 110.774 174.314 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 9.6 tp -57.32 152.81 2.7 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.861 0 C-N-CA 124.387 1.075 . . . . 0.0 111.635 176.171 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 1.9 mpt_? -126.32 151.5 47.46 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 124.786 1.234 . . . . 0.0 112.386 -178.418 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -80.71 -7.62 59.4 Favored 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 124.813 1.245 . . . . 0.0 112.853 176.92 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 44.8 p -67.62 8.92 0.3 Allowed 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 127.774 2.43 . . . . 0.0 115.662 -179.155 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 38.1 ttpt -46.32 -42.7 15.07 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 125.695 1.598 . . . . 0.0 114.157 -179.175 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -77.22 -21.67 53.48 Favored 'General case' 0 N--CA 1.474 0.734 0 N-CA-C 113.865 1.061 . . . . 0.0 113.865 179.011 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 78.3 mt -95.53 -18.69 20.42 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 126.489 1.916 . . . . 0.0 114.199 -178.328 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 7.2 m -78.41 79.4 4.85 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 125.082 1.353 . . . . 0.0 110.762 -178.138 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -76.55 144.4 39.71 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 128.196 2.598 . . . . 0.0 111.075 -177.569 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 9.2 mt-10 -73.74 150.83 40.89 Favored 'General case' 0 N--CA 1.472 0.665 0 O-C-N 120.788 -1.195 . . . . 0.0 111.659 175.789 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 16.3 m -81.14 149.05 5.09 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.783 0 N-CA-C 109.404 -0.591 . . . . 0.0 109.404 173.568 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 42.4 t -63.9 126.86 29.02 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-O 121.98 0.895 . . . . 0.0 111.244 179.08 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 3.3 mpt_? -63.7 -26.02 68.47 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 124.743 1.217 . . . . 0.0 113.151 -177.317 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 13.9 mm-40 -82.8 -37.77 24.04 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-O 121.136 0.493 . . . . 0.0 109.785 177.017 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 61.2 t80 -62.67 -30.37 71.33 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 124.759 1.224 . . . . 0.0 111.076 174.677 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 79.5 mt-30 -59.48 -21.41 60.07 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.667 0.787 . . . . 0.0 112.869 175.088 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 3.5 mpt_? -118.33 14.47 13.82 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 126.171 1.788 . . . . 0.0 111.842 178.009 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 58.48 36.38 84.29 Favored Glycine 0 CA--C 1.534 1.251 0 C-N-CA 125.225 1.393 . . . . 0.0 114.194 -179.992 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 6.7 t -128.49 16.63 6.5 Favored 'General case' 0 N--CA 1.476 0.87 0 N-CA-C 114.727 1.38 . . . . 0.0 114.727 -175.85 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 10.2 t -68.06 172.05 6.12 Favored 'General case' 0 CA--C 1.559 1.289 0 O-C-N 121.542 -0.724 . . . . 0.0 110.487 173.104 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 51.1 m -133.98 11.88 3.95 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 125.332 1.453 . . . . 0.0 114.764 -176.114 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 70.2 mtm-85 -134.85 146.38 58.56 Favored Pre-proline 0 N--CA 1.476 0.843 0 C-N-CA 125.281 1.433 . . . . 0.0 112.625 -176.906 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -68.68 166.15 27.04 Favored 'Trans proline' 0 CA--C 1.542 0.885 0 C-N-CA 122.154 1.903 . . . . 0.0 109.96 172.457 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 -54.24 -27.75 36.8 Favored 'General case' 0 N--CA 1.474 0.764 0 N-CA-C 113.725 1.009 . . . . 0.0 113.725 177.762 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 11.7 p -76.82 -11.88 59.89 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 125.491 1.516 . . . . 0.0 114.953 178.588 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 51.2 mm-40 -119.59 -27.26 5.55 Favored 'General case' 0 N--CA 1.476 0.869 0 N-CA-C 116.063 1.875 . . . . 0.0 116.063 -174.468 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 3.3 t -67.93 163.77 21.34 Favored 'General case' 0 CA--C 1.548 0.872 0 N-CA-C 115.773 1.768 . . . . 0.0 115.773 -175.033 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.61 -11.94 59.99 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 127.881 2.472 . . . . 0.0 112.659 -179.989 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 75.6 m-85 -143.07 172.99 11.96 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 126.711 2.004 . . . . 0.0 110.138 179.957 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -79.32 152.56 30.41 Favored 'General case' 0 CA--C 1.547 0.848 0 N-CA-C 114.291 1.219 . . . . 0.0 114.291 -177.787 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 63.3 m170 -126.43 89.6 51.84 Favored Pre-proline 0 CA--C 1.551 0.99 0 C-N-CA 126.138 1.775 . . . . 0.0 109.637 178.21 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 33.6 Cg_endo -63.48 148.08 92.8 Favored 'Trans proline' 0 CA--C 1.539 0.775 0 C-N-CA 123.052 2.501 . . . . 0.0 114.648 -177.367 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 58.2 p -87.29 -173.47 4.41 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 125.445 1.498 . . . . 0.0 112.245 176.061 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 67.9 mttm -62.42 -19.38 63.41 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 125.704 1.602 . . . . 0.0 113.478 173.828 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 61.1 p -109.11 -24.04 11.36 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 125.062 1.345 . . . . 0.0 114.326 -179.965 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 82.6 m -60.98 129.13 39.85 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-N 119.329 0.968 . . . . 0.0 112.902 179.839 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 67.1 tp60 -81.41 135.1 35.64 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 124.171 0.988 . . . . 0.0 110.411 177.628 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 15.0 t -117.48 144.68 24.73 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.819 0 C-N-CA 125.693 1.597 . . . . 0.0 109.299 -179.823 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 50.3 mt-10 -146.16 124.43 12.26 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 125.698 1.599 . . . . 0.0 110.404 179.5 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 62.9 t30 43.64 36.94 1.35 Allowed 'General case' 0 CA--C 1.554 1.133 0 N-CA-C 116.357 1.984 . . . . 0.0 116.357 178.043 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 86.49 16.96 61.17 Favored Glycine 0 CA--C 1.537 1.457 0 O-C-N 120.929 -1.107 . . . . 0.0 114.875 -179.873 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 62.8 mtt180 -138.24 163.73 31.01 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 126.373 1.869 . . . . 0.0 110.807 -179.536 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 5.1 m -139.63 144.2 29.12 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.506 0 C-N-CA 126.994 2.118 . . . . 0.0 109.323 -177.918 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 60.4 mt -94.06 132.82 37.1 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.729 0 O-C-N 121.146 -0.971 . . . . 0.0 110.112 -177.925 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -74.43 148.99 40.64 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 124.156 0.982 . . . . 0.0 112.465 178.344 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 7.8 t -69.2 95.72 0.78 Allowed 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 125.025 1.33 . . . . 0.0 109.981 179.531 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 27.2 p90 -58.01 -36.32 72.51 Favored 'General case' 0 N--CA 1.467 0.385 0 C-N-CA 123.439 0.695 . . . . 0.0 111.417 179.373 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 74.5 m-20 -58.5 -36.23 73.46 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.439 0.696 . . . . 0.0 111.447 177.144 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 47.7 t -70.87 -38.22 73.09 Favored 'General case' 0 CA--C 1.54 0.583 0 O-C-N 121.149 -0.969 . . . . 0.0 111.642 178.251 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 50.0 mt -69.26 -42.66 75.29 Favored 'General case' 0 N--CA 1.474 0.732 0 O-C-N 121.316 -0.865 . . . . 0.0 112.352 175.205 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 31.3 mmmt -75.56 -9.94 59.02 Favored 'General case' 0 N--CA 1.478 0.925 0 C-N-CA 125.038 1.335 . . . . 0.0 113.844 -179.992 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 78.44 37.06 28.55 Favored Glycine 0 CA--C 1.536 1.346 0 C-N-CA 124.414 1.007 . . . . 0.0 113.82 179.519 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 51.1 ttp180 -119.86 -22.55 6.74 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 126.852 2.061 . . . . 0.0 114.256 -177.016 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 3.7 t -68.38 140.49 55.84 Favored 'General case' 0 CA--C 1.545 0.771 0 CA-C-O 122.245 1.021 . . . . 0.0 113.604 -177.639 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 82.0 p -150.1 9.21 0.66 Allowed 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 128.088 2.555 . . . . 0.0 111.526 177.131 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 27.8 ttm105 -76.57 164.66 25.71 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 128.732 2.813 . . . . 0.0 111.892 -178.833 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -133.04 10.63 4.21 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 124.736 1.215 . . . . 0.0 113.36 -179.632 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 37.4 p-10 -144.38 30.09 1.26 Allowed 'General case' 0 CA--C 1.549 0.906 0 C-N-CA 125.579 1.551 . . . . 0.0 113.483 -178.463 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 86.2 m -49.88 143.67 7.42 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 124.842 1.257 . . . . 0.0 113.684 -179.246 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 43.0 mtmt -93.42 9.15 37.67 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 124.698 1.199 . . . . 0.0 111.16 173.188 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 70.1 m-85 -129.91 149.27 51.71 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 126.797 2.039 . . . . 0.0 111.351 -173.602 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -74.74 117.1 16.19 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 124.312 1.045 . . . . 0.0 112.901 -176.046 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 1.8 m-70 -67.67 121.58 79.91 Favored Pre-proline 0 CA--C 1.544 0.726 0 CA-C-O 118.194 -0.908 . . . . 0.0 108.829 173.994 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 67.6 Cg_exo -45.68 107.7 0.12 Allowed 'Trans proline' 0 CA--C 1.543 0.969 0 C-N-CA 124.894 3.729 . . . . 0.0 115.392 -178.649 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 98.4 Cg_endo -76.34 155.25 36.79 Favored 'Trans proline' 0 CA--C 1.541 0.857 0 C-N-CA 121.515 1.476 . . . . 0.0 110.606 176.362 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_endo -56.19 -29.68 76.57 Favored 'Trans proline' 0 CA--C 1.54 0.816 0 C-N-CA 123.169 2.579 . . . . 0.0 114.839 -177.664 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 11.8 m-70 -80.15 -14.44 58.47 Favored 'General case' 0 N--CA 1.476 0.853 0 N-CA-C 114.598 1.333 . . . . 0.0 114.598 177.238 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 73.6 mt -116.18 -15.84 11.04 Favored 'General case' 0 N--CA 1.476 0.833 0 CA-C-N 119.394 0.997 . . . . 0.0 113.353 179.63 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 67.2 mttt -52.5 -37.43 57.37 Favored 'General case' 0 N--CA 1.476 0.873 0 CA-C-N 119.76 1.163 . . . . 0.0 111.186 173.273 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 19.4 m -63.37 -44.25 95.29 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 123.722 0.809 . . . . 0.0 111.21 176.431 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 18.5 mm100 -67.93 -42.93 80.28 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 124.067 0.947 . . . . 0.0 111.546 178.636 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 80.5 mt -61.47 -47.59 84.96 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 123.846 0.858 . . . . 0.0 110.996 177.284 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 3.8 pt-20 -64.54 -37.2 86.74 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 119.651 1.114 . . . . 0.0 112.232 177.615 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 60.7 mt -62.9 -46.66 95.78 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.691 0 CA-C-N 119.395 0.998 . . . . 0.0 110.051 177.216 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 16.1 t-20 -63.35 -41.01 98.83 Favored 'General case' 0 CA--C 1.545 0.767 0 CA-C-N 118.598 0.635 . . . . 0.0 111.091 177.585 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -62.7 -48.51 80.79 Favored Glycine 0 CA--C 1.534 1.258 0 O-C-N 121.421 -0.799 . . . . 0.0 111.924 176.942 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 61.0 mtp180 -58.69 -43.71 90.05 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 125.281 1.432 . . . . 0.0 111.069 176.352 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 57.2 t30 -61.54 -5.15 1.64 Allowed 'General case' 0 CA--C 1.552 1.052 0 C-N-CA 125.572 1.549 . . . . 0.0 114.15 175.65 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 62.2 m-80 -125.24 10.9 8.09 Favored 'General case' 0 CA--C 1.552 1.057 0 C-N-CA 126.517 1.927 . . . . 0.0 112.013 177.176 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 49.1 tp -122.56 -22.35 5.45 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 126.944 2.098 . . . . 0.0 112.315 179.069 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 3.1 pt -37.62 100.79 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.478 0.957 0 C-N-CA 129.032 2.933 . . . . 0.0 114.204 176.218 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 85.4 mt-30 -63.3 -16.03 59.09 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 124.888 1.275 . . . . 0.0 113.447 179.316 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 23.5 mp0 -56.81 -27.04 59.31 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 125.937 1.695 . . . . 0.0 112.652 177.5 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 59.6 mtpt -70.51 -19.84 62.88 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 124.825 1.25 . . . . 0.0 113.36 176.807 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 35.0 p30 . . . . . 0 CA--C 1.54 0.593 0 C-N-CA 125.849 1.66 . . . . 0.0 111.211 -179.815 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.1 ptp . . . . . 0 CA--C 1.545 0.751 0 N-CA-C 114.058 1.132 . . . . 0.0 114.058 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -148.72 166.1 29.4 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 125.768 1.627 . . . . 0.0 112.177 -179.872 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 29.9 m -140.34 165.87 20.42 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.027 0 C-N-CA 126.163 1.785 . . . . 0.0 111.467 179.669 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 63.2 m -138.92 160.45 39.72 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 125.273 1.429 . . . . 0.0 112.047 -179.445 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 40.3 t -64.08 145.1 14.05 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.976 0 C-N-CA 124.835 1.254 . . . . 0.0 110.896 178.841 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 11.8 p -62.18 154.38 70.51 Favored Pre-proline 0 N--CA 1.477 0.893 0 C-N-CA 125.274 1.43 . . . . 0.0 113.246 178.572 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 69.4 Cg_endo -68.43 159.76 52.04 Favored 'Trans proline' 0 CA--C 1.542 0.913 0 C-N-CA 123.103 2.536 . . . . 0.0 113.013 179.904 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 45.7 pt -135.51 22.71 0.98 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.143 0 C-N-CA 125.954 1.702 . . . . 0.0 112.712 -178.736 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 85.8 mmt-85 -135.68 34.34 2.93 Favored 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 126.35 1.86 . . . . 0.0 112.28 -177.645 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -52.64 -27.61 17.89 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 125.638 1.575 . . . . 0.0 114.15 -179.187 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 26.7 p -65.09 -3.72 4.02 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 125.482 1.513 . . . . 0.0 114.809 177.436 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 76.1 tttt -43.76 -46.51 7.68 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 126.838 2.055 . . . . 0.0 113.357 176.256 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -79.32 -20.43 47.93 Favored 'General case' 0 N--CA 1.474 0.771 0 N-CA-C 114.224 1.194 . . . . 0.0 114.224 -179.331 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 96.2 mt -91.3 -9.93 43.22 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 127.233 2.213 . . . . 0.0 114.954 -176.542 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 7.5 m -78.28 79.18 4.73 Favored 'General case' 0 N--CA 1.475 0.818 0 CA-C-O 122.336 1.065 . . . . 0.0 110.705 -179.175 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 12.4 tp -75.79 142.0 42.4 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 128.81 2.844 . . . . 0.0 112.023 -177.6 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -70.29 150.17 46.64 Favored 'General case' 0 N--CA 1.475 0.786 0 O-C-N 120.46 -1.4 . . . . 0.0 112.137 177.083 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 27.2 m -84.86 151.97 3.72 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.88 0 N-CA-C 109.676 -0.49 . . . . 0.0 109.676 172.104 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 51.3 t -67.54 125.78 27.25 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-O 121.804 0.812 . . . . 0.0 111.434 178.209 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 3.0 mpt_? -63.91 -26.21 68.49 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 124.763 1.225 . . . . 0.0 112.954 -178.158 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 11.1 mm-40 -81.79 -38.4 25.64 Favored 'General case' 0 CA--C 1.538 0.492 0 N-CA-C 109.662 -0.496 . . . . 0.0 109.662 176.877 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 59.7 t80 -63.84 -33.41 75.62 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 124.782 1.233 . . . . 0.0 110.969 175.093 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 84.7 mt-30 -59.31 -24.07 62.99 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 123.701 0.801 . . . . 0.0 112.396 174.277 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 72.9 mtt85 -114.95 12.49 16.81 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 126.453 1.901 . . . . 0.0 112.582 -175.582 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 58.19 34.95 75.51 Favored Glycine 0 CA--C 1.534 1.231 0 C-N-CA 125.256 1.407 . . . . 0.0 113.927 -179.828 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 6.7 t -131.89 14.67 4.8 Favored 'General case' 0 N--CA 1.474 0.762 0 N-CA-C 114.942 1.46 . . . . 0.0 114.942 -175.169 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 8.8 t -67.69 172.54 5.12 Favored 'General case' 0 CA--C 1.557 1.214 0 O-C-N 121.366 -0.834 . . . . 0.0 110.689 173.822 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 89.9 p -140.48 10.69 2.29 Favored 'General case' 0 N--CA 1.477 0.905 0 N-CA-C 115.349 1.611 . . . . 0.0 115.349 -176.309 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 59.0 mtm-85 -131.72 147.08 64.58 Favored Pre-proline 0 N--CA 1.474 0.731 0 C-N-CA 125.522 1.529 . . . . 0.0 112.405 -178.074 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -68.52 165.96 27.39 Favored 'Trans proline' 0 CA--C 1.542 0.889 0 C-N-CA 121.943 1.762 . . . . 0.0 109.633 171.82 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 7.1 p-10 -53.31 -31.8 45.8 Favored 'General case' 0 N--CA 1.473 0.724 0 O-C-N 121.268 -0.895 . . . . 0.0 113.244 177.826 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 22.7 p -72.76 -9.36 58.56 Favored 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 115.136 1.532 . . . . 0.0 115.136 178.468 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 19.8 mt-10 -122.47 -25.41 4.77 Favored 'General case' 0 N--CA 1.477 0.882 0 N-CA-C 115.9 1.815 . . . . 0.0 115.9 -176.421 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 3.0 t -69.68 164.02 24.37 Favored 'General case' 0 CA--C 1.547 0.829 0 N-CA-C 115.195 1.554 . . . . 0.0 115.195 -176.614 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -79.51 -11.14 59.9 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 127.186 2.194 . . . . 0.0 113.764 -179.495 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 65.9 m-85 -141.67 175.55 9.61 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 126.393 1.877 . . . . 0.0 110.673 -179.446 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -79.58 149.97 31.21 Favored 'General case' 0 CA--C 1.547 0.85 0 O-C-N 120.986 -1.071 . . . . 0.0 113.253 -178.078 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 65.2 m170 -123.88 91.99 49.0 Favored Pre-proline 0 CA--C 1.55 0.962 0 C-N-CA 125.785 1.634 . . . . 0.0 110.412 178.859 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_endo -63.0 162.3 26.41 Favored 'Trans proline' 0 CA--C 1.54 0.81 0 C-N-CA 123.356 2.704 . . . . 0.0 114.155 -179.224 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 84.6 p -131.6 -172.26 2.81 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 125.858 1.663 . . . . 0.0 112.531 178.84 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 60.4 pttt -27.14 -48.84 0.04 OUTLIER 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 129.345 3.058 . . . . 0.0 118.425 -175.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 5.5 p -109.66 -12.11 14.68 Favored 'General case' 0 N--CA 1.475 0.806 0 N-CA-C 115.697 1.74 . . . . 0.0 115.697 -176.286 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 66.7 m -57.9 128.63 38.04 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 124.546 1.138 . . . . 0.0 113.977 -176.835 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 44.4 tt0 -81.0 125.72 30.5 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 125.575 1.55 . . . . 0.0 110.215 178.333 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 23.2 t -119.67 133.43 66.47 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.976 0 C-N-CA 125.861 1.665 . . . . 0.0 109.608 -178.222 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -144.74 131.39 19.99 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 124.859 1.264 . . . . 0.0 111.504 -179.205 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 62.6 t30 41.41 38.01 0.76 Allowed 'General case' 0 CA--C 1.552 1.043 0 C-N-CA 127.277 2.231 . . . . 0.0 116.714 177.475 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 88.25 15.41 60.63 Favored Glycine 0 CA--C 1.535 1.324 0 O-C-N 120.979 -1.076 . . . . 0.0 114.975 179.536 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 31.6 mtt180 -139.43 168.3 20.13 Favored 'General case' 0 N--CA 1.467 0.4 0 C-N-CA 126.209 1.804 . . . . 0.0 112.185 -179.355 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 2.2 m -141.31 140.31 31.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 C-N-CA 127.737 2.415 . . . . 0.0 108.79 -178.914 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 47.2 mt -89.23 126.19 42.23 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.608 0 O-C-N 121.098 -1.001 . . . . 0.0 109.727 -179.336 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -71.66 146.83 48.02 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 124.071 0.948 . . . . 0.0 111.436 177.303 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 14.7 t -69.1 99.1 1.06 Allowed 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 124.752 1.221 . . . . 0.0 113.03 -177.072 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 28.1 p90 -61.18 -37.73 83.97 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 115.263 -0.88 . . . . 0.0 109.939 174.746 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 75.3 m-20 -62.25 -43.54 98.6 Favored 'General case' 0 CA--C 1.538 0.501 0 O-C-N 121.776 -0.578 . . . . 0.0 110.665 177.293 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 46.6 t -63.83 -44.14 94.13 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 119.633 1.106 . . . . 0.0 111.3 177.313 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 43.7 mt -62.8 -42.24 99.63 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 124.082 0.953 . . . . 0.0 113.294 176.85 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 31.4 mmmt -80.61 -12.65 59.48 Favored 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 124.904 1.281 . . . . 0.0 113.839 179.876 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 85.99 38.42 8.61 Favored Glycine 0 CA--C 1.538 1.485 0 C-N-CA 124.6 1.095 . . . . 0.0 114.274 179.225 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 49.2 ttp180 -122.07 -20.39 6.29 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 126.721 2.008 . . . . 0.0 114.808 -176.825 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 5.6 t -70.14 145.51 51.5 Favored 'General case' 0 CA--C 1.546 0.808 0 CA-C-N 119.393 0.997 . . . . 0.0 113.187 -178.187 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 85.9 p -155.65 8.53 0.26 Allowed 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 126.849 2.06 . . . . 0.0 113.106 179.24 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 67.3 mtm-85 -69.99 161.69 29.54 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 126.434 1.893 . . . . 0.0 113.797 -178.184 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -120.75 0.84 10.45 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 125.757 1.623 . . . . 0.0 112.263 175.834 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 23.1 m120 -142.41 34.93 1.48 Allowed 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 128.628 2.771 . . . . 0.0 109.692 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 8.9 t -56.98 130.51 46.35 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 126.052 1.741 . . . . 0.0 111.396 -178.39 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 17.1 mtmt -83.94 0.26 48.59 Favored 'General case' 0 N--CA 1.476 0.838 0 N-CA-C 113.715 1.006 . . . . 0.0 113.715 -178.843 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 72.2 m-85 -120.96 152.07 38.96 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 122.216 1.008 . . . . 0.0 112.231 -173.21 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -75.61 113.37 12.97 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 123.547 0.739 . . . . 0.0 111.766 -176.656 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 15.4 m170 -68.09 116.4 38.58 Favored Pre-proline 0 CA--C 1.546 0.823 0 N-CA-C 105.126 -2.176 . . . . 0.0 105.126 171.256 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 66.3 Cg_endo -70.16 132.14 22.09 Favored 'Trans proline' 0 CA--C 1.543 0.932 0 C-N-CA 121.917 1.744 . . . . 0.0 114.393 -169.86 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_endo -76.05 159.05 37.85 Favored 'Trans proline' 0 CA--C 1.542 0.879 0 C-N-CA 123.902 3.068 . . . . 0.0 111.863 178.543 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 21.1 Cg_endo -55.57 -32.78 84.39 Favored 'Trans proline' 0 CA--C 1.538 0.719 0 C-N-CA 123.484 2.789 . . . . 0.0 114.715 -178.155 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 56.0 m80 -76.84 -13.41 60.01 Favored 'General case' 0 N--CA 1.474 0.773 0 N-CA-C 114.659 1.355 . . . . 0.0 114.659 177.779 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 91.2 mt -115.86 -18.13 10.83 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 124.551 1.14 . . . . 0.0 113.535 179.344 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 58.3 mtpt -53.8 -37.21 63.28 Favored 'General case' 0 N--CA 1.48 1.072 0 CA-C-N 119.992 1.269 . . . . 0.0 111.233 172.907 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 19.6 m -64.16 -42.13 96.87 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 124.628 1.171 . . . . 0.0 111.709 176.007 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 90.6 mm-40 -67.21 -42.91 83.32 Favored 'General case' 0 N--CA 1.466 0.356 0 C-N-CA 123.517 0.727 . . . . 0.0 110.421 178.531 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 66.7 mt -63.2 -45.66 90.7 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-O 118.391 -0.814 . . . . 0.0 112.183 176.927 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 7.2 pt-20 -63.99 -35.64 81.37 Favored 'General case' 0 N--CA 1.474 0.766 0 CA-C-N 120.476 1.489 . . . . 0.0 111.878 177.196 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 69.1 mt -63.13 -44.54 99.48 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.679 0 CA-C-N 119.049 0.841 . . . . 0.0 109.77 175.185 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 86.4 m-20 -61.12 -42.74 99.08 Favored 'General case' 0 CA--C 1.545 0.774 0 O-C-N 121.707 -0.621 . . . . 0.0 110.728 175.665 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -63.37 -46.95 91.56 Favored Glycine 0 CA--C 1.531 1.053 0 C-N-CA 124.881 1.229 . . . . 0.0 112.403 178.873 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 85.6 mtt-85 -57.61 -40.05 78.28 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 124.589 1.156 . . . . 0.0 111.171 175.856 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 34.1 m-80 -71.71 -2.99 19.34 Favored 'General case' 0 CA--C 1.551 1.003 0 C-N-CA 124.854 1.262 . . . . 0.0 114.165 176.069 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 40.0 t30 -117.51 -35.42 3.99 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 124.945 1.298 . . . . 0.0 112.529 178.228 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 32.1 tp -55.57 -32.31 62.92 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 125.693 1.597 . . . . 0.0 112.611 177.735 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 29.9 pt -62.44 -15.05 14.02 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.722 0 C-N-CA 126.885 2.074 . . . . 0.0 114.434 177.099 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 51.0 tp60 -56.32 -26.62 52.91 Favored 'General case' 0 N--CA 1.473 0.722 0 CA-C-N 119.372 0.987 . . . . 0.0 112.644 178.232 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 40.7 mt-30 -61.38 -15.29 34.99 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 125.391 1.477 . . . . 0.0 113.78 175.933 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 29.7 mtpp -125.66 20.44 7.85 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 126.667 1.987 . . . . 0.0 112.704 -178.73 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 8.1 p30 . . . . . 0 CA--C 1.547 0.841 0 C-N-CA 124.786 1.234 . . . . 0.0 113.767 -179.98 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 13.9 tpt . . . . . 0 CA--C 1.543 0.7 0 N-CA-C 112.786 0.661 . . . . 0.0 112.786 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -55.45 -24.03 28.62 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 125.619 1.568 . . . . 0.0 114.396 179.79 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 26.9 m -61.22 -14.25 9.9 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.972 0 C-N-CA 125.484 1.514 . . . . 0.0 113.904 176.716 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 28.4 m -67.38 -9.33 40.38 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 125.43 1.492 . . . . 0.0 114.531 178.862 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 9.7 p -146.06 157.78 11.95 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.849 0 C-N-CA 125.499 1.52 . . . . 0.0 111.336 -179.582 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 13.2 p -66.56 151.42 96.36 Favored Pre-proline 0 N--CA 1.476 0.848 0 C-N-CA 124.618 1.167 . . . . 0.0 112.398 178.271 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -71.29 154.91 61.23 Favored 'Trans proline' 0 CA--C 1.541 0.846 0 C-N-CA 123.033 2.488 . . . . 0.0 112.939 -179.846 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 18.7 tt -151.35 -22.05 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.479 0.986 0 C-N-CA 124.873 1.269 . . . . 0.0 113.983 178.752 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 12.3 ttp180 -52.67 -27.59 18.01 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 124.912 1.285 . . . . 0.0 114.229 -179.072 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 10.3 p-10 -65.43 -18.7 65.52 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 126.085 1.754 . . . . 0.0 114.746 176.464 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 56.0 p -133.85 -9.81 2.72 Favored 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 124.676 1.19 . . . . 0.0 114.003 176.426 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 75.5 tttt -48.12 -46.52 34.21 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 125.732 1.613 . . . . 0.0 112.066 175.828 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -73.22 -23.15 60.34 Favored 'General case' 0 CA--C 1.544 0.727 0 N-CA-C 114.08 1.141 . . . . 0.0 114.08 -179.966 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 96.2 mt -91.19 -10.11 42.91 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 127.24 2.216 . . . . 0.0 114.78 -177.141 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 9.7 m -78.45 79.22 4.89 Favored 'General case' 0 N--CA 1.477 0.888 0 CA-C-N 119.728 1.149 . . . . 0.0 110.879 -178.805 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 10.0 tp -75.71 143.26 42.19 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 128.567 2.747 . . . . 0.0 111.875 -177.728 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 10.1 mt-10 -74.91 151.83 38.9 Favored 'General case' 0 N--CA 1.47 0.559 0 O-C-N 120.5 -1.375 . . . . 0.0 112.888 178.409 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 14.8 m -85.36 154.92 3.49 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.943 0 C-N-CA 123.255 0.622 . . . . 0.0 111.659 175.497 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 47.8 t -74.83 138.59 42.66 Favored 'General case' 0 CA--C 1.538 0.519 0 O-C-N 121.704 -0.622 . . . . 0.0 110.883 176.439 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.27 -39.57 74.85 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 124.811 1.244 . . . . 0.0 113.229 -178.422 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 13.5 mm-40 -73.97 -32.9 63.65 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 123.551 0.74 . . . . 0.0 111.351 179.268 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 67.3 t80 -62.75 -27.57 69.37 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 123.89 0.876 . . . . 0.0 111.471 175.844 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 57.9 mm-40 -65.28 -20.01 66.22 Favored 'General case' 0 N--CA 1.476 0.862 0 N-CA-C 112.815 0.672 . . . . 0.0 112.815 175.359 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 7.3 mpt_? -108.71 8.48 26.88 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 126.315 1.846 . . . . 0.0 111.607 176.894 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 58.64 36.12 84.22 Favored Glycine 0 CA--C 1.533 1.179 0 C-N-CA 125.421 1.486 . . . . 0.0 114.127 -179.677 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 4.8 t -130.96 7.81 4.73 Favored 'General case' 0 N--CA 1.477 0.917 0 N-CA-C 114.892 1.442 . . . . 0.0 114.892 -174.944 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 27.8 t -60.2 132.86 55.25 Favored 'General case' 0 CA--C 1.55 0.959 0 O-C-N 120.902 -1.124 . . . . 0.0 110.615 175.972 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 77.9 p -82.66 3.98 26.76 Favored 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 115.457 1.651 . . . . 0.0 115.457 -176.67 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 67.4 mtm-85 -130.23 146.2 60.58 Favored Pre-proline 0 N--CA 1.475 0.805 0 C-N-CA 125.252 1.421 . . . . 0.0 113.311 -176.216 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 95.2 Cg_endo -70.35 167.76 24.3 Favored 'Trans proline' 0 CA--C 1.543 0.958 0 C-N-CA 122.385 2.056 . . . . 0.0 110.021 171.706 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 -54.22 -29.12 45.28 Favored 'General case' 0 N--CA 1.475 0.81 0 N-CA-C 113.538 0.94 . . . . 0.0 113.538 177.158 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 16.2 p -75.52 -8.35 56.51 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 125.59 1.556 . . . . 0.0 114.981 178.642 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 19.3 mt-10 -124.78 -25.53 3.93 Favored 'General case' 0 N--CA 1.478 0.931 0 N-CA-C 116.092 1.886 . . . . 0.0 116.092 -176.012 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 4.3 t -68.92 163.14 25.11 Favored 'General case' 0 CA--C 1.548 0.895 0 N-CA-C 115.215 1.561 . . . . 0.0 115.215 -176.631 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -79.59 -9.99 59.72 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 127.286 2.234 . . . . 0.0 113.236 179.627 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 65.6 m-85 -140.54 174.0 10.95 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 126.411 1.885 . . . . 0.0 110.523 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -81.99 150.78 27.47 Favored 'General case' 0 CA--C 1.546 0.804 0 O-C-N 121.129 -0.982 . . . . 0.0 113.464 -177.742 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 66.5 m170 -123.82 86.52 53.24 Favored Pre-proline 0 CA--C 1.551 0.982 0 C-N-CA 126.043 1.737 . . . . 0.0 110.739 -179.587 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 29.5 Cg_endo -62.18 146.44 95.99 Favored 'Trans proline' 0 CA--C 1.54 0.811 0 C-N-CA 123.6 2.867 . . . . 0.0 114.923 -177.444 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 51.6 p -84.98 -176.05 6.04 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 124.867 1.267 . . . . 0.0 112.386 175.604 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 75.0 mmtt -60.67 -19.51 58.58 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 125.819 1.648 . . . . 0.0 113.553 173.558 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 43.0 m -109.06 -20.58 12.97 Favored 'General case' 0 N--CA 1.478 0.933 0 N-CA-C 114.216 1.191 . . . . 0.0 114.216 179.372 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 87.2 m -61.5 138.46 58.28 Favored 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 113.915 1.08 . . . . 0.0 113.915 -178.638 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 47.8 tt0 -83.57 127.66 33.91 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 125.832 1.653 . . . . 0.0 110.308 178.594 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 15.0 t -123.11 133.49 68.93 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.958 0 C-N-CA 125.666 1.587 . . . . 0.0 109.908 -177.852 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -144.24 129.29 18.57 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 125.114 1.366 . . . . 0.0 111.255 -179.136 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 61.9 t30 43.42 36.54 1.14 Allowed 'General case' 0 CA--C 1.552 1.051 0 C-N-CA 126.82 2.048 . . . . 0.0 116.462 177.94 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 87.41 14.24 64.17 Favored Glycine 0 CA--C 1.536 1.347 0 O-C-N 120.993 -1.067 . . . . 0.0 114.947 179.845 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 71.4 mtt180 -136.86 164.25 28.74 Favored 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 125.823 1.649 . . . . 0.0 111.087 -179.929 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 4.1 m -139.34 142.74 32.64 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.564 0 C-N-CA 127.13 2.172 . . . . 0.0 109.085 -177.926 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 29.1 mt -90.94 127.84 43.12 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.647 0 O-C-N 121.09 -1.006 . . . . 0.0 109.995 -178.51 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -73.38 147.46 44.29 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 123.962 0.905 . . . . 0.0 111.229 177.642 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 15.1 t -70.58 97.06 1.26 Allowed 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 125.655 1.582 . . . . 0.0 113.267 -175.82 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 28.1 p90 -59.66 -37.53 79.01 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 123.428 0.691 . . . . 0.0 110.407 175.179 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 69.7 m-20 -61.43 -36.82 81.42 Favored 'General case' 0 CA--C 1.54 0.574 0 O-C-N 121.645 -0.659 . . . . 0.0 111.632 177.273 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 46.7 p -67.19 -38.53 85.52 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-N 119.733 1.151 . . . . 0.0 111.976 177.304 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 42.1 mt -71.73 -42.97 66.64 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 124.51 1.124 . . . . 0.0 112.261 177.444 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 31.1 mmmt -76.12 -15.6 60.05 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 124.69 1.196 . . . . 0.0 113.7 179.573 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 87.76 42.41 6.07 Favored Glycine 0 CA--C 1.537 1.416 0 C-N-CA 124.519 1.057 . . . . 0.0 114.502 178.085 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 19.4 tpp180 -127.19 -23.43 3.57 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 125.865 1.666 . . . . 0.0 115.241 -176.922 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 8.2 t -62.67 128.96 38.39 Favored 'General case' 0 CA--C 1.546 0.8 0 CA-C-N 119.444 1.02 . . . . 0.0 113.142 -176.542 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 38.3 m -142.62 11.77 1.88 Allowed 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 126.743 2.017 . . . . 0.0 112.507 -179.773 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 77.4 mtm-85 -73.96 164.71 26.27 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 126.196 1.798 . . . . 0.0 114.047 -177.611 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -121.02 -1.59 9.82 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 125.961 1.704 . . . . 0.0 112.285 176.357 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 14.1 m120 -143.05 36.31 1.38 Allowed 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 128.127 2.571 . . . . 0.0 109.976 179.268 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 9.4 t -53.51 128.34 28.54 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 124.848 1.259 . . . . 0.0 111.436 -178.502 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 6.8 mtmp? -84.78 3.78 36.03 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 124.077 0.951 . . . . 0.0 113.457 -177.982 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 67.5 m-85 -124.76 152.79 43.37 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 124.207 1.003 . . . . 0.0 112.353 -173.881 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -79.65 116.4 19.83 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 123.712 0.805 . . . . 0.0 112.249 -175.788 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 32.7 m170 -68.99 114.42 23.1 Favored Pre-proline 0 CA--C 1.548 0.902 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 174.649 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 67.8 Cg_exo -47.23 112.99 0.6 Allowed 'Trans proline' 0 CA--C 1.541 0.861 0 C-N-CA 125.011 3.807 . . . . 0.0 116.267 -175.926 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 96.0 Cg_endo -76.0 157.01 38.7 Favored 'Trans proline' 0 CA--C 1.541 0.873 0 C-N-CA 121.74 1.627 . . . . 0.0 110.889 176.406 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_endo -57.41 -31.2 90.55 Favored 'Trans proline' 0 CA--C 1.539 0.734 0 C-N-CA 123.155 2.57 . . . . 0.0 114.839 -176.669 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 61.6 m80 -80.68 -10.84 59.7 Favored 'General case' 0 N--CA 1.475 0.803 0 N-CA-C 114.749 1.388 . . . . 0.0 114.749 178.169 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 77.3 mt -117.0 -16.96 10.47 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 124.214 1.005 . . . . 0.0 113.179 178.527 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 62.3 mttt -52.99 -35.47 59.29 Favored 'General case' 0 N--CA 1.475 0.825 0 CA-C-N 119.502 1.047 . . . . 0.0 111.58 173.249 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 24.5 m -63.64 -46.05 87.45 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 124.206 1.002 . . . . 0.0 111.295 175.969 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 92.4 mm-40 -65.57 -44.51 86.51 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 123.637 0.775 . . . . 0.0 110.659 177.661 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 87.9 mt -60.75 -46.52 90.13 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 123.833 0.853 . . . . 0.0 111.974 177.305 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -65.91 -35.42 80.58 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-N 119.934 1.243 . . . . 0.0 112.098 177.52 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 64.9 mt -62.6 -43.56 98.6 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.786 0 CA-C-N 119.258 0.935 . . . . 0.0 109.647 175.337 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 83.8 m-20 -61.77 -44.12 97.51 Favored 'General case' 0 CA--C 1.542 0.668 0 O-C-N 121.778 -0.576 . . . . 0.0 110.482 175.307 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -61.93 -49.52 74.75 Favored Glycine 0 CA--C 1.528 0.856 0 C-N-CA 124.701 1.143 . . . . 0.0 112.559 179.354 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 87.7 mtt-85 -55.64 -29.0 58.49 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 125.078 1.351 . . . . 0.0 113.469 177.972 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 42.9 m-80 -86.9 -0.52 56.65 Favored 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 125.136 1.374 . . . . 0.0 113.959 178.142 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 57.6 m-80 -130.7 -31.97 1.72 Allowed 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 124.752 1.221 . . . . 0.0 113.995 -179.078 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 85.6 mt -77.51 49.34 0.72 Allowed 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 127.347 2.259 . . . . 0.0 112.539 179.676 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 1.5 pp -133.27 157.69 42.77 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.68 0 C-N-CA 125.617 1.567 . . . . 0.0 113.116 -177.574 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 4.9 tp-100 -70.02 142.5 52.75 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.03 0.932 . . . . 0.0 110.56 178.437 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 73.3 mm-40 -84.72 147.08 27.08 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 124.1 0.96 . . . . 0.0 111.533 -179.869 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 14.2 ptmm? -153.59 170.47 20.73 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 125.364 1.466 . . . . 0.0 112.768 -179.009 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 48.4 t-20 . . . . . 0 CA--C 1.545 0.772 0 C-N-CA 124.648 1.179 . . . . 0.0 111.359 175.61 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.541 0.623 0 N-CA-C 113.968 1.099 . . . . 0.0 113.968 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -77.74 46.5 0.56 Allowed 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 126.773 2.029 . . . . 0.0 112.599 179.344 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 8.6 p -146.33 165.57 8.53 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.7 0 C-N-CA 126.446 1.898 . . . . 0.0 110.99 -176.794 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 46.2 m -66.26 137.21 56.79 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 124.695 1.198 . . . . 0.0 111.314 177.174 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 46.2 t -141.58 151.97 19.31 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.964 0 C-N-CA 126.09 1.756 . . . . 0.0 108.855 179.399 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 13.8 p -58.47 152.37 44.92 Favored Pre-proline 0 N--CA 1.477 0.916 0 C-N-CA 124.256 1.023 . . . . 0.0 112.557 178.082 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 70.9 Cg_exo -49.44 142.1 23.9 Favored 'Trans proline' 0 C--N 1.353 0.771 0 C-N-CA 123.872 3.048 . . . . 0.0 114.749 -179.955 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 30.2 pt -61.64 149.55 8.7 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.727 0 C-N-CA 124.431 1.092 . . . . 0.0 112.289 178.609 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 76.2 ttt-85 -59.33 -47.63 84.69 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 124.902 1.281 . . . . 0.0 114.259 -177.312 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 45.2 t0 -163.23 165.01 24.82 Favored 'General case' 0 CA--C 1.549 0.918 0 C-N-CA 124.662 1.185 . . . . 0.0 112.218 -177.958 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 21.3 p -132.63 -5.16 3.26 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 127.487 2.315 . . . . 0.0 112.52 175.432 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 7.1 ttpm? -51.04 -42.76 60.69 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 124.641 1.176 . . . . 0.0 112.618 177.767 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -66.61 -29.95 70.12 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 124.304 1.042 . . . . 0.0 113.372 177.936 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 91.2 mt -88.2 -12.22 44.48 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 127.202 2.201 . . . . 0.0 113.886 -179.119 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 12.9 m -79.59 79.37 6.07 Favored 'General case' 0 N--CA 1.474 0.732 0 CA-C-O 122.487 1.137 . . . . 0.0 110.218 -178.377 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 11.9 tp -75.61 143.81 42.1 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 128.512 2.725 . . . . 0.0 111.548 -177.357 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 62.5 mt-10 -74.03 150.57 40.57 Favored 'General case' 0 CA--C 1.541 0.614 0 O-C-N 120.765 -1.21 . . . . 0.0 112.362 178.622 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 13.7 m -86.33 153.24 3.44 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.232 0 C-N-CA 123.539 0.736 . . . . 0.0 111.149 174.59 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 41.5 t -72.29 130.15 40.1 Favored 'General case' 0 CA--C 1.543 0.695 0 O-C-N 121.129 -0.982 . . . . 0.0 112.081 178.76 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.2 -28.94 69.73 Favored 'General case' 0 N--CA 1.479 0.992 0 O-C-N 121.287 -0.883 . . . . 0.0 113.09 179.821 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -77.03 -41.4 42.77 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 123.726 0.811 . . . . 0.0 110.142 178.884 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 65.0 t80 -63.54 -34.4 77.72 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 124.331 1.052 . . . . 0.0 111.517 175.907 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 13.6 mm100 -62.65 -14.51 44.33 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 124.03 0.932 . . . . 0.0 113.161 175.081 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 11.8 mtp-105 -121.41 12.67 10.9 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 127.428 2.291 . . . . 0.0 112.197 179.27 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 57.2 35.73 71.8 Favored Glycine 0 CA--C 1.534 1.261 0 C-N-CA 125.259 1.409 . . . . 0.0 114.0 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 7.4 t -131.73 15.6 4.84 Favored 'General case' 0 N--CA 1.476 0.842 0 N-CA-C 114.898 1.444 . . . . 0.0 114.898 -174.958 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 5.9 t -67.83 172.53 5.29 Favored 'General case' 0 CA--C 1.556 1.182 0 CA-C-N 119.137 0.88 . . . . 0.0 111.432 175.295 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 94.3 p -134.79 6.1 3.41 Favored 'General case' 0 N--CA 1.476 0.85 0 N-CA-C 115.55 1.685 . . . . 0.0 115.55 -175.782 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 81.5 mtt180 -133.1 143.34 48.04 Favored Pre-proline 0 N--CA 1.472 0.64 0 C-N-CA 125.53 1.532 . . . . 0.0 111.91 -179.39 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -68.17 165.72 27.54 Favored 'Trans proline' 0 CA--C 1.542 0.913 0 C-N-CA 122.144 1.896 . . . . 0.0 109.919 173.155 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -51.89 -32.7 33.59 Favored 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 113.765 1.024 . . . . 0.0 113.765 178.486 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 17.6 p -71.05 -14.08 62.2 Favored 'General case' 0 N--CA 1.473 0.725 0 C-N-CA 125.906 1.682 . . . . 0.0 115.021 178.481 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 74.3 mm-40 -123.78 -22.85 4.82 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 125.692 1.597 . . . . 0.0 115.23 -174.268 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 4.6 t -65.14 168.18 7.08 Favored 'General case' 0 CA--C 1.548 0.898 0 N-CA-C 115.937 1.829 . . . . 0.0 115.937 -175.527 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -80.41 -18.98 47.27 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 128.075 2.55 . . . . 0.0 113.102 -179.755 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 67.5 m-85 -145.2 178.37 8.12 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 126.625 1.97 . . . . 0.0 110.598 -178.061 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -79.37 151.13 31.15 Favored 'General case' 0 CA--C 1.547 0.864 0 O-C-N 120.812 -1.18 . . . . 0.0 113.404 -178.071 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 59.5 m170 -125.41 87.73 55.24 Favored Pre-proline 0 CA--C 1.549 0.932 0 C-N-CA 126.128 1.771 . . . . 0.0 110.355 179.576 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -64.32 147.32 90.9 Favored 'Trans proline' 0 C--N 1.352 0.754 0 C-N-CA 123.237 2.625 . . . . 0.0 114.379 -177.885 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 60.2 p -84.59 -176.31 6.18 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 124.685 1.194 . . . . 0.0 111.79 174.735 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 47.1 mmtm -61.04 -18.75 59.52 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 125.259 1.424 . . . . 0.0 113.253 173.084 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 42.1 m -109.17 -20.6 12.93 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 125.133 1.373 . . . . 0.0 114.563 -178.9 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 97.0 m -65.45 132.93 50.19 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-N 119.357 0.981 . . . . 0.0 112.659 179.862 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 33.9 mt-30 -77.24 138.43 39.41 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 123.271 0.628 . . . . 0.0 111.011 176.766 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 11.8 t -127.87 147.08 32.58 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.897 0 C-N-CA 125.666 1.586 . . . . 0.0 110.986 -176.895 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 4.3 pt-20 -149.02 117.48 6.51 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 125.188 1.395 . . . . 0.0 114.062 -179.349 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 75.0 m-20 40.66 30.46 0.09 Allowed 'General case' 0 CA--C 1.553 1.073 0 C-N-CA 127.536 2.334 . . . . 0.0 116.986 174.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 109.17 5.5 30.41 Favored Glycine 0 CA--C 1.536 1.371 0 C-N-CA 124.656 1.122 . . . . 0.0 114.932 -178.995 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 34.3 mtt180 -133.87 165.41 25.07 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 119.236 1.518 . . . . 0.0 112.508 179.04 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 3.8 m -140.42 145.79 25.39 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.534 0 C-N-CA 127.992 2.517 . . . . 0.0 109.107 -179.417 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 17.8 mt -94.13 131.44 41.01 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 O-C-N 121.003 -1.061 . . . . 0.0 110.201 -178.485 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -77.65 148.21 35.16 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 124.095 0.958 . . . . 0.0 111.659 178.632 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 21.5 t -70.63 98.94 1.58 Allowed 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 124.9 1.28 . . . . 0.0 112.582 -177.409 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 29.5 p90 -60.78 -38.34 84.95 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 123.652 0.781 . . . . 0.0 110.512 175.789 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 60.9 m-20 -59.59 -38.44 81.25 Favored 'General case' 0 CA--C 1.543 0.703 0 O-C-N 121.719 -0.613 . . . . 0.0 110.436 176.66 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 24.7 p -65.49 -41.71 92.98 Favored 'General case' 0 N--CA 1.472 0.632 0 CA-C-N 119.929 1.241 . . . . 0.0 112.164 177.832 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 33.6 mt -68.71 -41.25 79.34 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 124.756 1.222 . . . . 0.0 112.638 177.913 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 14.2 mmmm -77.53 -8.78 58.34 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 124.586 1.155 . . . . 0.0 113.437 178.743 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 78.71 41.12 16.02 Favored Glycine 0 CA--C 1.536 1.369 0 C-N-CA 124.733 1.158 . . . . 0.0 113.632 179.265 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 65.1 ttt-85 -123.64 -22.9 4.86 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 126.85 2.06 . . . . 0.0 114.873 -175.571 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 5.6 t -69.22 145.88 52.81 Favored 'General case' 0 CA--C 1.545 0.768 0 CA-C-N 119.24 0.927 . . . . 0.0 112.973 -178.0 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 78.4 p -154.98 9.54 0.32 Allowed 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 126.704 2.001 . . . . 0.0 112.904 178.94 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 68.2 mtm-85 -70.14 160.8 31.41 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 126.181 1.792 . . . . 0.0 113.263 -178.569 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -121.25 3.15 10.36 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 125.623 1.569 . . . . 0.0 112.459 177.125 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 27.2 m120 -142.71 27.66 1.65 Allowed 'General case' 0 CA--C 1.552 1.048 0 C-N-CA 127.751 2.42 . . . . 0.0 110.56 -179.218 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 4.5 t -50.17 128.83 20.09 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 126.502 1.921 . . . . 0.0 112.525 -176.189 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 32.3 mtmt -84.17 3.11 36.51 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 125.182 1.393 . . . . 0.0 113.868 -177.98 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 87.9 m-85 -125.46 152.87 44.34 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 124.944 1.298 . . . . 0.0 111.935 -175.298 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -76.38 117.42 18.03 Favored 'General case' 0 N--CA 1.465 0.307 0 C-N-CA 123.708 0.803 . . . . 0.0 112.213 -176.471 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 12.9 m170 -72.31 115.7 41.68 Favored Pre-proline 0 CA--C 1.547 0.859 0 N-CA-C 107.962 -1.125 . . . . 0.0 107.962 174.215 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_exo -48.87 115.22 1.56 Allowed 'Trans proline' 0 CA--C 1.542 0.905 0 C-N-CA 124.802 3.668 . . . . 0.0 115.696 -176.104 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 92.2 Cg_endo -78.88 153.65 25.77 Favored 'Trans proline' 0 CA--C 1.544 1.02 0 C-N-CA 121.887 1.725 . . . . 0.0 111.283 177.6 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 86.6 Cg_exo -47.16 -36.99 22.78 Favored 'Trans proline' 0 CA--C 1.537 0.664 0 C-N-CA 124.189 3.26 . . . . 0.0 115.704 179.682 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 69.8 m80 -79.63 -10.35 59.78 Favored 'General case' 0 N--CA 1.473 0.704 0 N-CA-C 115.588 1.699 . . . . 0.0 115.588 -179.643 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 79.9 mt -119.42 -14.55 9.16 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 124.512 1.125 . . . . 0.0 113.287 177.721 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 23.8 mtpp -54.45 -34.8 62.16 Favored 'General case' 0 N--CA 1.477 0.915 0 CA-C-N 119.451 1.023 . . . . 0.0 111.409 173.363 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 21.7 m -62.92 -45.71 91.2 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 123.877 0.871 . . . . 0.0 111.202 176.068 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 92.6 mm-40 -66.03 -44.99 83.05 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 123.604 0.761 . . . . 0.0 110.954 177.665 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 76.5 mt -60.72 -45.24 94.99 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 123.742 0.817 . . . . 0.0 112.212 177.809 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -66.85 -36.5 82.47 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-N 119.578 1.081 . . . . 0.0 111.886 177.343 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 63.9 mt -62.06 -42.05 93.49 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.754 0 CA-C-N 119.117 0.871 . . . . 0.0 109.797 175.384 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 86.4 m-20 -61.74 -47.12 86.64 Favored 'General case' 0 CA--C 1.543 0.704 0 O-C-N 121.861 -0.525 . . . . 0.0 110.395 175.32 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -60.43 -47.48 90.92 Favored Glycine 0 CA--C 1.531 1.058 0 C-N-CA 124.595 1.093 . . . . 0.0 113.105 179.355 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 88.9 mtt-85 -58.18 -21.32 46.92 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 125.32 1.448 . . . . 0.0 113.402 176.66 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 60.3 m-80 -106.28 9.81 31.9 Favored 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 125.991 1.717 . . . . 0.0 112.915 178.591 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 38.9 t30 -132.75 -25.09 1.9 Allowed 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 125.087 1.355 . . . . 0.0 114.213 -179.99 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 53.5 tp -61.47 -30.17 70.43 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 125.975 1.71 . . . . 0.0 113.551 -179.986 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . 0.405 HD13 ' H ' ' A' ' 88' ' ' ILE . 0.2 OUTLIER -72.47 173.3 0.89 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.686 0 C-N-CA 125.983 1.713 . . . . 0.0 112.753 178.064 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 5.6 tp-100 -63.02 156.26 25.23 Favored 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 125.29 1.436 . . . . 0.0 111.303 176.532 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 5.2 tp-100 -52.81 138.38 29.56 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 124.42 1.088 . . . . 0.0 112.462 179.642 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 62.0 mttp -69.71 -8.55 48.8 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 126.218 1.807 . . . . 0.0 115.843 -176.379 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 49.2 t-20 . . . . . 0 CA--C 1.542 0.672 0 C-N-CA 125.566 1.547 . . . . 0.0 111.497 179.806 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 13.8 tpt . . . . . 0 CA--C 1.545 0.766 0 N-CA-C 112.583 0.586 . . . . 0.0 112.583 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -137.9 11.82 2.88 Favored 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 125.912 1.685 . . . . 0.0 113.47 -179.875 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 35.9 m -131.32 9.8 1.85 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.23 0 C-N-CA 125.931 1.692 . . . . 0.0 113.473 -178.227 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 8.0 t -152.4 179.34 8.64 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 125.961 1.705 . . . . 0.0 111.272 179.862 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 14.7 p -143.52 143.43 24.4 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.798 0 C-N-CA 125.605 1.562 . . . . 0.0 111.234 179.672 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 26.6 p -71.1 142.38 87.4 Favored Pre-proline 0 N--CA 1.476 0.873 0 C-N-CA 124.655 1.182 . . . . 0.0 112.926 -179.19 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_endo -74.76 151.25 40.53 Favored 'Trans proline' 0 CA--C 1.541 0.866 0 C-N-CA 123.017 2.478 . . . . 0.0 111.533 177.217 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 9.1 tp -158.0 156.54 4.03 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.817 0 C-N-CA 125.298 1.439 . . . . 0.0 110.24 178.434 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 51.1 tpt85 -143.3 -29.64 0.52 Allowed 'General case' 0 N--CA 1.481 1.093 0 N-CA-C 114.621 1.341 . . . . 0.0 114.621 179.338 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 45.5 t0 -64.28 154.31 35.53 Favored 'General case' 0 CA--C 1.549 0.916 0 CA-C-N 119.389 0.995 . . . . 0.0 112.16 179.01 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 30.5 p -129.79 -1.11 4.8 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 126.864 2.065 . . . . 0.0 113.18 -179.521 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 7.4 ttpm? -49.33 -41.06 37.51 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 125.179 1.392 . . . . 0.0 113.945 179.04 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -75.48 -22.63 57.07 Favored 'General case' 0 N--CA 1.475 0.79 0 N-CA-C 114.113 1.153 . . . . 0.0 114.113 178.684 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 90.7 mt -91.72 -12.02 35.18 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 127.22 2.208 . . . . 0.0 114.423 -177.822 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 9.6 m -79.03 74.2 5.56 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 124.678 1.191 . . . . 0.0 110.898 -177.792 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 9.8 tp -75.7 143.73 41.96 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 126.845 2.058 . . . . 0.0 111.853 -178.047 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 8.2 mt-10 -69.54 150.29 47.28 Favored 'General case' 0 N--CA 1.472 0.67 0 O-C-N 120.766 -1.209 . . . . 0.0 112.308 178.735 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 21.3 m -82.15 148.85 5.01 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 N-CA-C 109.303 -0.628 . . . . 0.0 109.303 173.545 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 49.6 t -66.01 130.92 44.91 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-O 121.757 0.789 . . . . 0.0 111.01 178.124 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 2.8 mpt_? -69.41 -33.75 73.47 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 125.667 1.587 . . . . 0.0 112.192 -177.725 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 14.8 mm-40 -77.9 -34.5 51.42 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 123.676 0.79 . . . . 0.0 110.998 178.36 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 74.6 t80 -62.59 -27.51 69.24 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 124.452 1.101 . . . . 0.0 111.365 175.222 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 54.4 mm-40 -65.03 -19.5 66.03 Favored 'General case' 0 N--CA 1.475 0.825 0 N-CA-C 112.806 0.669 . . . . 0.0 112.806 175.337 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 6.9 mpt_? -111.75 10.2 20.9 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 126.477 1.911 . . . . 0.0 111.56 177.012 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 58.32 36.31 82.83 Favored Glycine 0 CA--C 1.533 1.213 0 C-N-CA 125.463 1.506 . . . . 0.0 114.287 -179.957 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 6.2 t -130.84 11.9 5.2 Favored 'General case' 0 N--CA 1.478 0.963 0 N-CA-C 115.117 1.525 . . . . 0.0 115.117 -175.388 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 36.8 t -61.45 139.11 58.27 Favored 'General case' 0 CA--C 1.551 1.017 0 O-C-N 121.318 -0.864 . . . . 0.0 110.988 176.165 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 78.2 p -89.23 0.67 56.59 Favored 'General case' 0 N--CA 1.472 0.631 0 N-CA-C 115.686 1.735 . . . . 0.0 115.686 -176.755 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 68.0 mtt180 -132.65 145.35 56.79 Favored Pre-proline 0 N--CA 1.475 0.803 0 C-N-CA 125.19 1.396 . . . . 0.0 113.042 -177.131 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -68.94 166.14 27.58 Favored 'Trans proline' 0 CA--C 1.543 0.965 0 C-N-CA 122.39 2.06 . . . . 0.0 110.125 172.878 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -52.23 -32.1 35.21 Favored 'General case' 0 N--CA 1.477 0.89 0 N-CA-C 113.868 1.062 . . . . 0.0 113.868 178.022 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 22.4 p -72.14 -13.71 61.63 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 125.585 1.554 . . . . 0.0 114.941 178.553 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 70.8 mm-40 -125.35 -22.25 4.38 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 125.574 1.55 . . . . 0.0 115.182 -174.623 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 14.3 t -60.03 162.75 5.35 Favored 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 115.37 1.618 . . . . 0.0 115.37 -176.509 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.42 -13.65 58.95 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 126.748 2.019 . . . . 0.0 112.821 177.959 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 70.3 m-85 -141.61 175.92 9.31 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 126.657 1.983 . . . . 0.0 111.151 -178.76 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -81.57 151.3 27.77 Favored 'General case' 0 CA--C 1.551 1.008 0 O-C-N 120.753 -1.217 . . . . 0.0 113.599 -178.283 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 56.0 m170 -124.67 91.28 49.7 Favored Pre-proline 0 CA--C 1.551 1.001 0 C-N-CA 126.006 1.722 . . . . 0.0 111.168 179.419 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo -66.49 167.05 19.81 Favored 'Trans proline' 0 CA--C 1.542 0.922 0 C-N-CA 123.678 2.919 . . . . 0.0 114.395 -179.237 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 59.7 p -125.04 -174.28 3.01 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 126.116 1.766 . . . . 0.0 111.954 177.401 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 30.9 mmmt -49.48 -26.58 3.49 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 127.31 2.244 . . . . 0.0 116.323 -179.378 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 21.1 m -109.05 -19.07 13.51 Favored 'General case' 0 N--CA 1.481 1.082 0 N-CA-C 114.506 1.299 . . . . 0.0 114.506 -179.389 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 58.3 m -63.49 135.43 56.88 Favored 'General case' 0 CA--C 1.543 0.7 0 CA-C-N 119.359 0.981 . . . . 0.0 113.137 -178.734 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 40.4 tt0 -85.29 127.6 34.38 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 125.519 1.527 . . . . 0.0 110.044 178.716 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 20.1 t -120.45 133.6 66.64 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 C-N-CA 125.523 1.529 . . . . 0.0 109.51 -178.162 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 -143.19 130.44 20.89 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 125.016 1.326 . . . . 0.0 110.864 -179.118 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 45.59 36.65 2.68 Favored 'General case' 0 CA--C 1.555 1.147 0 C-N-CA 126.451 1.9 . . . . 0.0 115.366 178.936 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 81.18 19.94 65.88 Favored Glycine 0 CA--C 1.536 1.387 0 O-C-N 120.956 -1.09 . . . . 0.0 114.579 -179.856 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 63.4 mtt180 -138.69 163.25 32.61 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 125.995 1.718 . . . . 0.0 110.938 -179.16 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 3.3 m -138.17 140.07 40.94 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.501 0 C-N-CA 126.613 1.965 . . . . 0.0 109.381 -177.91 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 54.7 mt -90.32 130.63 39.25 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.662 0 O-C-N 121.544 -0.723 . . . . 0.0 109.528 -178.952 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -74.99 150.56 38.94 Favored 'General case' 0 CA--C 1.551 0.982 0 C-N-CA 123.782 0.833 . . . . 0.0 112.556 178.642 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 2.5 t -68.35 91.51 0.39 Allowed 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 125.614 1.566 . . . . 0.0 110.85 -178.375 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 25.2 p90 -56.48 -36.94 69.69 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 124.167 0.987 . . . . 0.0 111.498 178.996 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 72.7 m-20 -61.82 -33.7 74.6 Favored 'General case' 0 CA--C 1.54 0.592 0 O-C-N 121.878 -0.514 . . . . 0.0 111.597 177.43 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 30.4 t -70.39 -41.21 73.32 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-N 119.678 1.126 . . . . 0.0 110.769 177.254 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 42.0 mt -66.74 -41.11 88.38 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.01 0.924 . . . . 0.0 112.912 176.075 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 32.1 mmmt -81.32 -7.53 59.59 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 125.114 1.365 . . . . 0.0 114.203 -179.302 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 77.61 39.95 23.98 Favored Glycine 0 CA--C 1.537 1.431 0 C-N-CA 124.505 1.05 . . . . 0.0 114.12 178.889 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 50.4 ttp180 -125.98 -16.54 5.57 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 126.758 2.023 . . . . 0.0 114.79 -176.546 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 4.7 t -62.29 133.48 55.19 Favored 'General case' 0 CA--C 1.544 0.713 0 CA-C-N 119.448 1.022 . . . . 0.0 113.322 -176.233 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 88.2 p -145.0 6.34 1.16 Allowed 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 127.138 2.175 . . . . 0.0 112.47 179.423 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.464 ' NH1' ' SG ' ' A' ' 66' ' ' CYS . 21.8 mtm105 -70.85 168.31 17.09 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 126.813 2.045 . . . . 0.0 113.248 179.434 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -136.66 14.84 3.15 Favored 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 127.019 2.128 . . . . 0.0 111.022 176.179 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 33.9 p-10 -144.67 19.68 1.67 Allowed 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 127.839 2.456 . . . . 0.0 113.522 -174.785 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' CYS . . . . . 0.464 ' SG ' ' NH1' ' A' ' 63' ' ' ARG . 63.2 m -41.51 115.56 0.65 Allowed 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 125.056 1.342 . . . . 0.0 114.506 -175.443 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 19.1 mtmt -80.66 4.0 20.17 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-N 114.916 -1.038 . . . . 0.0 111.459 173.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 65.5 m-85 -125.61 144.94 50.36 Favored 'General case' 0 N--CA 1.447 -0.605 0 C-N-CA 126.416 1.886 . . . . 0.0 110.21 -174.24 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -72.81 117.56 14.66 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 123.817 0.847 . . . . 0.0 112.252 -176.017 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 3.8 m-70 -65.4 123.97 85.82 Favored Pre-proline 0 CA--C 1.546 0.801 0 N-CA-C 105.865 -1.902 . . . . 0.0 105.865 170.328 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -70.02 122.87 9.46 Favored 'Trans proline' 0 CA--C 1.544 0.992 0 C-N-CA 121.946 1.764 . . . . 0.0 113.938 -170.932 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 94.5 Cg_endo -77.82 153.29 29.41 Favored 'Trans proline' 0 CA--C 1.543 0.962 0 C-N-CA 123.264 2.643 . . . . 0.0 112.015 179.261 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 80.6 Cg_exo -45.69 -42.9 19.09 Favored 'Trans proline' 0 CA--C 1.538 0.72 0 C-N-CA 124.319 3.346 . . . . 0.0 115.844 179.883 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 17.4 t-80 -70.77 -15.22 62.66 Favored 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 114.938 1.458 . . . . 0.0 114.938 -179.786 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 81.1 mt -112.55 -18.17 12.46 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 124.562 1.145 . . . . 0.0 112.975 178.622 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 57.4 mtpt -54.09 -35.76 62.45 Favored 'General case' 0 N--CA 1.478 0.941 0 CA-C-N 119.83 1.195 . . . . 0.0 111.593 174.852 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 22.4 m -62.83 -45.63 91.72 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 124.081 0.952 . . . . 0.0 111.374 175.691 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 76.2 mt-30 -64.21 -46.93 81.71 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 123.634 0.774 . . . . 0.0 110.711 177.449 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 92.4 mt -61.42 -45.8 92.77 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 124.205 1.002 . . . . 0.0 112.549 179.244 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 7.5 pt-20 -66.03 -37.01 84.79 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-N 119.91 1.232 . . . . 0.0 111.98 177.972 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 61.9 mt -61.59 -40.74 87.65 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 CA-C-N 119.215 0.916 . . . . 0.0 110.131 176.304 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 79.5 m-20 -67.59 -47.03 70.87 Favored 'General case' 0 CA--C 1.546 0.819 0 O-C-N 121.918 -0.489 . . . . 0.0 110.803 175.477 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -61.49 -40.16 98.3 Favored Glycine 0 CA--C 1.529 0.954 0 C-N-CA 125.114 1.34 . . . . 0.0 113.62 -179.278 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 82.0 mtt-85 -56.74 -16.73 6.98 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 125.239 1.416 . . . . 0.0 113.919 175.997 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 12.0 t-20 -115.57 9.41 15.36 Favored 'General case' 0 CA--C 1.555 1.147 0 C-N-CA 125.965 1.706 . . . . 0.0 112.522 178.771 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -134.77 -24.52 1.5 Allowed 'General case' 0 CA--C 1.549 0.93 0 C-N-CA 125.31 1.444 . . . . 0.0 114.383 -176.641 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 42.4 mt -61.93 -11.53 13.65 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 125.263 1.425 . . . . 0.0 114.205 179.348 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 1.7 pp -68.29 18.23 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.553 1.077 0 C-N-CA 128.099 2.56 . . . . 0.0 114.785 176.804 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 33.7 tt0 -49.33 134.13 18.91 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 126.706 2.002 . . . . 0.0 112.583 179.735 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 52.6 tt0 -148.66 149.66 31.87 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 125.1 1.36 . . . . 0.0 111.016 179.78 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 65.0 pttt -64.2 163.62 12.39 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 125.0 1.32 . . . . 0.0 113.423 178.624 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 44.2 t30 . . . . . 0 CA--C 1.545 0.756 0 C-N-CA 124.799 1.24 . . . . 0.0 112.502 178.228 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 64.7 mtt . . . . . 0 CA--C 1.544 0.715 0 N-CA-C 113.256 0.836 . . . . 0.0 113.256 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -138.23 12.19 2.82 Favored 'General case' 0 CA--C 1.551 1.01 0 C-N-CA 126.002 1.721 . . . . 0.0 113.406 -179.441 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 35.1 m -73.21 -7.95 10.7 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.167 0 C-N-CA 125.375 1.47 . . . . 0.0 114.652 -179.561 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 17.2 m -58.65 155.0 13.32 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 125.663 1.585 . . . . 0.0 113.759 -179.885 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 30.2 m -138.04 164.8 27.06 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.005 0 C-N-CA 125.526 1.53 . . . . 0.0 112.175 179.741 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 2.7 p -63.37 153.45 82.26 Favored Pre-proline 0 N--CA 1.477 0.909 0 C-N-CA 125.655 1.582 . . . . 0.0 113.539 179.25 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 62.2 Cg_endo -76.15 25.82 0.42 Allowed 'Trans proline' 0 CA--C 1.546 1.092 0 C-N-CA 125.187 3.925 . . . . 0.0 115.771 -178.167 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 44.6 pt -50.37 -28.5 5.29 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.048 0 C-N-CA 125.862 1.665 . . . . 0.0 115.393 -178.459 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 60.2 ttt85 -71.59 -31.5 67.01 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 124.297 1.039 . . . . 0.0 112.35 176.982 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -87.47 -35.37 18.28 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 124.689 1.196 . . . . 0.0 112.681 179.78 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 28.3 p -67.84 -3.11 8.57 Favored 'General case' 0 N--CA 1.481 1.12 0 N-CA-C 113.965 1.098 . . . . 0.0 113.965 177.02 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 36.2 ttpt -38.24 -45.89 1.02 Allowed 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 127.481 2.312 . . . . 0.0 114.302 178.2 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -80.34 -19.03 47.44 Favored 'General case' 0 CA--C 1.543 0.696 0 N-CA-C 114.743 1.386 . . . . 0.0 114.743 -178.402 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 83.5 mt -93.12 -18.52 22.49 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 126.362 1.865 . . . . 0.0 114.555 -176.605 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 2.6 m -73.71 75.3 1.56 Allowed 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 124.645 1.178 . . . . 0.0 111.863 -178.847 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -75.65 146.07 40.56 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 128.391 2.676 . . . . 0.0 111.094 -178.456 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 12.0 mt-10 -76.04 153.0 36.76 Favored 'General case' 0 N--CA 1.472 0.667 0 O-C-N 120.215 -1.553 . . . . 0.0 112.835 178.386 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 10.8 m -84.4 154.43 3.63 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.73 0 C-N-CA 122.748 0.419 . . . . 0.0 110.279 173.904 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 48.8 t -71.41 139.18 49.63 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-O 121.23 0.538 . . . . 0.0 110.361 176.609 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 3.8 mpt_? -68.59 -38.39 80.61 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 125.306 1.443 . . . . 0.0 112.452 -177.635 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 17.0 mm-40 -74.63 -33.78 62.64 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 123.918 0.887 . . . . 0.0 110.927 178.489 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 51.1 t80 -64.71 -22.78 67.06 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 123.801 0.841 . . . . 0.0 112.065 175.315 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 76.9 mt-30 -59.12 -22.58 61.09 Favored 'General case' 0 N--CA 1.477 0.882 0 O-C-N 121.568 -0.707 . . . . 0.0 112.872 175.526 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -116.62 14.26 15.41 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 125.741 1.616 . . . . 0.0 111.91 177.24 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 58.36 37.75 88.48 Favored Glycine 0 CA--C 1.534 1.227 0 C-N-CA 125.333 1.444 . . . . 0.0 114.228 -179.61 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 5.5 t -127.73 9.61 6.47 Favored 'General case' 0 N--CA 1.479 1.023 0 N-CA-C 114.632 1.345 . . . . 0.0 114.632 -175.279 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 34.6 t -62.7 134.61 56.57 Favored 'General case' 0 CA--C 1.55 0.947 0 O-C-N 120.927 -1.108 . . . . 0.0 111.021 175.729 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 27.8 m -79.37 2.79 20.34 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 125.69 1.596 . . . . 0.0 115.293 -177.358 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 71.2 mtm-85 -132.62 146.93 63.53 Favored Pre-proline 0 N--CA 1.474 0.775 0 C-N-CA 125.033 1.333 . . . . 0.0 113.733 -174.876 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 95.0 Cg_endo -71.01 166.87 27.75 Favored 'Trans proline' 0 CA--C 1.545 1.047 0 C-N-CA 122.337 2.024 . . . . 0.0 109.792 170.738 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -53.9 -32.4 53.22 Favored 'General case' 0 N--CA 1.477 0.924 0 O-C-N 121.157 -0.965 . . . . 0.0 112.79 177.681 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 26.9 p -71.16 -8.28 52.46 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 125.876 1.671 . . . . 0.0 115.147 178.158 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 20.5 mt-10 -125.14 -25.81 3.77 Favored 'General case' 0 N--CA 1.476 0.854 0 N-CA-C 115.439 1.644 . . . . 0.0 115.439 -177.587 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 4.2 t -70.16 164.23 24.65 Favored 'General case' 0 CA--C 1.548 0.878 0 N-CA-C 115.154 1.539 . . . . 0.0 115.154 -177.01 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 75.0 mmtt -81.31 -10.55 59.55 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 127.272 2.229 . . . . 0.0 113.25 179.949 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 73.7 m-85 -139.15 175.66 9.36 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 126.878 2.071 . . . . 0.0 110.196 179.497 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -86.11 150.13 24.64 Favored 'General case' 0 CA--C 1.546 0.805 0 O-C-N 121.213 -0.93 . . . . 0.0 113.458 -177.655 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 61.5 m170 -122.17 90.62 49.02 Favored Pre-proline 0 CA--C 1.554 1.128 0 C-N-CA 125.573 1.549 . . . . 0.0 111.056 179.222 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 30.8 Cg_endo -62.36 161.35 27.64 Favored 'Trans proline' 0 C--N 1.355 0.878 0 C-N-CA 123.62 2.88 . . . . 0.0 114.878 -178.874 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 52.5 p -113.44 -174.21 2.42 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 125.655 1.582 . . . . 0.0 112.265 177.439 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 58.0 mtmt -52.55 -25.4 10.36 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 126.873 2.069 . . . . 0.0 115.512 178.981 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 42.7 m -109.07 -19.83 13.23 Favored 'General case' 0 N--CA 1.478 0.968 0 N-CA-C 114.827 1.418 . . . . 0.0 114.827 -179.07 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 63.8 m -62.82 133.72 55.16 Favored 'General case' 0 CA--C 1.541 0.611 0 CA-C-N 119.471 1.032 . . . . 0.0 113.419 -179.107 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 35.5 mt-30 -81.92 139.14 34.81 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 123.41 0.684 . . . . 0.0 110.888 175.769 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 12.0 t -131.49 138.71 52.44 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.794 0 C-N-CA 125.413 1.485 . . . . 0.0 110.59 -177.275 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -145.69 132.75 20.33 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 125.093 1.357 . . . . 0.0 111.128 177.879 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 63.1 t30 42.78 37.14 0.97 Allowed 'General case' 0 CA--C 1.552 1.021 0 C-N-CA 126.684 1.994 . . . . 0.0 116.105 177.89 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 84.25 17.18 65.23 Favored Glycine 0 CA--C 1.536 1.402 0 O-C-N 120.998 -1.064 . . . . 0.0 114.848 -179.62 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 64.1 mtt180 -136.48 160.28 39.24 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 125.617 1.567 . . . . 0.0 111.736 -179.546 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 3.2 m -138.79 139.31 41.02 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.491 0 C-N-CA 127.63 2.372 . . . . 0.0 110.392 -176.459 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 59.1 mt -87.19 129.08 39.23 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.78 0 O-C-N 121.118 -0.988 . . . . 0.0 109.716 -179.788 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -75.13 149.87 38.92 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 124.185 0.994 . . . . 0.0 111.74 178.14 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 18.8 t -68.93 99.87 1.12 Allowed 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 124.682 1.193 . . . . 0.0 113.061 -177.045 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 33.2 p90 -61.83 -38.0 86.55 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 115.071 -0.968 . . . . 0.0 110.229 175.064 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 70.0 m-20 -62.22 -44.28 96.93 Favored 'General case' 0 CA--C 1.537 0.452 0 O-C-N 121.755 -0.591 . . . . 0.0 110.612 176.962 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 41.6 t -63.94 -41.79 97.51 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-N 119.631 1.105 . . . . 0.0 111.509 177.516 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 31.3 mt -63.57 -40.53 97.21 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 123.774 0.83 . . . . 0.0 112.875 176.286 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 32.2 mmmt -82.87 -9.07 59.49 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 124.878 1.271 . . . . 0.0 113.845 179.589 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 80.84 38.18 17.01 Favored Glycine 0 CA--C 1.537 1.463 0 C-N-CA 124.722 1.154 . . . . 0.0 114.103 179.571 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 50.3 ttp180 -120.75 -19.47 7.35 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 126.631 1.972 . . . . 0.0 114.83 -176.525 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 4.8 t -69.23 148.67 49.51 Favored 'General case' 0 CA--C 1.546 0.796 0 CA-C-N 119.311 0.96 . . . . 0.0 113.562 -177.789 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 86.6 p -156.38 7.58 0.2 Allowed 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 126.777 2.031 . . . . 0.0 113.438 179.562 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 76.3 mtm-85 -68.93 161.25 29.2 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 126.01 1.724 . . . . 0.0 114.077 -178.076 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -117.81 -1.73 11.49 Favored 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 125.926 1.691 . . . . 0.0 112.081 176.016 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 14.8 m120 -142.92 39.19 1.47 Allowed 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 128.496 2.719 . . . . 0.0 109.49 179.161 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 7.9 t -54.11 126.49 22.96 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 124.777 1.231 . . . . 0.0 111.465 -177.968 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 25.7 mtmt -80.46 0.78 32.03 Favored 'General case' 0 N--CA 1.474 0.771 0 N-CA-C 114.007 1.114 . . . . 0.0 114.007 -177.532 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 80.8 m-85 -125.58 154.35 42.36 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 125.127 1.371 . . . . 0.0 111.394 -175.127 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -76.69 113.15 14.02 Favored 'General case' 0 CA--C 1.533 0.312 0 O-C-N 121.654 -0.654 . . . . 0.0 112.265 -176.258 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 8.3 m170 -64.49 127.08 91.9 Favored Pre-proline 0 CA--C 1.545 0.768 0 N-CA-C 106.892 -1.521 . . . . 0.0 106.892 172.48 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 89.7 Cg_endo -72.97 120.73 6.79 Favored 'Trans proline' 0 CA--C 1.546 1.075 0 C-N-CA 122.401 2.067 . . . . 0.0 114.06 -170.757 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 94.3 Cg_endo -77.05 153.41 32.31 Favored 'Trans proline' 0 CA--C 1.544 1.001 0 C-N-CA 123.206 2.604 . . . . 0.0 111.973 178.297 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_exo -46.27 -41.45 22.28 Favored 'Trans proline' 0 CA--C 1.538 0.706 0 C-N-CA 124.156 3.237 . . . . 0.0 115.753 179.449 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 57.3 m80 -72.4 -13.7 61.52 Favored 'General case' 0 N--CA 1.475 0.805 0 N-CA-C 115.181 1.548 . . . . 0.0 115.181 179.605 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 92.1 mt -114.13 -17.21 11.96 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 124.426 1.091 . . . . 0.0 112.949 177.565 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 56.0 mtpt -54.89 -38.91 68.16 Favored 'General case' 0 N--CA 1.478 0.944 0 CA-C-N 119.931 1.241 . . . . 0.0 111.85 174.944 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 4.7 m -63.02 -38.51 91.48 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 123.728 0.811 . . . . 0.0 111.777 176.753 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 92.5 mm-40 -69.95 -49.57 50.49 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 123.175 0.59 . . . . 0.0 109.721 177.638 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 95.4 mt -58.47 -47.04 85.37 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 124.134 0.974 . . . . 0.0 113.056 178.767 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -62.97 -32.25 73.54 Favored 'General case' 0 N--CA 1.475 0.811 0 CA-C-N 119.932 1.242 . . . . 0.0 112.444 178.759 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 57.0 mt -74.73 -42.58 47.63 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.584 0 C-N-CA 123.858 0.863 . . . . 0.0 110.269 175.783 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 26.5 m120 -60.64 -36.17 78.01 Favored 'General case' 0 CA--C 1.543 0.692 0 CA-C-N 119.406 1.003 . . . . 0.0 110.423 174.75 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -57.17 -26.98 57.0 Favored Glycine 0 CA--C 1.535 1.295 0 C-N-CA 125.18 1.371 . . . . 0.0 113.643 176.56 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -60.31 -27.13 67.06 Favored 'General case' 0 N--CA 1.479 0.985 0 CA-C-N 118.633 1.216 . . . . 0.0 112.124 175.774 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 8.8 t-20 -80.17 -1.7 41.52 Favored 'General case' 0 CA--C 1.554 1.108 0 C-N-CA 125.419 1.488 . . . . 0.0 113.022 175.789 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 39.8 t30 -130.85 8.37 4.83 Favored 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 126.157 1.783 . . . . 0.0 112.679 179.978 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 15.3 tp -75.88 37.77 0.15 Allowed 'General case' 0 CA--C 1.552 1.055 0 C-N-CA 126.353 1.861 . . . . 0.0 113.406 -178.86 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 43.3 pt -77.58 -2.84 4.95 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.944 0 C-N-CA 126.069 1.748 . . . . 0.0 113.928 -179.779 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 87.7 mt-30 -138.27 165.24 27.22 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 126.591 1.956 . . . . 0.0 110.983 178.694 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 8.5 pt20 -55.06 142.21 31.31 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 124.977 1.311 . . . . 0.0 113.954 -179.542 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.21 -2.84 26.54 Favored 'General case' 0 N--CA 1.483 1.188 0 N-CA-C 115.3 1.593 . . . . 0.0 115.3 179.122 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 59.1 t-20 . . . . . 0 CA--C 1.545 0.763 0 C-N-CA 127.996 2.519 . . . . 0.0 114.677 -179.183 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.6 mmt . . . . . 0 CA--C 1.545 0.751 0 N-CA-C 113.433 0.901 . . . . 0.0 113.433 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -151.32 170.95 18.27 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 126.175 1.79 . . . . 0.0 111.81 179.843 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 48.1 t -136.0 136.42 49.71 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.928 0 C-N-CA 125.46 1.504 . . . . 0.0 109.725 179.29 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 9.5 t -154.96 -174.45 4.99 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 125.736 1.614 . . . . 0.0 110.774 179.718 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 6.5 p -71.44 23.75 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.482 1.155 0 C-N-CA 127.715 2.406 . . . . 0.0 114.685 -179.83 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 27.3 p -59.91 154.67 47.34 Favored Pre-proline 0 N--CA 1.479 1.006 0 C-N-CA 126.275 1.83 . . . . 0.0 113.225 178.723 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 47.0 Cg_endo -63.47 140.18 74.55 Favored 'Trans proline' 0 CA--C 1.54 0.796 0 C-N-CA 122.715 2.276 . . . . 0.0 112.243 179.321 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 8.9 tp -156.07 166.72 0.93 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.829 0 C-N-CA 126.451 1.9 . . . . 0.0 110.131 -179.111 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 11.7 tpt85 -58.68 146.29 36.96 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 124.242 1.017 . . . . 0.0 111.434 178.136 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -51.31 -71.55 0.06 Allowed 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 126.553 1.941 . . . . 0.0 115.697 -174.636 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 73.8 p -147.77 4.28 0.75 Allowed 'General case' 0 N--CA 1.486 1.341 0 N-CA-C 115.535 1.68 . . . . 0.0 115.535 -174.196 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 49.8 tttm -45.08 -29.36 0.87 Allowed 'General case' 0 N--CA 1.484 1.226 0 N-CA-C 117.405 2.372 . . . . 0.0 117.405 -174.85 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 2.5 p90 -112.39 1.07 15.84 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 124.89 1.276 . . . . 0.0 114.308 -179.337 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 94.8 mt -105.03 -10.13 17.4 Favored 'General case' 0 CA--C 1.539 0.522 0 N-CA-C 116.269 1.952 . . . . 0.0 116.269 -172.263 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 4.0 m -75.01 79.7 2.2 Favored 'General case' 0 N--CA 1.479 1.015 0 CA-C-N 120.474 1.488 . . . . 0.0 112.208 -179.044 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -75.68 144.59 41.53 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 127.066 2.146 . . . . 0.0 112.41 -177.908 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 10.3 mt-10 -74.89 150.96 38.99 Favored 'General case' 0 N--CA 1.474 0.771 0 O-C-N 120.688 -1.258 . . . . 0.0 111.916 176.577 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 15.9 m -82.06 150.89 4.3 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.795 0 N-CA-C 109.816 -0.439 . . . . 0.0 109.816 174.362 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 53.5 t -63.82 130.7 45.23 Favored 'General case' 0 C--O 1.237 0.43 0 CA-C-O 122.552 1.168 . . . . 0.0 111.349 177.671 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 3.3 mpt_? -68.45 -25.3 64.93 Favored 'General case' 0 N--CA 1.465 0.296 0 C-N-CA 124.716 1.207 . . . . 0.0 112.244 -178.582 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -84.21 -37.61 21.6 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 123.125 0.57 . . . . 0.0 110.017 177.303 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 63.5 t80 -62.0 -31.24 71.6 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 124.823 1.249 . . . . 0.0 110.884 174.982 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 12.4 mm100 -62.98 -15.81 57.44 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 123.928 0.891 . . . . 0.0 113.294 175.264 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 6.2 mpt_? -120.32 13.4 11.91 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 126.605 1.962 . . . . 0.0 111.464 177.058 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 57.96 35.82 77.84 Favored Glycine 0 CA--C 1.533 1.197 0 C-N-CA 125.396 1.474 . . . . 0.0 114.375 179.888 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 6.4 t -131.13 11.04 5.0 Favored 'General case' 0 N--CA 1.477 0.91 0 N-CA-C 115.128 1.529 . . . . 0.0 115.128 -175.527 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 44.3 t -60.7 136.57 58.11 Favored 'General case' 0 CA--C 1.548 0.891 0 CA-C-N 119.091 0.86 . . . . 0.0 110.523 176.078 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 80.2 p -93.01 6.37 48.15 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 125.541 1.537 . . . . 0.0 114.394 -178.235 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 57.2 mtm-85 -129.64 151.49 78.14 Favored Pre-proline 0 N--CA 1.474 0.76 0 C-N-CA 125.253 1.421 . . . . 0.0 113.795 -173.946 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 95.1 Cg_endo -74.59 163.88 35.01 Favored 'Trans proline' 0 CA--C 1.542 0.88 0 C-N-CA 122.429 2.086 . . . . 0.0 109.419 172.338 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 -54.62 -28.11 44.29 Favored 'General case' 0 N--CA 1.475 0.821 0 N-CA-C 113.407 0.891 . . . . 0.0 113.407 176.477 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 22.1 p -73.85 -17.43 61.06 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 125.57 1.548 . . . . 0.0 115.126 178.948 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -115.65 -31.08 5.96 Favored 'General case' 0 N--CA 1.478 0.939 0 N-CA-C 114.295 1.22 . . . . 0.0 114.295 -179.277 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 4.7 t -56.77 147.11 23.91 Favored 'General case' 0 CA--C 1.545 0.756 0 CA-C-O 122.735 1.255 . . . . 0.0 113.887 -175.63 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 39.6 mmtm -81.88 4.83 20.92 Favored 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 126.475 1.91 . . . . 0.0 113.145 -177.706 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 75.6 m-85 -143.76 170.18 16.35 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 128.633 2.773 . . . . 0.0 108.631 175.913 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -84.24 153.53 23.55 Favored 'General case' 0 CA--C 1.547 0.863 0 N-CA-C 114.526 1.306 . . . . 0.0 114.526 -177.048 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 65.0 m170 -124.58 90.66 50.61 Favored Pre-proline 0 CA--C 1.55 0.943 0 C-N-CA 126.203 1.801 . . . . 0.0 110.361 178.048 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 34.7 Cg_endo -64.0 148.53 91.56 Favored 'Trans proline' 0 CA--C 1.539 0.754 0 C-N-CA 123.31 2.674 . . . . 0.0 114.483 -177.535 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 52.9 p -86.72 -175.88 5.58 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 125.114 1.366 . . . . 0.0 112.228 175.847 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 58.0 mtmt -60.72 -20.04 60.2 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 125.556 1.542 . . . . 0.0 113.472 173.645 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 49.1 m -109.11 -20.81 12.87 Favored 'General case' 0 N--CA 1.477 0.897 0 N-CA-C 114.436 1.273 . . . . 0.0 114.436 -179.594 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 84.5 m -63.94 134.87 55.89 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 119.498 1.044 . . . . 0.0 113.193 179.878 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 35.7 mt-30 -81.45 142.1 33.27 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 123.181 0.592 . . . . 0.0 111.253 176.669 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 11.8 t -132.34 138.16 52.87 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.865 0 C-N-CA 125.404 1.481 . . . . 0.0 110.573 -177.748 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -146.21 132.66 19.68 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 125.298 1.439 . . . . 0.0 111.391 178.194 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 62.5 t30 41.26 37.94 0.7 Allowed 'General case' 0 CA--C 1.553 1.073 0 C-N-CA 126.99 2.116 . . . . 0.0 116.578 177.16 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 87.77 13.73 64.32 Favored Glycine 0 CA--C 1.535 1.335 0 O-C-N 120.997 -1.064 . . . . 0.0 115.188 179.777 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 56.0 mtt180 -136.56 164.16 28.85 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 125.421 1.488 . . . . 0.0 111.432 179.39 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 5.2 m -134.34 176.81 8.0 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 C-N-CA 129.127 2.971 . . . . 0.0 107.493 179.623 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 59.1 mt -126.71 130.07 71.57 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.833 0 CA-C-N 119.78 1.173 . . . . 0.0 108.786 179.589 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -73.04 147.62 44.89 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 123.758 0.823 . . . . 0.0 111.931 177.873 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 13.9 t -69.75 99.37 1.34 Allowed 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 125.067 1.347 . . . . 0.0 113.35 -176.432 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 26.4 p90 -61.92 -37.94 86.56 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 115.191 -0.913 . . . . 0.0 110.013 174.34 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 70.3 m-20 -61.44 -43.09 99.47 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 123.099 0.559 . . . . 0.0 110.851 177.193 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 44.6 t -64.66 -43.23 94.26 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-N 119.506 1.048 . . . . 0.0 111.566 177.911 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 34.3 mt -65.39 -36.99 85.65 Favored 'General case' 0 CA--C 1.542 0.665 0 N-CA-C 113.378 0.881 . . . . 0.0 113.378 177.124 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 29.7 mmmt -88.17 -5.62 58.32 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 125.197 1.399 . . . . 0.0 114.509 -178.32 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 81.02 39.84 12.48 Favored Glycine 0 CA--C 1.536 1.38 0 C-N-CA 124.506 1.05 . . . . 0.0 114.384 178.221 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 71.9 ttt-85 -123.64 -21.52 5.21 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 126.546 1.939 . . . . 0.0 114.695 -176.63 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 5.5 t -73.06 136.29 44.96 Favored 'General case' 0 CA--C 1.545 0.765 0 CA-C-N 119.431 1.014 . . . . 0.0 113.387 -177.396 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 58.3 m -145.38 11.79 1.32 Allowed 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 127.12 2.168 . . . . 0.0 112.066 178.343 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 81.3 mtm-85 -70.24 160.01 32.96 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 125.888 1.675 . . . . 0.0 114.265 -177.608 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -114.16 -9.35 12.91 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 127.843 2.457 . . . . 0.0 112.507 177.731 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 10.8 m120 -142.47 41.09 1.6 Allowed 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 128.155 2.582 . . . . 0.0 109.857 -179.614 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 9.0 t -53.07 129.07 29.7 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 124.774 1.23 . . . . 0.0 111.607 -178.367 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 31.8 mtmt -84.17 2.33 40.21 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 124.62 1.168 . . . . 0.0 113.63 -177.87 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 84.4 m-85 -125.08 154.36 41.5 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 125.384 1.473 . . . . 0.0 111.908 -175.521 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -78.07 114.72 17.22 Favored 'General case' 0 N--CA 1.465 0.318 0 C-N-CA 123.989 0.915 . . . . 0.0 112.155 -176.619 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 11.0 m170 -70.2 115.17 31.73 Favored Pre-proline 0 CA--C 1.546 0.8 0 N-CA-C 108.094 -1.076 . . . . 0.0 108.094 174.654 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 81.1 Cg_exo -48.89 114.07 1.12 Allowed 'Trans proline' 0 CA--C 1.543 0.928 0 C-N-CA 124.621 3.547 . . . . 0.0 116.794 -174.757 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_endo -77.02 155.78 33.9 Favored 'Trans proline' 0 CA--C 1.546 1.114 0 C-N-CA 122.658 2.238 . . . . 0.0 111.479 175.965 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 92.9 Cg_exo -43.58 -45.79 10.44 Favored 'Trans proline' 0 CA--C 1.539 0.73 0 C-N-CA 124.861 3.707 . . . . 0.0 116.531 -179.777 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -73.53 -12.61 60.83 Favored 'General case' 0 N--CA 1.478 0.971 0 N-CA-C 114.676 1.362 . . . . 0.0 114.676 -179.431 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 87.0 mt -112.64 -19.56 12.02 Favored 'General case' 0 N--CA 1.475 0.789 0 CA-C-N 119.458 1.026 . . . . 0.0 113.71 -179.717 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 54.3 mtpt -52.69 -39.66 62.17 Favored 'General case' 0 N--CA 1.48 1.035 0 CA-C-N 119.908 1.231 . . . . 0.0 111.426 174.252 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 24.7 m -63.19 -41.59 99.21 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 124.781 1.232 . . . . 0.0 111.92 176.926 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 16.9 mm100 -68.57 -44.39 74.54 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 123.56 0.744 . . . . 0.0 110.521 179.206 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 81.0 mt -62.31 -46.63 87.89 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 123.376 0.67 . . . . 0.0 112.235 177.769 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -64.21 -29.78 70.87 Favored 'General case' 0 N--CA 1.476 0.854 0 CA-C-N 120.361 1.437 . . . . 0.0 113.106 178.147 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 63.9 mt -71.15 -44.88 73.77 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.69 0 O-C-N 121.354 -0.841 . . . . 0.0 109.242 174.854 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 75.7 m-20 -62.15 -36.72 82.68 Favored 'General case' 0 CA--C 1.542 0.639 0 O-C-N 121.644 -0.66 . . . . 0.0 110.955 175.773 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -61.01 -49.28 80.36 Favored Glycine 0 CA--C 1.529 0.93 0 C-N-CA 124.513 1.054 . . . . 0.0 111.494 177.95 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 82.6 mtt85 -57.81 -43.02 85.42 Favored 'General case' 0 N--CA 1.481 1.078 0 CA-C-N 118.063 0.931 . . . . 0.0 111.559 175.334 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 55.9 t30 -64.5 -7.73 11.2 Favored 'General case' 0 CA--C 1.553 1.071 0 C-N-CA 124.959 1.304 . . . . 0.0 114.027 177.271 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 61.1 m-80 -125.28 12.46 8.2 Favored 'General case' 0 CA--C 1.551 1.003 0 C-N-CA 126.507 1.923 . . . . 0.0 112.38 178.771 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 18.7 tp -130.48 21.76 5.15 Favored 'General case' 0 CA--C 1.55 0.971 0 C-N-CA 126.714 2.005 . . . . 0.0 111.082 179.549 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 75.2 mt -57.32 123.98 10.06 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.535 0 C-N-CA 126.814 2.045 . . . . 0.0 109.71 179.719 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 3.6 tp-100 -110.74 2.83 18.66 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 125.091 1.356 . . . . 0.0 114.057 -175.728 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 89.9 mm-40 -60.72 -9.89 4.61 Favored 'General case' 0 N--CA 1.477 0.897 0 N-CA-C 115.963 1.838 . . . . 0.0 115.963 -178.895 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 65.6 pttt -121.8 11.96 10.5 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 125.777 1.631 . . . . 0.0 114.397 -179.637 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 45.7 t30 . . . . . 0 CA--C 1.545 0.767 0 C-N-CA 124.793 1.237 . . . . 0.0 112.855 179.552 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.0 mmt . . . . . 0 CA--C 1.54 0.592 0 N-CA-C 113.485 0.92 . . . . 0.0 113.485 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -55.7 -10.73 0.76 Allowed 'General case' 0 CA--C 1.552 1.046 0 N-CA-C 116.276 1.954 . . . . 0.0 116.276 -179.341 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 8.2 p -127.63 8.68 3.28 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.976 0 C-N-CA 126.372 1.869 . . . . 0.0 112.329 179.166 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 37.0 m -133.35 -20.05 2.13 Favored 'General case' 0 N--CA 1.479 0.977 0 N-CA-C 114.881 1.438 . . . . 0.0 114.881 -178.031 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 9.3 p -66.32 145.04 14.15 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.892 0 C-N-CA 124.364 1.066 . . . . 0.0 112.063 179.0 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 41.5 p -143.23 151.21 54.65 Favored Pre-proline 0 N--CA 1.478 0.968 0 C-N-CA 125.741 1.616 . . . . 0.0 110.866 178.986 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 70.6 Cg_endo -78.97 -12.7 14.52 Favored 'Trans proline' 0 CA--C 1.542 0.896 0 C-N-CA 123.358 2.705 . . . . 0.0 115.176 -177.554 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 43.8 pt -77.83 176.53 0.66 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 C-N-CA 125.713 1.605 . . . . 0.0 113.635 -177.797 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 41.3 ptt180 -55.56 155.91 5.13 Favored 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 125.387 1.475 . . . . 0.0 113.225 177.832 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -145.49 145.5 31.09 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 124.263 1.025 . . . . 0.0 112.807 -177.528 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 28.9 p -134.41 -5.81 2.59 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 125.19 1.396 . . . . 0.0 113.129 174.613 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 24.5 pttm -64.58 -31.91 73.34 Favored 'General case' 0 N--CA 1.477 0.884 0 CA-C-N 120.695 1.588 . . . . 0.0 111.932 175.56 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -64.92 -31.33 72.51 Favored 'General case' 0 N--CA 1.476 0.858 0 CA-C-N 118.651 0.66 . . . . 0.0 111.29 172.397 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 92.5 mt -89.76 -8.45 52.17 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 126.615 1.966 . . . . 0.0 114.268 -179.146 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 18.2 m -81.15 80.52 7.59 Favored 'General case' 0 N--CA 1.475 0.781 0 CA-C-O 122.13 0.966 . . . . 0.0 110.477 -178.625 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -75.77 145.21 40.95 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 128.613 2.765 . . . . 0.0 111.983 -178.232 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 52.8 mt-10 -72.33 150.99 43.02 Favored 'General case' 0 N--CA 1.47 0.564 0 O-C-N 120.487 -1.383 . . . . 0.0 112.615 176.899 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 16.8 m -86.69 156.49 3.3 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.971 0 C-N-CA 123.506 0.723 . . . . 0.0 111.418 174.359 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 49.1 t -77.66 129.69 35.88 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-O 121.607 0.718 . . . . 0.0 110.649 177.238 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 4.2 mpt_? -66.64 -28.99 68.92 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 124.418 1.087 . . . . 0.0 113.247 -177.462 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -78.13 -40.21 38.83 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 123.443 0.697 . . . . 0.0 109.518 177.79 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 64.3 t80 -63.24 -35.07 79.11 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 124.486 1.115 . . . . 0.0 111.298 175.957 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 13.8 mm100 -62.12 -15.31 44.65 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 124.227 1.011 . . . . 0.0 113.38 175.424 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 11.8 mtp-105 -120.76 12.67 11.41 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 127.233 2.213 . . . . 0.0 112.28 179.569 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 57.99 34.69 73.15 Favored Glycine 0 CA--C 1.536 1.354 0 C-N-CA 125.086 1.327 . . . . 0.0 113.9 -179.771 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 7.3 t -129.88 13.36 5.8 Favored 'General case' 0 N--CA 1.475 0.801 0 N-CA-C 114.906 1.447 . . . . 0.0 114.906 -175.196 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 6.5 t -69.53 171.7 8.45 Favored 'General case' 0 CA--C 1.556 1.182 0 O-C-N 121.413 -0.804 . . . . 0.0 110.542 173.823 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 50.7 m -135.45 13.57 3.49 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 125.059 1.344 . . . . 0.0 114.457 -176.796 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 51.0 mtt85 -135.45 145.97 55.81 Favored Pre-proline 0 N--CA 1.47 0.553 0 C-N-CA 125.301 1.44 . . . . 0.0 112.756 -176.349 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_endo -69.69 165.34 31.21 Favored 'Trans proline' 0 CA--C 1.545 1.06 0 C-N-CA 121.943 1.762 . . . . 0.0 109.744 171.323 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -54.6 -30.25 54.09 Favored 'General case' 0 N--CA 1.477 0.91 0 O-C-N 121.124 -0.985 . . . . 0.0 112.678 177.882 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 29.9 p -72.37 -8.43 54.93 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 126.268 1.827 . . . . 0.0 115.135 177.792 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 27.0 mm-40 -124.61 -24.86 4.1 Favored 'General case' 0 N--CA 1.476 0.868 0 N-CA-C 115.53 1.678 . . . . 0.0 115.53 -175.993 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 1.4 t -73.45 170.33 15.34 Favored 'General case' 0 CA--C 1.545 0.753 0 N-CA-C 115.361 1.615 . . . . 0.0 115.361 -175.921 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 13.0 mmmm -85.24 -13.16 50.74 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 126.807 2.043 . . . . 0.0 113.285 -179.377 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 56.7 m-85 -140.02 174.86 10.09 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 126.761 2.025 . . . . 0.0 109.598 179.001 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -83.65 151.04 25.51 Favored 'General case' 0 CA--C 1.545 0.784 0 N-CA-C 114.177 1.177 . . . . 0.0 114.177 -177.034 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 64.2 m170 -121.86 87.27 46.59 Favored Pre-proline 0 CA--C 1.553 1.068 0 C-N-CA 126.158 1.783 . . . . 0.0 110.888 179.572 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 39.5 Cg_endo -64.4 150.54 88.08 Favored 'Trans proline' 0 CA--C 1.54 0.808 0 C-N-CA 123.568 2.845 . . . . 0.0 114.912 -177.797 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 53.4 p -88.01 -174.93 4.9 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 124.945 1.298 . . . . 0.0 111.985 175.578 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 63.0 mttp -62.01 -18.67 61.28 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 125.523 1.529 . . . . 0.0 113.368 173.421 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 25.1 m -109.12 -22.4 12.14 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.917 1.287 . . . . 0.0 114.153 -179.079 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 89.6 m -63.58 138.35 58.47 Favored 'General case' 0 CA--C 1.542 0.651 0 CA-C-N 119.394 0.997 . . . . 0.0 113.175 179.586 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 16.3 mt-30 -80.66 136.2 36.17 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 124.663 1.185 . . . . 0.0 111.466 179.004 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 9.2 t -129.75 136.25 59.49 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.816 0 C-N-CA 124.958 1.303 . . . . 0.0 110.913 -178.084 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -146.99 131.8 18.01 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 125.286 1.435 . . . . 0.0 111.79 178.185 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 62.5 t30 39.46 39.3 0.47 Allowed 'General case' 0 CA--C 1.554 1.106 0 C-N-CA 127.28 2.232 . . . . 0.0 116.863 176.63 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 90.58 11.55 62.11 Favored Glycine 0 CA--C 1.536 1.374 0 O-C-N 121.101 -1.0 . . . . 0.0 115.393 179.465 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 42.1 mtm180 -136.17 164.9 26.98 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 125.53 1.532 . . . . 0.0 112.358 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 5.2 m -137.2 151.21 26.64 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.642 0 C-N-CA 128.12 2.568 . . . . 0.0 109.135 -179.93 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 17.2 mt -100.5 130.68 49.38 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.78 0 O-C-N 121.191 -0.943 . . . . 0.0 110.181 -178.306 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -78.31 149.79 33.41 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 123.946 0.898 . . . . 0.0 111.99 178.637 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 19.2 t -71.79 99.21 2.12 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 125.242 1.417 . . . . 0.0 113.039 -176.362 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 24.3 p90 -60.88 -36.83 80.21 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 123.574 0.75 . . . . 0.0 110.514 174.76 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 73.6 m-20 -61.3 -38.24 86.1 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 123.397 0.679 . . . . 0.0 111.199 177.338 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 31.2 p -64.72 -41.37 96.02 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 119.5 1.045 . . . . 0.0 112.216 178.058 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 38.5 mt -69.7 -40.74 76.13 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 124.575 1.15 . . . . 0.0 112.04 177.613 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 30.9 mmmt -76.31 -11.87 59.98 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 124.464 1.106 . . . . 0.0 113.71 178.482 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 78.5 35.75 31.96 Favored Glycine 0 CA--C 1.537 1.457 0 C-N-CA 124.563 1.078 . . . . 0.0 113.43 -179.508 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 50.8 ttp180 -116.66 -19.85 9.8 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 126.623 1.969 . . . . 0.0 114.378 -176.67 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 5.1 t -67.92 140.85 56.48 Favored 'General case' 0 CA--C 1.545 0.784 0 CA-C-N 119.078 0.854 . . . . 0.0 112.949 -177.879 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 87.6 p -152.4 8.92 0.47 Allowed 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 126.709 2.004 . . . . 0.0 113.056 179.715 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 87.3 mtm-85 -67.84 163.37 22.02 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 126.393 1.877 . . . . 0.0 114.65 -178.216 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -125.38 8.55 7.8 Favored 'General case' 0 CA--C 1.553 1.095 0 C-N-CA 126.916 2.086 . . . . 0.0 110.526 173.64 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 35.6 p-10 -142.76 22.73 1.95 Allowed 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 129.311 3.045 . . . . 0.0 112.15 -177.843 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 4.2 t -49.54 120.01 3.85 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 125.228 1.411 . . . . 0.0 112.518 -175.723 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 33.8 mtmt -84.88 6.97 22.61 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 125.556 1.542 . . . . 0.0 113.636 -177.399 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 84.8 m-85 -129.14 151.88 49.33 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 125.192 1.397 . . . . 0.0 112.258 -174.589 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -77.2 118.61 19.88 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 123.723 0.809 . . . . 0.0 112.096 -176.992 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 11.2 m170 -71.4 115.91 41.96 Favored Pre-proline 0 CA--C 1.548 0.876 0 N-CA-C 108.045 -1.094 . . . . 0.0 108.045 174.381 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_exo -47.3 112.18 0.5 Allowed 'Trans proline' 0 CA--C 1.543 0.969 0 C-N-CA 125.015 3.81 . . . . 0.0 115.507 -176.231 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -75.68 148.82 33.19 Favored 'Trans proline' 0 CA--C 1.542 0.887 0 C-N-CA 122.052 1.835 . . . . 0.0 110.366 176.866 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_exo -47.32 -37.64 25.1 Favored 'Trans proline' 0 CA--C 1.539 0.748 0 C-N-CA 123.723 2.949 . . . . 0.0 115.193 179.433 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 6.8 t-80 -72.04 -16.94 62.05 Favored 'General case' 0 N--CA 1.472 0.659 0 N-CA-C 115.177 1.547 . . . . 0.0 115.177 179.778 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 90.9 mt -115.22 -15.78 11.6 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 124.735 1.214 . . . . 0.0 112.898 177.791 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 52.9 mtpt -53.98 -34.36 59.58 Favored 'General case' 0 N--CA 1.475 0.78 0 CA-C-N 119.662 1.119 . . . . 0.0 111.384 174.37 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 27.5 m -61.82 -47.13 86.47 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-N 118.723 0.692 . . . . 0.0 111.462 175.381 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 93.3 mm-40 -66.23 -43.56 86.28 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 123.772 0.829 . . . . 0.0 111.316 178.04 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 76.3 mt -62.53 -45.49 92.75 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 123.896 0.879 . . . . 0.0 111.984 178.085 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 5.3 pt-20 -66.11 -36.48 83.27 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-N 119.459 1.027 . . . . 0.0 112.153 177.859 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 51.2 mt -61.11 -39.84 83.75 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 CA-C-N 119.509 1.05 . . . . 0.0 110.386 177.193 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 29.4 m-80 -70.76 -43.5 68.66 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 123.216 0.606 . . . . 0.0 111.4 175.436 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -66.14 -40.82 95.12 Favored Glycine 0 CA--C 1.533 1.179 0 C-N-CA 124.242 0.925 . . . . 0.0 113.71 -179.665 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 53.2 mtp180 -60.9 -17.18 49.22 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 125.742 1.617 . . . . 0.0 113.47 176.586 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 63.9 t30 -107.92 14.13 25.6 Favored 'General case' 0 CA--C 1.554 1.108 0 C-N-CA 125.881 1.672 . . . . 0.0 111.96 177.578 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 25.2 t-20 -136.63 -35.87 0.72 Allowed 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 125.811 1.644 . . . . 0.0 113.863 -176.15 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 87.5 mt -74.33 62.26 0.95 Allowed 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 127.029 2.132 . . . . 0.0 112.678 179.708 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 25.2 pt -135.82 144.41 33.62 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.62 0 C-N-CA 126.645 1.978 . . . . 0.0 110.681 -179.411 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -158.63 159.51 35.49 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 125.248 1.419 . . . . 0.0 112.029 -178.108 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 87.5 mt-30 -60.77 -24.74 65.99 Favored 'General case' 0 N--CA 1.478 0.955 0 N-CA-C 113.816 1.043 . . . . 0.0 113.816 179.222 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 75.2 mmtt -81.01 7.28 11.15 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 126.168 1.787 . . . . 0.0 113.732 178.329 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 49.6 t-20 . . . . . 0 CA--C 1.542 0.649 0 C-N-CA 125.879 1.671 . . . . 0.0 112.446 -176.056 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 95.5 mmm . . . . . 0 CA--C 1.542 0.67 0 N-CA-C 113.339 0.866 . . . . 0.0 113.339 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -57.56 -24.91 58.8 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 125.008 1.323 . . . . 0.0 114.217 -179.896 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 7.8 p -62.78 -22.86 31.32 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 C-N-CA 125.013 1.325 . . . . 0.0 113.632 178.339 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 50.1 m -71.34 -7.82 49.66 Favored 'General case' 0 N--CA 1.475 0.783 0 N-CA-C 116.12 1.896 . . . . 0.0 116.12 -178.073 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 35.0 m -64.34 156.49 5.42 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.156 0 CA-C-N 119.89 1.223 . . . . 0.0 113.12 179.406 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 7.4 p -68.72 150.73 97.56 Favored Pre-proline 0 N--CA 1.475 0.817 0 C-N-CA 124.178 0.991 . . . . 0.0 112.506 177.516 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 93.0 Cg_endo -74.79 166.14 29.94 Favored 'Trans proline' 0 CA--C 1.541 0.87 0 C-N-CA 123.301 2.667 . . . . 0.0 112.549 179.08 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 44.7 pt -107.77 10.15 9.17 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.121 0 C-N-CA 125.292 1.437 . . . . 0.0 113.02 178.828 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 33.9 ttm180 -60.87 -22.58 64.42 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 126.359 1.864 . . . . 0.0 113.93 179.236 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 55.5 t0 -73.52 68.34 1.15 Allowed 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 125.887 1.675 . . . . 0.0 112.594 178.76 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 22.3 p -64.49 0.37 1.08 Allowed 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 126.181 1.792 . . . . 0.0 115.138 -179.737 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 1.6 ttmp? -47.7 -42.71 25.66 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 125.704 1.601 . . . . 0.0 112.668 178.377 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -72.86 -27.88 62.18 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 124.359 1.064 . . . . 0.0 113.814 179.686 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 82.6 mt -91.77 -16.6 26.6 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 127.021 2.128 . . . . 0.0 114.994 -176.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 7.0 m -77.41 77.14 3.94 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 124.314 1.046 . . . . 0.0 111.543 -177.096 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 13.0 tp -75.62 143.76 42.11 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 128.757 2.823 . . . . 0.0 112.007 -178.375 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 10.1 mt-10 -73.32 150.5 41.85 Favored 'General case' 0 N--CA 1.474 0.743 0 O-C-N 120.448 -1.407 . . . . 0.0 112.886 178.788 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 16.0 m -84.48 154.66 3.62 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.838 0 C-N-CA 122.805 0.442 . . . . 0.0 111.673 176.256 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 44.8 t -74.98 131.02 40.35 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-O 121.192 0.52 . . . . 0.0 109.829 175.316 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 4.5 mpt_? -68.29 -37.34 80.55 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 125.623 1.569 . . . . 0.0 112.976 -176.836 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 15.9 mm-40 -76.65 -33.54 58.31 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 123.848 0.859 . . . . 0.0 111.151 179.334 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 78.3 t80 -63.3 -27.79 69.57 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 123.964 0.906 . . . . 0.0 111.287 174.923 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 52.9 mm-40 -63.59 -19.6 64.97 Favored 'General case' 0 N--CA 1.476 0.858 0 N-CA-C 112.855 0.687 . . . . 0.0 112.855 175.307 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 6.7 mpt_? -111.85 10.67 20.76 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 126.404 1.882 . . . . 0.0 111.645 177.008 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 58.05 36.34 80.97 Favored Glycine 0 CA--C 1.534 1.26 0 C-N-CA 125.542 1.544 . . . . 0.0 114.216 -179.879 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 6.1 t -132.54 13.46 4.51 Favored 'General case' 0 N--CA 1.479 0.983 0 N-CA-C 115.143 1.534 . . . . 0.0 115.143 -175.031 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 39.6 t -59.9 131.77 51.88 Favored 'General case' 0 CA--C 1.55 0.967 0 O-C-N 121.379 -0.825 . . . . 0.0 111.157 176.984 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 21.8 m -73.95 1.89 9.81 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 125.985 1.714 . . . . 0.0 115.217 -177.347 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 63.4 mtm-85 -132.49 148.67 70.55 Favored Pre-proline 0 N--CA 1.474 0.75 0 C-N-CA 125.657 1.583 . . . . 0.0 112.867 -175.466 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -67.81 162.21 40.54 Favored 'Trans proline' 0 CA--C 1.542 0.923 0 C-N-CA 121.92 1.747 . . . . 0.0 109.425 171.674 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 17.2 m-20 -53.45 -25.44 16.1 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 125.025 1.33 . . . . 0.0 114.205 -177.437 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 16.8 p -83.84 -12.75 55.12 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 127.342 2.257 . . . . 0.0 115.317 178.855 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 16.2 mt-10 -111.5 -22.77 11.1 Favored 'General case' 0 N--CA 1.478 0.943 0 N-CA-C 115.291 1.589 . . . . 0.0 115.291 -176.835 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 3.8 t -66.92 164.85 16.63 Favored 'General case' 0 CA--C 1.545 0.769 0 N-CA-C 114.059 1.133 . . . . 0.0 114.059 -178.571 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 44.1 mmtm -100.58 6.66 44.22 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 126.541 1.937 . . . . 0.0 113.6 -176.94 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 51.9 m-85 -141.3 167.57 21.86 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 127.64 2.376 . . . . 0.0 108.448 173.503 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -80.08 148.04 31.19 Favored 'General case' 0 CA--C 1.544 0.75 0 O-C-N 120.94 -1.1 . . . . 0.0 113.584 -176.372 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 20.6 m170 -120.27 87.86 40.79 Favored Pre-proline 0 CA--C 1.554 1.097 0 C-N-CA 125.79 1.636 . . . . 0.0 110.563 -179.366 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -59.67 146.08 96.35 Favored 'Trans proline' 0 C--N 1.354 0.863 0 C-N-CA 123.442 2.761 . . . . 0.0 114.871 -178.032 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 48.1 p -82.86 -178.78 7.23 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 124.305 1.042 . . . . 0.0 112.474 175.942 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -59.8 -19.85 53.19 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 125.698 1.599 . . . . 0.0 113.599 173.934 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 51.8 m -109.23 -15.59 14.25 Favored 'General case' 0 N--CA 1.476 0.828 0 N-CA-C 114.888 1.44 . . . . 0.0 114.888 -179.259 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 78.8 m -65.67 159.52 24.76 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-N 119.896 1.225 . . . . 0.0 114.046 179.459 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 41.1 mt-30 -119.37 140.81 49.76 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 125.257 1.423 . . . . 0.0 111.063 178.15 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 1.1 m -131.79 149.87 33.29 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.576 0 C-N-CA 125.118 1.367 . . . . 0.0 112.546 -177.388 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 -144.59 139.13 27.92 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 125.929 1.692 . . . . 0.0 110.455 176.445 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 89.4 m-20 45.54 34.83 1.77 Allowed 'General case' 0 CA--C 1.554 1.124 0 N-CA-C 115.464 1.653 . . . . 0.0 115.464 176.18 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 81.07 19.81 66.41 Favored Glycine 0 CA--C 1.536 1.359 0 C-N-CA 124.243 0.925 . . . . 0.0 114.781 -179.363 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 44.3 mtt180 -137.33 160.83 37.94 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 125.145 1.378 . . . . 0.0 112.311 -179.067 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 3.3 m -137.41 142.63 36.39 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.648 0 C-N-CA 127.817 2.447 . . . . 0.0 109.972 -177.075 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 43.4 mt -91.26 126.34 43.94 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.567 0 O-C-N 121.386 -0.821 . . . . 0.0 109.871 -178.504 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -70.05 146.15 51.19 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 123.954 0.901 . . . . 0.0 111.334 177.689 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 29.4 t -67.08 100.22 0.74 Allowed 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 124.675 1.19 . . . . 0.0 112.244 -178.122 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 32.9 p90 -61.3 -37.8 84.51 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 115.017 -0.992 . . . . 0.0 110.017 175.557 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 70.9 m-20 -61.89 -44.63 96.41 Favored 'General case' 0 CA--C 1.539 0.55 0 O-C-N 121.8 -0.562 . . . . 0.0 110.475 176.746 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 43.3 t -63.57 -46.11 87.36 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 119.748 1.158 . . . . 0.0 111.247 177.763 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 34.4 mt -61.16 -40.75 95.02 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 124.059 0.944 . . . . 0.0 113.42 176.759 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 31.3 mmmt -81.23 -12.88 59.01 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 124.78 1.232 . . . . 0.0 113.746 179.297 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 85.66 38.08 9.07 Favored Glycine 0 CA--C 1.539 1.539 0 C-N-CA 124.681 1.134 . . . . 0.0 114.336 179.438 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 47.8 ttp180 -121.86 -20.76 6.28 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 126.716 2.006 . . . . 0.0 114.764 -176.705 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 5.0 t -68.43 147.25 52.32 Favored 'General case' 0 CA--C 1.544 0.742 0 CA-C-N 119.442 1.019 . . . . 0.0 113.349 -177.835 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 86.1 p -154.49 7.6 0.31 Allowed 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 126.738 2.015 . . . . 0.0 113.146 179.559 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 76.8 mtm-85 -69.56 161.71 29.02 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 126.126 1.77 . . . . 0.0 113.74 -178.451 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -119.46 -0.26 10.92 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 125.884 1.674 . . . . 0.0 112.136 176.219 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 17.8 m120 -143.54 37.06 1.33 Allowed 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 128.217 2.607 . . . . 0.0 109.831 179.28 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 7.8 t -54.0 128.71 31.57 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 125.049 1.339 . . . . 0.0 111.272 -178.42 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 27.0 mtmt -83.47 0.83 44.62 Favored 'General case' 0 N--CA 1.477 0.899 0 N-CA-C 113.731 1.011 . . . . 0.0 113.731 -177.856 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 84.7 m-85 -122.82 154.0 38.81 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 125.203 1.401 . . . . 0.0 111.438 -175.778 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -75.56 112.32 11.78 Favored 'General case' 0 CA--C 1.531 0.242 0 N-CA-C 113.513 0.931 . . . . 0.0 113.513 -175.548 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 12.0 m170 -69.05 117.36 51.04 Favored Pre-proline 0 CA--C 1.545 0.777 0 N-CA-C 105.111 -2.181 . . . . 0.0 105.111 169.972 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -71.41 132.51 20.84 Favored 'Trans proline' 0 CA--C 1.541 0.849 0 C-N-CA 121.821 1.68 . . . . 0.0 114.719 -169.948 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 86.7 Cg_endo -77.16 153.88 32.24 Favored 'Trans proline' 0 CA--C 1.544 0.979 0 C-N-CA 123.39 2.727 . . . . 0.0 111.501 178.18 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 98.6 Cg_exo -44.81 -39.96 14.25 Favored 'Trans proline' 0 CA--C 1.539 0.771 0 C-N-CA 124.561 3.507 . . . . 0.0 116.11 179.902 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 72.7 m80 -73.4 -14.38 61.26 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 115.138 1.533 . . . . 0.0 115.138 179.796 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 92.8 mt -116.04 -16.29 11.07 Favored 'General case' 0 N--CA 1.474 0.725 0 C-N-CA 124.817 1.247 . . . . 0.0 113.383 179.814 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 61.2 mtpt -54.5 -36.68 64.45 Favored 'General case' 0 N--CA 1.48 1.033 0 CA-C-N 119.572 1.078 . . . . 0.0 111.11 172.569 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 19.6 m -63.97 -42.73 97.16 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 124.644 1.178 . . . . 0.0 111.65 176.211 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 89.9 mm-40 -66.85 -43.73 82.85 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 123.543 0.737 . . . . 0.0 110.51 178.827 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 93.8 mt -63.32 -43.46 97.73 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-O 118.405 -0.807 . . . . 0.0 112.401 177.378 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -65.81 -35.81 81.73 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-N 120.339 1.427 . . . . 0.0 111.827 176.58 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 66.7 mt -62.48 -42.48 95.87 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.845 0 CA-C-N 119.034 0.834 . . . . 0.0 109.677 175.25 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 82.4 m-20 -63.92 -44.49 92.74 Favored 'General case' 0 CA--C 1.544 0.743 0 O-C-N 121.658 -0.651 . . . . 0.0 110.537 174.927 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -59.76 -45.61 95.46 Favored Glycine 0 CA--C 1.528 0.865 0 C-N-CA 125.328 1.442 . . . . 0.0 112.452 179.294 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 86.6 mtt-85 -58.42 -19.24 34.58 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 125.177 1.391 . . . . 0.0 113.389 175.843 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 53.9 m-80 -103.86 6.19 36.34 Favored 'General case' 0 CA--C 1.551 1.017 0 C-N-CA 125.976 1.711 . . . . 0.0 113.279 178.501 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 35.4 m-80 -129.88 -36.73 1.56 Allowed 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 125.374 1.47 . . . . 0.0 112.525 178.848 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 61.5 tp -59.09 -30.26 67.96 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 125.625 1.57 . . . . 0.0 112.525 177.482 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 1.6 pp -57.14 -7.08 0.49 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.878 0 C-N-CA 126.93 2.092 . . . . 0.0 115.648 178.475 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 39.3 mt-30 -67.21 -13.77 62.28 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 124.489 1.115 . . . . 0.0 113.1 176.348 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -73.4 -13.02 61.01 Favored 'General case' 0 CA--C 1.548 0.883 0 N-CA-C 114.142 1.164 . . . . 0.0 114.142 178.234 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 67.4 mttm -60.76 156.2 17.58 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 125.448 1.499 . . . . 0.0 112.864 178.625 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 43.5 t30 . . . . . 0 CA--C 1.542 0.666 0 C-N-CA 125.33 1.452 . . . . 0.0 111.468 179.413 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.7 mpp? . . . . . 0 CA--C 1.546 0.789 0 N-CA-C 113.198 0.814 . . . . 0.0 113.198 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -150.25 166.98 28.27 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 126.025 1.73 . . . . 0.0 111.993 179.65 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 28.2 m -140.16 163.17 24.15 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.998 0 C-N-CA 125.952 1.701 . . . . 0.0 111.594 179.542 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 40.6 m -144.24 163.71 32.86 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 125.268 1.427 . . . . 0.0 111.874 -179.682 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 30.8 m -139.62 164.34 24.07 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.023 0 C-N-CA 126.041 1.737 . . . . 0.0 111.17 179.08 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 12.4 p -62.71 125.63 86.73 Favored Pre-proline 0 N--CA 1.477 0.879 0 C-N-CA 124.1 0.96 . . . . 0.0 112.064 179.178 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 96.4 Cg_endo -76.44 166.99 26.49 Favored 'Trans proline' 0 CA--C 1.542 0.875 0 C-N-CA 123.336 2.691 . . . . 0.0 112.847 -179.978 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 47.4 pt -126.0 -2.11 4.96 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.099 0 C-N-CA 125.259 1.423 . . . . 0.0 113.547 178.825 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 32.2 ttt85 -49.27 -36.61 21.1 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 125.796 1.638 . . . . 0.0 113.856 -178.515 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 -67.57 -17.93 64.82 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 126.187 1.795 . . . . 0.0 115.084 -179.842 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 68.9 p -134.53 -10.36 2.46 Favored 'General case' 0 N--CA 1.481 1.1 0 N-CA-C 115.25 1.574 . . . . 0.0 115.25 -178.482 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 86.3 tttt -51.95 -28.7 17.53 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 125.055 1.342 . . . . 0.0 114.338 178.947 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -96.25 -6.93 36.86 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 125.403 1.481 . . . . 0.0 113.982 177.814 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 65.4 mt -98.44 -11.92 21.88 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 126.344 1.858 . . . . 0.0 115.454 -175.479 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 4.8 m -77.09 75.66 3.66 Favored 'General case' 0 N--CA 1.478 0.944 0 CA-C-O 122.366 1.079 . . . . 0.0 110.949 -179.788 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 12.2 tp -75.98 143.24 41.64 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 128.027 2.531 . . . . 0.0 112.455 -177.757 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -68.44 148.78 50.14 Favored 'General case' 0 N--CA 1.474 0.755 0 O-C-N 120.729 -1.232 . . . . 0.0 112.255 177.578 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 20.9 m -82.68 149.95 4.48 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.827 0 C-N-CA 122.927 0.491 . . . . 0.0 110.286 173.142 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.406 ' HB2' ' CE1' ' A' ' 38' ' ' HIS . 48.1 t -67.31 123.4 20.24 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-O 122.352 1.073 . . . . 0.0 111.463 178.071 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 2.7 mpt_? -64.39 -28.74 69.89 Favored 'General case' 0 N--CA 1.467 0.41 0 C-N-CA 124.965 1.306 . . . . 0.0 113.372 -175.903 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 11.5 mm-40 -82.93 -38.87 22.2 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 123.18 0.592 . . . . 0.0 110.138 177.839 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 81.1 t80 -61.65 -31.98 72.12 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 124.669 1.188 . . . . 0.0 111.042 174.772 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 12.6 mm100 -61.56 -16.86 51.81 Favored 'General case' 0 CA--C 1.545 0.771 0 N-CA-C 113.429 0.9 . . . . 0.0 113.429 175.698 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 5.6 mpt_? -121.69 14.04 10.88 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 126.338 1.855 . . . . 0.0 111.727 177.737 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 58.61 36.1 83.9 Favored Glycine 0 CA--C 1.535 1.289 0 C-N-CA 125.16 1.362 . . . . 0.0 114.183 -179.984 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 6.9 t -128.63 16.73 6.42 Favored 'General case' 0 N--CA 1.477 0.896 0 N-CA-C 114.489 1.292 . . . . 0.0 114.489 -176.005 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 9.1 t -67.31 173.98 3.58 Favored 'General case' 0 CA--C 1.558 1.264 0 O-C-N 121.633 -0.667 . . . . 0.0 110.858 173.985 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 90.7 p -136.24 9.43 3.22 Favored 'General case' 0 N--CA 1.477 0.902 0 N-CA-C 115.359 1.614 . . . . 0.0 115.359 -176.241 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 65.6 mtm-85 -132.69 153.61 81.16 Favored Pre-proline 0 N--CA 1.475 0.793 0 C-N-CA 125.941 1.696 . . . . 0.0 112.13 -178.449 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_endo -73.51 161.81 41.45 Favored 'Trans proline' 0 CA--C 1.541 0.827 0 C-N-CA 122.0 1.8 . . . . 0.0 109.109 173.109 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 -53.9 -28.44 36.55 Favored 'General case' 0 N--CA 1.473 0.709 0 N-CA-C 113.241 0.83 . . . . 0.0 113.241 177.69 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 27.2 p -72.1 -20.16 61.69 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 125.933 1.693 . . . . 0.0 115.069 178.887 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -114.84 -30.7 6.35 Favored 'General case' 0 N--CA 1.477 0.892 0 N-CA-C 114.295 1.221 . . . . 0.0 114.295 -178.014 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . 0.406 ' HB3' ' CE1' ' A' ' 38' ' ' HIS . 3.1 t -59.04 158.1 9.11 Favored 'General case' 0 CA--C 1.549 0.905 0 N-CA-C 114.675 1.361 . . . . 0.0 114.675 -175.654 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 36.7 mmtm -86.89 -0.31 56.28 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 126.773 2.029 . . . . 0.0 115.102 -173.095 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 75.3 m-85 -144.29 168.41 20.15 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 127.015 2.126 . . . . 0.0 109.388 175.692 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -73.7 150.69 41.06 Favored 'General case' 0 CA--C 1.548 0.871 0 O-C-N 120.414 -1.428 . . . . 0.0 113.842 -177.052 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . 0.406 ' CE1' ' HB2' ' A' ' 19' ' ' CYS . 7.1 m80 -127.33 84.16 64.15 Favored Pre-proline 0 CA--C 1.55 0.945 0 C-N-CA 125.451 1.5 . . . . 0.0 110.782 -177.415 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 35.2 Cg_endo -63.87 150.44 88.41 Favored 'Trans proline' 0 C--N 1.353 0.779 0 C-N-CA 123.636 2.891 . . . . 0.0 115.146 -177.078 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 54.1 p -89.35 -176.25 5.01 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 125.109 1.363 . . . . 0.0 111.695 174.536 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 60.9 mtpt -59.6 -21.9 61.05 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 125.516 1.526 . . . . 0.0 113.605 174.274 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 40.0 m -109.14 -16.13 14.16 Favored 'General case' 0 N--CA 1.477 0.923 0 N-CA-C 114.716 1.376 . . . . 0.0 114.716 -179.346 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 92.3 m -64.88 136.28 56.68 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-N 119.465 1.03 . . . . 0.0 112.218 179.462 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 42.0 tt0 -81.53 126.3 31.52 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 124.669 1.188 . . . . 0.0 110.502 179.165 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 18.7 t -119.75 134.65 62.59 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.941 0 C-N-CA 125.927 1.691 . . . . 0.0 109.688 -178.37 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -144.06 130.17 19.61 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 125.128 1.371 . . . . 0.0 111.331 -179.057 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 61.9 t30 42.75 37.01 0.93 Allowed 'General case' 0 CA--C 1.553 1.082 0 C-N-CA 126.989 2.115 . . . . 0.0 116.526 177.885 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 88.1 14.35 62.62 Favored Glycine 0 CA--C 1.536 1.35 0 O-C-N 121.103 -0.998 . . . . 0.0 114.929 179.653 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 31.1 mtt180 -138.52 167.56 21.67 Favored 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 126.101 1.76 . . . . 0.0 111.95 -179.57 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 4.4 m -140.03 146.56 24.71 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.571 0 C-N-CA 127.119 2.167 . . . . 0.0 108.911 -179.892 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 26.1 mt -95.72 127.98 47.3 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.814 0 O-C-N 121.108 -0.995 . . . . 0.0 109.611 -179.071 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -73.27 151.66 41.28 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 123.462 0.705 . . . . 0.0 111.683 177.44 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 13.2 t -73.46 98.87 2.85 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 124.421 1.089 . . . . 0.0 113.064 -176.881 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 30.0 p90 -61.66 -38.22 86.95 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 123.942 0.897 . . . . 0.0 110.139 174.843 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 66.1 m-20 -61.08 -42.38 98.39 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 123.011 0.524 . . . . 0.0 110.509 176.978 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 47.6 t -64.4 -42.37 96.14 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-N 119.519 1.054 . . . . 0.0 111.441 177.425 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 31.0 mt -63.73 -40.38 96.59 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 123.763 0.825 . . . . 0.0 112.921 176.399 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 31.4 mmmt -81.35 -9.46 59.74 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 124.763 1.225 . . . . 0.0 114.017 179.486 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 79.41 37.16 24.86 Favored Glycine 0 CA--C 1.536 1.4 0 C-N-CA 124.477 1.037 . . . . 0.0 113.525 -179.644 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 72.8 ttt-85 -117.19 -24.02 7.66 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 127.163 2.185 . . . . 0.0 113.966 -176.826 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 5.8 t -67.4 139.96 57.16 Favored 'General case' 0 CA--C 1.544 0.716 0 CA-C-O 121.768 0.794 . . . . 0.0 112.734 -177.92 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 7.3 t -152.73 14.94 0.56 Allowed 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 126.407 1.883 . . . . 0.0 111.938 179.149 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 74.4 mtm-85 -73.4 162.59 29.14 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 125.903 1.681 . . . . 0.0 113.007 -178.865 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -120.53 1.15 10.61 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 125.513 1.525 . . . . 0.0 112.515 177.048 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 68.3 m-80 -143.32 29.14 1.45 Allowed 'General case' 0 CA--C 1.552 1.022 0 C-N-CA 127.613 2.365 . . . . 0.0 110.772 -179.504 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 7.4 t -52.11 125.6 16.14 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 126.087 1.755 . . . . 0.0 111.876 -177.542 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 30.4 mtmt -85.25 1.28 48.92 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 124.578 1.151 . . . . 0.0 113.308 -178.558 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 87.3 m-85 -115.13 147.65 39.98 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 124.191 0.997 . . . . 0.0 111.469 -175.402 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -73.42 112.79 9.82 Favored 'General case' 0 N--CA 1.465 0.287 0 C-N-CA 123.473 0.709 . . . . 0.0 111.9 -176.18 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 12.1 m170 -68.71 114.02 19.74 Favored Pre-proline 0 CA--C 1.547 0.831 0 N-CA-C 107.487 -1.301 . . . . 0.0 107.487 174.285 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 67.7 Cg_exo -47.93 112.56 0.59 Allowed 'Trans proline' 0 CA--C 1.543 0.943 0 C-N-CA 124.842 3.694 . . . . 0.0 117.153 -173.691 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -76.69 153.55 34.03 Favored 'Trans proline' 0 CA--C 1.547 1.149 0 C-N-CA 122.068 1.845 . . . . 0.0 111.734 176.215 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 81.4 Cg_exo -42.27 -49.52 6.02 Favored 'Trans proline' 0 CA--C 1.539 0.73 0 C-N-CA 125.046 3.831 . . . . 0.0 116.823 -179.059 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 1.7 t60 -66.8 -29.94 70.01 Favored 'General case' 0 N--CA 1.478 0.954 0 N-CA-C 113.585 0.957 . . . . 0.0 113.585 -179.393 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 85.5 mt -93.64 -21.35 19.44 Favored 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 114.026 1.121 . . . . 0.0 114.026 -178.058 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 54.1 mtpt -53.5 -38.87 64.12 Favored 'General case' 0 N--CA 1.48 1.037 0 CA-C-N 120.204 1.366 . . . . 0.0 111.611 175.397 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 29.7 m -62.73 -43.98 97.4 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 124.937 1.295 . . . . 0.0 111.561 175.855 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 94.5 mm-40 -66.21 -43.04 87.86 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 123.622 0.769 . . . . 0.0 110.933 178.33 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 88.1 mt -62.02 -50.44 72.02 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 123.876 0.87 . . . . 0.0 111.554 177.632 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -62.61 -28.85 70.18 Favored 'General case' 0 N--CA 1.476 0.843 0 CA-C-N 120.025 1.284 . . . . 0.0 113.489 178.919 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 61.2 mt -70.23 -43.59 78.53 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.727 0 C-N-CA 123.723 0.809 . . . . 0.0 109.743 174.892 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 24.8 m-80 -66.2 -35.97 81.84 Favored 'General case' 0 CA--C 1.542 0.647 0 O-C-N 121.352 -0.842 . . . . 0.0 110.958 175.453 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -59.68 -46.13 94.53 Favored Glycine 0 CA--C 1.532 1.109 0 C-N-CA 124.487 1.041 . . . . 0.0 112.158 177.247 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 80.2 mtt85 -61.2 -18.2 57.01 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 124.25 1.02 . . . . 0.0 113.53 174.576 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 51.9 m-80 -104.72 11.18 34.28 Favored 'General case' 0 CA--C 1.551 0.991 0 C-N-CA 126.136 1.774 . . . . 0.0 112.428 178.32 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 21.9 t30 -127.77 -48.54 1.38 Allowed 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 125.817 1.647 . . . . 0.0 112.511 -179.58 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 94.6 mt -61.58 -16.38 47.49 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 124.308 1.043 . . . . 0.0 113.551 179.673 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 36.2 pt -83.73 -15.87 11.2 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.76 0 C-N-CA 127.514 2.326 . . . . 0.0 114.627 177.712 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 43.2 tt0 -68.25 109.09 3.43 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 124.046 0.938 . . . . 0.0 113.124 -175.114 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 4.2 tm0? -68.73 -32.04 71.53 Favored 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 123.845 0.858 . . . . 0.0 113.177 -178.848 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -141.21 123.9 16.05 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 126.161 1.784 . . . . 0.0 110.302 178.411 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 59.1 t30 . . . . . 0 CA--C 1.544 0.735 0 C-N-CA 124.216 1.006 . . . . 0.0 112.567 -179.227 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.3 mpt? . . . . . 0 CA--C 1.546 0.813 0 N-CA-C 113.194 0.812 . . . . 0.0 113.194 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -149.97 166.38 29.82 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 125.99 1.716 . . . . 0.0 112.08 179.606 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 6.5 m -141.0 148.45 21.56 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.98 0 C-N-CA 126.03 1.732 . . . . 0.0 111.437 179.813 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 20.1 m -69.0 -24.17 64.19 Favored 'General case' 0 N--CA 1.478 0.94 0 N-CA-C 114.758 1.392 . . . . 0.0 114.758 -178.189 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 25.4 m -143.79 162.82 15.67 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.965 0 C-N-CA 126.55 1.94 . . . . 0.0 110.64 179.796 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 23.5 p -60.87 139.84 93.63 Favored Pre-proline 0 N--CA 1.476 0.869 0 C-N-CA 123.44 0.696 . . . . 0.0 112.186 179.209 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 69.0 Cg_endo -77.63 -4.92 15.06 Favored 'Trans proline' 0 CA--C 1.543 0.937 0 C-N-CA 123.843 3.028 . . . . 0.0 115.129 -178.163 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 17.8 pt -62.06 156.67 3.97 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.673 0 C-N-CA 125.676 1.59 . . . . 0.0 113.462 -178.293 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 66.2 ttt180 -144.4 -36.66 0.32 Allowed 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 124.411 1.085 . . . . 0.0 113.397 176.172 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 13.2 m-20 -61.67 -25.39 67.36 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 124.597 1.159 . . . . 0.0 113.536 178.025 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 25.7 p -126.15 1.35 7.17 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 125.829 1.652 . . . . 0.0 113.731 179.914 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 16.1 tppt? -53.82 -45.28 70.76 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 124.378 1.071 . . . . 0.0 111.78 177.656 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -73.07 -23.67 60.58 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 124.606 1.163 . . . . 0.0 113.473 178.628 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 95.0 mt -91.67 -14.92 29.28 Favored 'General case' 0 N--CA 1.467 0.376 0 C-N-CA 126.064 1.746 . . . . 0.0 114.429 -177.802 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 12.8 m -75.83 78.93 2.75 Favored 'General case' 0 N--CA 1.475 0.791 0 CA-C-N 119.508 1.049 . . . . 0.0 110.785 -179.208 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 10.6 tp -75.52 141.42 43.03 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 128.021 2.528 . . . . 0.0 111.985 -176.352 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 53.0 mt-10 -71.77 151.32 43.62 Favored 'General case' 0 N--CA 1.472 0.642 0 O-C-N 120.933 -1.104 . . . . 0.0 112.452 178.623 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 16.9 m -86.71 156.54 3.29 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.904 0 C-N-CA 123.107 0.563 . . . . 0.0 111.201 174.487 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 42.2 t -75.89 132.09 40.09 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-O 121.725 0.774 . . . . 0.0 110.677 176.685 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 3.8 mpt_? -66.62 -28.17 68.28 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 124.641 1.176 . . . . 0.0 113.167 -177.79 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -84.47 -36.13 22.49 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 118.36 0.527 . . . . 0.0 110.415 178.62 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 59.1 t80 -62.69 -31.28 72.14 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 123.686 0.794 . . . . 0.0 110.835 173.565 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 12.2 mm100 -62.48 -17.93 60.7 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 124.028 0.931 . . . . 0.0 113.334 175.387 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 1.7 mpp_? -118.16 13.12 13.73 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 126.417 1.887 . . . . 0.0 111.673 176.159 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 58.76 36.04 84.78 Favored Glycine 0 CA--C 1.533 1.218 0 C-N-CA 125.12 1.343 . . . . 0.0 113.894 -179.572 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 6.4 t -130.08 15.27 5.71 Favored 'General case' 0 N--CA 1.477 0.91 0 N-CA-C 114.827 1.418 . . . . 0.0 114.827 -175.333 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 8.8 t -67.99 169.8 9.39 Favored 'General case' 0 CA--C 1.557 1.212 0 CA-C-N 118.865 0.757 . . . . 0.0 110.454 173.435 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 50.5 m -132.23 13.58 4.65 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 125.302 1.441 . . . . 0.0 114.394 -176.09 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 75.5 mtm-85 -135.8 144.87 50.53 Favored Pre-proline 0 N--CA 1.472 0.63 0 C-N-CA 125.493 1.517 . . . . 0.0 112.337 -177.184 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_endo -69.37 165.72 29.55 Favored 'Trans proline' 0 CA--C 1.544 0.986 0 C-N-CA 121.955 1.77 . . . . 0.0 109.697 171.472 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -54.27 -31.31 53.43 Favored 'General case' 0 N--CA 1.478 0.939 0 O-C-N 121.196 -0.94 . . . . 0.0 112.468 177.554 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 24.6 p -70.15 -10.9 60.25 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 126.496 1.918 . . . . 0.0 115.141 177.47 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 44.6 mm-40 -122.83 -29.91 3.91 Favored 'General case' 0 N--CA 1.476 0.841 0 N-CA-C 115.184 1.55 . . . . 0.0 115.184 -177.003 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 3.4 t -66.99 164.75 17.02 Favored 'General case' 0 CA--C 1.546 0.81 0 N-CA-C 115.123 1.527 . . . . 0.0 115.123 -175.364 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -80.96 -12.31 59.41 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 126.777 2.031 . . . . 0.0 113.433 -179.632 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 60.5 m-85 -139.81 176.55 8.65 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 126.556 1.943 . . . . 0.0 110.173 179.408 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -84.58 148.49 26.44 Favored 'General case' 0 CA--C 1.547 0.845 0 O-C-N 121.134 -0.979 . . . . 0.0 113.361 -177.214 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 66.8 m170 -119.64 87.98 38.2 Favored Pre-proline 0 CA--C 1.55 0.958 0 C-N-CA 125.847 1.659 . . . . 0.0 111.177 179.385 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_endo -62.92 144.41 93.19 Favored 'Trans proline' 0 CA--C 1.539 0.759 0 C-N-CA 123.458 2.772 . . . . 0.0 114.45 -178.323 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 45.1 p -81.78 -175.09 5.39 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 124.438 1.095 . . . . 0.0 111.941 175.233 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 61.2 mtpt -60.12 -21.3 61.38 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 125.359 1.464 . . . . 0.0 113.152 173.198 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 46.1 m -109.27 -21.03 12.74 Favored 'General case' 0 N--CA 1.478 0.951 0 N-CA-C 114.548 1.314 . . . . 0.0 114.548 -179.958 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 81.9 m -61.59 135.6 57.7 Favored 'General case' 0 CA--C 1.544 0.718 0 CA-C-N 119.653 1.115 . . . . 0.0 112.352 179.39 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 38.4 tt0 -79.2 129.46 34.48 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.695 1.198 . . . . 0.0 111.091 179.993 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 13.7 t -122.87 133.45 68.94 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.037 0 C-N-CA 125.692 1.597 . . . . 0.0 110.025 -178.268 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 50.7 mt-10 -145.16 129.05 17.38 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 125.156 1.382 . . . . 0.0 111.813 -178.594 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 61.7 t30 39.66 38.82 0.46 Allowed 'General case' 0 CA--C 1.553 1.08 0 C-N-CA 127.572 2.349 . . . . 0.0 117.273 176.735 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 93.79 9.64 59.63 Favored Glycine 0 CA--C 1.535 1.3 0 O-C-N 120.955 -1.091 . . . . 0.0 115.168 178.961 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 31.7 mtt180 -137.69 170.91 15.24 Favored 'General case' 0 N--CA 1.466 0.331 0 C-N-CA 125.682 1.593 . . . . 0.0 111.827 179.591 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 5.3 m -135.85 171.95 16.38 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.675 0 C-N-CA 128.876 2.87 . . . . 0.0 107.324 177.593 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 38.7 mt -122.29 129.04 75.62 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.941 0 CA-C-N 120.209 1.368 . . . . 0.0 109.099 -179.927 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -73.72 146.08 44.67 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 124.176 0.99 . . . . 0.0 111.636 178.458 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 15.5 t -70.3 100.47 1.72 Allowed 'General case' 0 C--O 1.24 0.584 0 C-N-CA 124.972 1.309 . . . . 0.0 113.133 -176.918 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 31.3 p90 -61.51 -38.57 87.85 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 115.281 -0.872 . . . . 0.0 110.207 175.021 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 73.7 m-20 -61.38 -42.11 98.18 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 123.116 0.566 . . . . 0.0 110.855 177.433 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 48.4 t -64.31 -42.22 96.45 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 119.452 1.024 . . . . 0.0 111.472 177.538 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 29.9 mt -64.94 -40.89 95.71 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 123.636 0.774 . . . . 0.0 112.862 176.397 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 31.4 mmmt -79.51 -10.44 59.8 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 124.703 1.201 . . . . 0.0 113.872 179.087 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 80.25 37.52 21.08 Favored Glycine 0 CA--C 1.537 1.409 0 C-N-CA 124.642 1.115 . . . . 0.0 113.712 -179.932 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 50.5 ttp180 -120.24 -19.82 7.55 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 126.822 2.049 . . . . 0.0 114.507 -176.614 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 6.2 t -68.08 139.36 56.22 Favored 'General case' 0 CA--C 1.545 0.774 0 CA-C-N 119.247 0.93 . . . . 0.0 112.603 -178.376 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 87.6 p -150.68 9.31 0.6 Allowed 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 126.601 1.96 . . . . 0.0 112.944 -179.958 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 80.3 mtm-85 -68.13 163.45 22.54 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 126.339 1.856 . . . . 0.0 113.797 -178.66 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -119.46 -2.28 10.58 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 126.362 1.865 . . . . 0.0 112.831 176.981 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 36.2 m-20 -144.46 31.56 1.2 Allowed 'General case' 0 CA--C 1.552 1.036 0 C-N-CA 127.659 2.384 . . . . 0.0 110.88 -178.329 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 8.1 t -51.74 125.53 15.24 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 126.104 1.762 . . . . 0.0 111.866 -178.346 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 27.4 mtmt -84.12 2.09 41.1 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 124.607 1.163 . . . . 0.0 113.374 -178.588 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 80.6 m-85 -117.65 149.19 41.12 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 124.334 1.053 . . . . 0.0 111.591 -174.763 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -76.09 117.75 18.12 Favored 'General case' 0 N--CA 1.464 0.253 0 C-N-CA 123.516 0.727 . . . . 0.0 111.293 -176.49 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 15.3 m170 -72.25 114.32 28.48 Favored Pre-proline 0 CA--C 1.549 0.907 0 N-CA-C 107.46 -1.311 . . . . 0.0 107.46 174.602 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 63.6 Cg_exo -47.27 115.9 1.55 Allowed 'Trans proline' 0 CA--C 1.543 0.96 0 C-N-CA 124.855 3.703 . . . . 0.0 116.522 -174.433 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -76.3 149.36 31.47 Favored 'Trans proline' 0 CA--C 1.542 0.887 0 C-N-CA 121.906 1.737 . . . . 0.0 110.472 175.955 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 84.6 Cg_exo -47.05 -39.32 25.41 Favored 'Trans proline' 0 CA--C 1.537 0.671 0 C-N-CA 123.868 3.045 . . . . 0.0 115.192 179.547 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 12.6 t-80 -69.8 -17.76 63.42 Favored 'General case' 0 N--CA 1.473 0.698 0 N-CA-C 114.99 1.478 . . . . 0.0 114.99 179.473 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 84.3 mt -114.19 -16.87 12.0 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 124.64 1.176 . . . . 0.0 112.848 178.742 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 54.2 mtpt -54.65 -36.2 64.3 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-N 119.725 1.148 . . . . 0.0 111.449 174.103 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 25.1 m -63.21 -43.73 97.31 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 123.635 0.774 . . . . 0.0 111.455 176.168 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 16.4 mm100 -67.5 -44.84 77.5 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 123.664 0.786 . . . . 0.0 110.75 178.129 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 81.7 mt -61.74 -48.69 79.57 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 124.2 1.0 . . . . 0.0 112.233 177.921 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -63.85 -35.67 81.39 Favored 'General case' 0 N--CA 1.474 0.741 0 CA-C-N 119.886 1.221 . . . . 0.0 112.733 179.725 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 60.2 mt -64.23 -45.49 96.09 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.763 0 CA-C-N 118.802 0.728 . . . . 0.0 110.062 176.203 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 32.2 m-80 -65.85 -37.88 87.35 Favored 'General case' 0 CA--C 1.542 0.672 0 O-C-N 121.696 -0.627 . . . . 0.0 111.354 175.956 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -63.08 -48.79 77.12 Favored Glycine 0 CA--C 1.528 0.846 0 C-N-CA 124.502 1.048 . . . . 0.0 111.981 177.653 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 71.8 mtp85 -57.73 -39.38 77.17 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 124.53 1.132 . . . . 0.0 112.024 176.231 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 49.6 t30 -67.34 -31.14 71.2 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 123.776 0.83 . . . . 0.0 112.641 176.694 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 56.7 t30 -86.48 -30.65 21.83 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 125.085 1.354 . . . . 0.0 113.536 179.791 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 37.4 tp -54.55 -13.53 1.0 Allowed 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 127.71 2.404 . . . . 0.0 115.414 -179.014 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 21.0 pt -64.68 10.76 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.548 0.9 0 C-N-CA 127.205 2.202 . . . . 0.0 115.355 177.856 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -49.97 -27.61 5.64 Favored 'General case' 0 N--CA 1.477 0.892 0 N-CA-C 116.356 1.984 . . . . 0.0 116.356 -177.413 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -80.82 -4.5 54.89 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 124.922 1.289 . . . . 0.0 114.044 177.046 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 39.5 ttpt -129.6 -30.95 2.05 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 126.426 1.891 . . . . 0.0 113.499 -178.065 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 54.0 t-20 . . . . . 0 C--O 1.243 0.74 0 C-N-CA 125.436 1.495 . . . . 0.0 111.486 179.574 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.5 mmt . . . . . 0 CA--C 1.542 0.641 0 N-CA-C 113.141 0.793 . . . . 0.0 113.141 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -49.49 -25.93 3.02 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 126.539 1.936 . . . . 0.0 114.839 -179.451 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 26.7 m -66.0 -16.11 20.06 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.754 0 C-N-CA 125.548 1.539 . . . . 0.0 114.452 177.521 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 89.2 p -139.75 -18.69 0.94 Allowed 'General case' 0 N--CA 1.478 0.935 0 N-CA-C 116.722 2.119 . . . . 0.0 116.722 -177.467 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 34.1 m -74.99 41.73 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.542 0 CA-C-N 120.553 1.524 . . . . 0.0 114.439 179.651 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 60.9 p -57.57 151.28 41.12 Favored Pre-proline 0 N--CA 1.479 1.004 0 C-N-CA 124.97 1.308 . . . . 0.0 112.832 179.886 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 85.6 Cg_exo -49.06 133.8 29.14 Favored 'Trans proline' 0 C--N 1.353 0.815 0 C-N-CA 124.229 3.286 . . . . 0.0 115.08 -178.563 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 9.8 tp -58.03 132.39 22.65 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.637 0 C-N-CA 123.952 0.901 . . . . 0.0 111.513 179.068 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 34.8 ptt-85 -161.6 161.82 29.83 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 126.868 2.067 . . . . 0.0 110.855 -176.192 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 8.7 p-10 -63.38 -27.21 69.15 Favored 'General case' 0 CA--C 1.544 0.735 0 N-CA-C 113.53 0.937 . . . . 0.0 113.53 177.545 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 25.5 p -87.1 2.27 50.29 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 125.314 1.445 . . . . 0.0 114.112 178.079 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 3.3 tmpt? -54.45 -39.93 67.88 Favored 'General case' 0 N--CA 1.479 0.992 0 O-C-N 120.734 -1.229 . . . . 0.0 112.866 -178.601 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -75.29 -24.7 57.55 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 123.868 0.867 . . . . 0.0 113.051 177.683 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 86.8 mt -89.37 -14.65 35.12 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 126.127 1.771 . . . . 0.0 114.375 -178.227 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 6.8 m -78.03 75.86 4.56 Favored 'General case' 0 N--CA 1.477 0.907 0 CA-C-N 119.289 0.95 . . . . 0.0 111.008 -178.958 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 12.0 tp -75.66 145.88 40.67 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 127.531 2.332 . . . . 0.0 112.374 -178.227 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 15.9 mt-10 -75.24 150.9 38.48 Favored 'General case' 0 N--CA 1.472 0.638 0 O-C-N 120.602 -1.311 . . . . 0.0 112.752 179.29 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 13.0 m -83.52 155.56 3.75 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 C-N-CA 122.787 0.435 . . . . 0.0 111.596 176.29 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 42.6 t -72.89 129.5 38.28 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-O 122.063 0.935 . . . . 0.0 110.608 176.046 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 3.9 mpt_? -67.82 -27.82 67.05 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 124.925 1.29 . . . . 0.0 113.211 -177.542 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 15.8 mm-40 -84.13 -36.38 22.97 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 123.297 0.639 . . . . 0.0 110.11 178.423 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 72.7 t80 -63.27 -30.93 71.98 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 124.214 1.005 . . . . 0.0 110.917 174.19 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 12.6 mm100 -62.17 -16.03 50.16 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 123.886 0.874 . . . . 0.0 113.045 174.899 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 6.5 mpt_? -119.4 12.84 12.56 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 126.72 2.008 . . . . 0.0 111.622 176.684 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 58.22 36.12 81.18 Favored Glycine 0 CA--C 1.534 1.249 0 C-N-CA 125.479 1.514 . . . . 0.0 114.565 179.742 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 6.4 t -132.07 12.25 4.69 Favored 'General case' 0 N--CA 1.478 0.962 0 N-CA-C 115.202 1.556 . . . . 0.0 115.202 -175.384 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 31.0 t -61.03 131.84 51.91 Favored 'General case' 0 CA--C 1.548 0.897 0 O-C-N 121.175 -0.953 . . . . 0.0 110.783 176.53 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 75.4 p -83.18 6.67 18.52 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 125.94 1.696 . . . . 0.0 114.645 -178.04 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 75.3 mtm-85 -127.38 152.87 76.97 Favored Pre-proline 0 N--CA 1.473 0.685 0 C-N-CA 125.851 1.661 . . . . 0.0 113.476 -175.69 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo -72.66 160.61 46.03 Favored 'Trans proline' 0 CA--C 1.54 0.79 0 C-N-CA 122.098 1.865 . . . . 0.0 109.053 172.461 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 16.7 m-20 -55.3 -22.12 17.46 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 124.759 1.223 . . . . 0.0 113.822 -178.71 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 14.9 p -83.55 -22.08 32.48 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 127.306 2.242 . . . . 0.0 115.5 179.296 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -101.51 -31.9 10.65 Favored 'General case' 0 N--CA 1.477 0.883 0 CA-C-N 119.742 1.155 . . . . 0.0 113.839 -177.519 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 4.3 t -56.67 150.31 16.07 Favored 'General case' 0 CA--C 1.545 0.763 0 N-CA-C 115.007 1.484 . . . . 0.0 115.007 -174.105 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 13.4 mptt -81.9 -2.24 50.58 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 127.046 2.139 . . . . 0.0 113.134 -177.241 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 63.8 m-85 -138.79 169.8 17.14 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 127.461 2.304 . . . . 0.0 109.587 174.622 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -80.37 149.06 30.36 Favored 'General case' 0 CA--C 1.547 0.857 0 N-CA-C 114.382 1.253 . . . . 0.0 114.382 -175.948 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 21.2 m170 -121.07 86.78 42.88 Favored Pre-proline 0 CA--C 1.556 1.178 0 C-N-CA 125.99 1.716 . . . . 0.0 111.173 -179.179 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 35.2 Cg_endo -65.25 150.01 87.93 Favored 'Trans proline' 0 CA--C 1.539 0.771 0 C-N-CA 123.279 2.653 . . . . 0.0 114.671 -178.8 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 46.1 p -88.4 -175.34 4.96 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 124.476 1.11 . . . . 0.0 111.536 174.19 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 62.8 mttp -61.21 -18.53 58.72 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 125.379 1.471 . . . . 0.0 113.388 173.221 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 47.8 m -109.19 -20.99 12.78 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 125.078 1.351 . . . . 0.0 114.645 -178.783 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 71.6 m -63.58 137.55 58.16 Favored 'General case' 0 CA--C 1.543 0.701 0 CA-C-N 119.304 0.956 . . . . 0.0 113.32 -179.883 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 4.3 tm0? -82.88 134.28 35.09 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 124.774 1.23 . . . . 0.0 111.257 178.817 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -139.07 145.06 28.11 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.677 0 C-N-CA 125.251 1.42 . . . . 0.0 112.259 179.775 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -147.27 140.6 25.36 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 126.019 1.727 . . . . 0.0 110.911 176.802 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 61.1 t30 41.4 38.13 0.78 Allowed 'General case' 0 CA--C 1.553 1.073 0 C-N-CA 126.585 1.954 . . . . 0.0 116.166 177.53 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 84.53 16.65 65.76 Favored Glycine 0 CA--C 1.537 1.424 0 O-C-N 121.091 -1.006 . . . . 0.0 115.358 -179.938 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 55.5 mtt85 -136.92 160.87 37.6 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 124.913 1.285 . . . . 0.0 112.043 -179.945 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 5.8 m -135.89 150.1 28.24 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.698 0 C-N-CA 128.034 2.533 . . . . 0.0 109.847 -177.512 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 40.4 mt -98.84 127.63 51.25 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.75 0 O-C-N 121.28 -0.887 . . . . 0.0 109.992 -179.055 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -73.44 147.43 44.2 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 124.268 1.027 . . . . 0.0 111.716 177.6 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 17.9 t -69.26 100.08 1.26 Allowed 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 124.93 1.292 . . . . 0.0 112.784 -177.392 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 30.2 p90 -61.57 -38.47 87.63 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 115.23 -0.895 . . . . 0.0 110.163 175.183 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 71.1 m-20 -61.47 -42.69 99.17 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 123.127 0.571 . . . . 0.0 110.761 177.29 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 47.6 t -64.11 -42.32 96.93 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-N 119.491 1.041 . . . . 0.0 111.574 177.669 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 28.6 mt -65.46 -40.57 93.35 Favored 'General case' 0 CA--C 1.543 0.674 0 O-C-N 121.436 -0.79 . . . . 0.0 112.881 176.625 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 31.3 mmmt -79.84 -11.31 59.83 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 124.679 1.191 . . . . 0.0 113.928 179.167 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 82.17 37.79 14.53 Favored Glycine 0 CA--C 1.537 1.409 0 C-N-CA 124.577 1.085 . . . . 0.0 113.959 179.76 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 50.5 ttp180 -121.23 -18.29 7.44 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 126.652 1.981 . . . . 0.0 114.518 -176.646 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 6.0 t -71.67 133.69 45.83 Favored 'General case' 0 CA--C 1.545 0.765 0 CA-C-N 119.298 0.954 . . . . 0.0 112.747 -178.331 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 59.8 m -142.93 12.84 1.86 Allowed 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 126.85 2.06 . . . . 0.0 112.022 178.874 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 82.5 mtm-85 -70.6 163.52 26.8 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 125.791 1.636 . . . . 0.0 113.74 -178.323 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -119.77 -3.19 10.29 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 126.515 1.926 . . . . 0.0 112.968 177.268 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 43.9 m-20 -145.13 34.7 1.09 Allowed 'General case' 0 CA--C 1.551 1.017 0 C-N-CA 127.745 2.418 . . . . 0.0 110.308 -178.348 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 8.4 t -51.17 127.63 19.77 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 125.688 1.595 . . . . 0.0 112.28 -177.341 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 36.1 mtmt -85.02 5.63 28.6 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 125.324 1.45 . . . . 0.0 113.612 -177.281 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 84.4 m-85 -126.57 155.34 42.6 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 124.87 1.268 . . . . 0.0 112.061 -175.532 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -76.99 114.94 16.34 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 123.679 0.792 . . . . 0.0 112.267 -176.598 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 10.7 m170 -71.5 113.62 21.2 Favored Pre-proline 0 CA--C 1.546 0.807 0 N-CA-C 107.605 -1.257 . . . . 0.0 107.605 173.539 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 89.3 Cg_exo -50.1 111.36 0.51 Allowed 'Trans proline' 0 CA--C 1.542 0.901 0 C-N-CA 124.801 3.667 . . . . 0.0 117.226 -173.871 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 97.1 Cg_endo -76.34 152.97 35.2 Favored 'Trans proline' 0 CA--C 1.547 1.15 0 C-N-CA 122.109 1.873 . . . . 0.0 111.109 175.254 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 91.6 Cg_exo -43.95 -44.92 11.87 Favored 'Trans proline' 0 CA--C 1.538 0.717 0 C-N-CA 124.755 3.637 . . . . 0.0 116.308 -179.51 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 25.6 m170 -74.76 -5.82 45.45 Favored 'General case' 0 N--CA 1.478 0.95 0 N-CA-C 115.111 1.523 . . . . 0.0 115.111 -179.523 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 95.5 mt -116.16 -21.24 9.49 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 124.852 1.261 . . . . 0.0 113.122 177.198 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 57.4 mtpt -54.09 -35.46 62.13 Favored 'General case' 0 N--CA 1.477 0.922 0 CA-C-N 119.752 1.16 . . . . 0.0 111.439 175.304 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 23.0 m -63.62 -46.82 83.98 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 124.798 1.239 . . . . 0.0 111.416 174.902 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 75.1 mt-30 -62.51 -44.98 95.03 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.64 0.776 . . . . 0.0 110.884 177.708 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 82.2 mt -61.77 -50.18 73.41 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 124.205 1.002 . . . . 0.0 111.861 177.998 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 7.5 pt-20 -63.6 -35.16 79.59 Favored 'General case' 0 N--CA 1.474 0.726 0 CA-C-N 119.838 1.199 . . . . 0.0 112.895 179.279 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 60.4 mt -60.62 -41.21 87.18 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.795 0 CA-C-N 119.269 0.941 . . . . 0.0 110.063 176.369 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 12.7 t-20 -69.67 -45.0 69.36 Favored 'General case' 0 CA--C 1.545 0.783 0 O-C-N 121.827 -0.545 . . . . 0.0 110.595 175.316 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -56.65 -40.13 87.44 Favored Glycine 0 CA--C 1.534 1.273 0 C-N-CA 125.171 1.367 . . . . 0.0 113.357 177.726 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 86.4 mtt-85 -62.38 -29.49 70.51 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 125.432 1.493 . . . . 0.0 112.52 176.241 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 62.7 t30 -84.45 -36.93 21.99 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 124.006 0.922 . . . . 0.0 110.637 174.765 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -77.49 7.08 5.9 Favored 'General case' 0 CA--C 1.555 1.139 0 C-N-CA 126.405 1.882 . . . . 0.0 113.104 176.781 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 13.6 tp -62.51 -5.64 2.74 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 126.964 2.106 . . . . 0.0 115.04 -177.149 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 49.9 pt -56.1 -11.68 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.479 1.002 0 C-N-CA 126.655 1.982 . . . . 0.0 115.234 177.821 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 20.1 pt20 -114.83 10.96 16.58 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 126.211 1.804 . . . . 0.0 113.762 179.664 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 25.2 tm0? -60.3 -24.31 64.86 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 125.061 1.344 . . . . 0.0 114.16 -179.699 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 19.5 ptpt -143.1 166.16 25.41 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 125.976 1.71 . . . . 0.0 112.275 178.907 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 45.3 t30 . . . . . 0 CA--C 1.542 0.668 0 C-N-CA 125.409 1.484 . . . . 0.0 111.435 -179.733 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.3 mmt . . . . . 0 CA--C 1.545 0.754 0 N-CA-C 113.48 0.919 . . . . 0.0 113.48 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -64.67 157.61 26.76 Favored 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 124.93 1.292 . . . . 0.0 113.162 179.057 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 30.6 m -67.25 -18.21 23.74 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.175 0 N-CA-C 114.502 1.297 . . . . 0.0 114.502 179.685 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 8.1 t -156.05 172.32 18.61 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 125.854 1.662 . . . . 0.0 111.163 178.899 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 27.8 m -64.41 153.94 7.31 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.876 0 C-N-CA 124.867 1.267 . . . . 0.0 112.861 179.051 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 20.1 p -72.65 154.61 91.37 Favored Pre-proline 0 N--CA 1.475 0.786 0 C-N-CA 124.509 1.124 . . . . 0.0 112.451 178.335 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 82.6 Cg_endo -71.88 162.8 40.86 Favored 'Trans proline' 0 C--N 1.351 0.707 0 C-N-CA 123.217 2.612 . . . . 0.0 113.069 -178.992 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 12.4 tt -66.42 22.09 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.484 1.269 0 C-N-CA 127.178 2.191 . . . . 0.0 115.048 179.001 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 1.4 mpt_? -126.39 -8.68 6.35 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 127.637 2.375 . . . . 0.0 112.059 176.845 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -70.87 -10.6 59.92 Favored 'General case' 0 CA--C 1.549 0.937 0 C-N-CA 124.699 1.2 . . . . 0.0 112.268 174.965 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 21.3 p -59.92 -2.8 0.44 Allowed 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 127.182 2.193 . . . . 0.0 115.468 177.716 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 85.0 tttt -48.72 -34.71 12.56 Favored 'General case' 0 N--CA 1.477 0.918 0 CA-C-N 120.699 1.59 . . . . 0.0 113.857 179.08 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -65.7 -25.74 67.45 Favored 'General case' 0 N--CA 1.474 0.772 0 N-CA-C 113.818 1.044 . . . . 0.0 113.818 177.488 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 87.1 mt -88.81 -8.9 53.54 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 127.26 2.224 . . . . 0.0 113.797 -179.418 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 4.1 m -77.43 76.94 3.97 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-O 122.738 1.256 . . . . 0.0 110.366 -179.632 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -75.65 142.26 42.62 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 128.428 2.691 . . . . 0.0 111.716 -177.139 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 51.8 mt-10 -70.89 149.86 46.33 Favored 'General case' 0 N--CA 1.471 0.612 0 O-C-N 120.718 -1.239 . . . . 0.0 112.08 176.927 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 16.5 m -84.1 155.2 3.66 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.921 0 C-N-CA 123.163 0.585 . . . . 0.0 111.191 174.555 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 42.3 t -74.76 133.56 41.96 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-O 121.861 0.839 . . . . 0.0 110.841 176.861 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 3.4 mpt_? -67.95 -26.96 66.21 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 124.994 1.317 . . . . 0.0 113.437 -177.562 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 7.8 mm-40 -87.86 -32.9 18.75 Favored 'General case' 0 N--CA 1.465 0.32 0 C-N-CA 123.053 0.541 . . . . 0.0 110.701 178.427 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 64.2 t80 -64.15 -31.69 72.98 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 123.513 0.725 . . . . 0.0 110.212 172.93 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 12.0 mm100 -61.61 -24.21 66.54 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 123.669 0.788 . . . . 0.0 112.541 174.382 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 28.0 mtm105 -103.48 -2.36 26.98 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 125.967 1.707 . . . . 0.0 112.575 177.649 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 72.58 35.86 59.02 Favored Glycine 0 CA--C 1.533 1.191 0 C-N-CA 126.223 1.868 . . . . 0.0 113.983 179.927 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 5.3 t -137.15 10.62 3.03 Favored 'General case' 0 N--CA 1.48 1.053 0 N-CA-C 116.122 1.897 . . . . 0.0 116.122 -175.033 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 28.9 t -60.77 131.73 51.61 Favored 'General case' 0 CA--C 1.55 0.971 0 CA-C-N 119.723 1.147 . . . . 0.0 111.518 177.545 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 29.0 m -80.16 5.14 15.26 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 125.811 1.644 . . . . 0.0 114.894 -177.581 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 79.1 mtm-85 -129.69 145.22 56.12 Favored Pre-proline 0 N--CA 1.475 0.798 0 C-N-CA 125.243 1.417 . . . . 0.0 113.491 -175.28 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 93.5 Cg_endo -70.22 166.79 27.01 Favored 'Trans proline' 0 CA--C 1.543 0.959 0 C-N-CA 122.251 1.967 . . . . 0.0 109.803 171.382 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 7.1 p-10 -54.61 -28.76 48.83 Favored 'General case' 0 N--CA 1.475 0.821 0 O-C-N 121.031 -1.043 . . . . 0.0 113.507 177.088 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 35.0 p -75.52 -9.25 58.42 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 125.472 1.509 . . . . 0.0 114.995 178.874 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 25.5 mm-40 -122.12 -25.16 4.96 Favored 'General case' 0 N--CA 1.477 0.901 0 N-CA-C 115.763 1.764 . . . . 0.0 115.763 -175.748 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 4.3 t -71.02 164.55 25.33 Favored 'General case' 0 CA--C 1.545 0.788 0 N-CA-C 115.181 1.549 . . . . 0.0 115.181 -175.164 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -83.33 -13.29 55.37 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 126.888 2.075 . . . . 0.0 113.428 -179.805 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 59.5 m-85 -136.76 171.79 13.98 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 127.093 2.157 . . . . 0.0 110.105 179.068 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -81.26 151.96 27.85 Favored 'General case' 0 CA--C 1.545 0.757 0 N-CA-C 114.555 1.317 . . . . 0.0 114.555 -176.15 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 67.7 m170 -124.25 85.32 55.3 Favored Pre-proline 0 CA--C 1.553 1.072 0 C-N-CA 126.315 1.846 . . . . 0.0 110.638 -179.788 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_endo -63.42 151.71 83.62 Favored 'Trans proline' 0 C--N 1.352 0.762 0 C-N-CA 123.606 2.871 . . . . 0.0 115.166 -177.43 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 59.6 p -84.77 -176.31 6.16 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 124.785 1.234 . . . . 0.0 111.93 174.492 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 67.7 mttm -63.24 -18.34 63.43 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 125.477 1.511 . . . . 0.0 113.407 173.686 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 70.8 p -109.26 -21.23 12.65 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 125.368 1.467 . . . . 0.0 114.696 -178.92 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 84.0 m -63.68 138.89 58.68 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 119.463 1.029 . . . . 0.0 113.581 179.522 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 24.3 mt-30 -78.79 136.82 37.47 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 124.808 1.243 . . . . 0.0 111.449 178.242 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 11.2 t -130.23 135.4 60.88 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.687 0 C-N-CA 124.789 1.235 . . . . 0.0 110.478 -179.484 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -145.91 132.72 20.06 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 125.149 1.379 . . . . 0.0 111.202 178.236 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 63.2 t30 41.16 38.39 0.73 Allowed 'General case' 0 CA--C 1.552 1.038 0 C-N-CA 126.951 2.1 . . . . 0.0 116.419 177.622 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 87.26 14.99 63.11 Favored Glycine 0 CA--C 1.536 1.377 0 O-C-N 121.071 -1.018 . . . . 0.0 115.136 179.892 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 30.0 mtt180 -137.01 163.75 30.0 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 125.452 1.501 . . . . 0.0 112.702 -179.664 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 6.2 m -137.6 141.35 39.51 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.562 0 C-N-CA 127.87 2.468 . . . . 0.0 109.91 -179.243 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 49.8 mt -90.2 142.29 13.14 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.964 0 O-C-N 121.092 -1.005 . . . . 0.0 108.991 178.591 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -90.8 152.28 20.85 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 123.54 0.736 . . . . 0.0 112.693 -179.718 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 3.7 t -70.29 88.87 0.64 Allowed 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.997 1.719 . . . . 0.0 111.398 -177.061 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 28.9 p90 -57.7 -36.86 72.55 Favored 'General case' 0 N--CA 1.469 0.508 0 O-C-N 121.341 -0.849 . . . . 0.0 111.934 179.374 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 66.8 m-20 -59.48 -30.79 68.79 Favored 'General case' 0 CA--C 1.542 0.648 0 O-C-N 121.807 -0.558 . . . . 0.0 111.66 177.269 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 47.9 t -71.28 -41.46 69.99 Favored 'General case' 0 N--CA 1.469 0.513 0 O-C-N 120.744 -1.223 . . . . 0.0 111.104 177.054 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 48.3 mt -66.94 -40.25 87.53 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 123.912 0.885 . . . . 0.0 112.49 175.731 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 14.2 mmmm -78.48 -8.4 58.49 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 125.078 1.351 . . . . 0.0 114.591 -179.381 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 76.05 49.59 8.47 Favored Glycine 0 CA--C 1.534 1.219 0 CA-C-N 118.786 0.721 . . . . 0.0 112.26 -179.222 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.13 -21.8 1.19 Allowed 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 125.981 1.713 . . . . 0.0 115.588 -174.843 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 7.4 t -56.18 113.76 1.68 Allowed 'General case' 0 CA--C 1.546 0.816 0 N-CA-C 114.362 1.245 . . . . 0.0 114.362 -174.159 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 19.9 m -142.13 15.55 2.07 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 127.871 2.468 . . . . 0.0 110.968 179.188 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.401 ' NH2' ' SG ' ' A' ' 66' ' ' CYS . 20.1 ttm105 -63.34 143.2 58.01 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 127.354 2.262 . . . . 0.0 112.96 -176.283 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 3.5 mp0 -64.93 -35.18 80.31 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 124.301 1.041 . . . . 0.0 112.892 179.761 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 52.5 m-80 -152.39 109.85 3.58 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 126.697 1.999 . . . . 0.0 109.271 179.543 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' CYS . . . . . 0.401 ' SG ' ' NH2' ' A' ' 63' ' ' ARG . 59.0 m -69.36 139.09 54.15 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-O 121.84 0.829 . . . . 0.0 111.138 177.751 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 35.2 mtmt -115.51 15.65 16.66 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 125.788 1.635 . . . . 0.0 111.144 176.457 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 68.7 m-85 -139.03 150.43 45.79 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 127.714 2.405 . . . . 0.0 111.381 -174.683 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -73.63 122.06 21.69 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 124.598 1.159 . . . . 0.0 112.874 -178.406 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 4.0 m170 -72.92 117.59 61.06 Favored Pre-proline 0 CA--C 1.547 0.83 0 N-CA-C 107.609 -1.256 . . . . 0.0 107.609 171.455 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 90.1 Cg_exo -48.89 111.47 0.48 Allowed 'Trans proline' 0 CA--C 1.545 1.045 0 C-N-CA 124.475 3.45 . . . . 0.0 116.238 -176.301 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 68.1 Cg_endo -74.53 154.1 44.68 Favored 'Trans proline' 0 CA--C 1.542 0.893 0 C-N-CA 122.391 2.061 . . . . 0.0 111.048 176.38 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -54.95 -34.66 87.21 Favored 'Trans proline' 0 CA--C 1.536 0.59 0 C-N-CA 123.532 2.821 . . . . 0.0 114.682 -177.413 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 19.4 t-80 -75.66 -13.44 60.33 Favored 'General case' 0 N--CA 1.474 0.734 0 N-CA-C 114.519 1.303 . . . . 0.0 114.519 178.308 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 87.7 mt -115.55 -14.6 11.5 Favored 'General case' 0 N--CA 1.474 0.769 0 N-CA-C 113.948 1.092 . . . . 0.0 113.948 178.461 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 56.0 mtpt -54.55 -32.71 58.88 Favored 'General case' 0 N--CA 1.475 0.78 0 CA-C-N 119.728 1.149 . . . . 0.0 110.638 173.103 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 17.4 m -62.89 -42.98 99.97 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 124.648 1.179 . . . . 0.0 111.585 175.208 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 -66.65 -47.23 73.19 Favored 'General case' 0 CA--C 1.536 0.438 0 O-C-N 121.419 -0.801 . . . . 0.0 110.093 176.663 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 44.3 mt -61.92 -39.15 91.03 Favored 'General case' 0 N--CA 1.471 0.584 0 N-CA-C 113.183 0.809 . . . . 0.0 113.183 178.287 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 17.7 mm-40 -53.49 -54.29 39.28 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 124.733 1.213 . . . . 0.0 110.443 174.485 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 69.5 mt -68.45 -37.52 77.93 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.402 0 C-N-CA 126.032 1.733 . . . . 0.0 111.197 -176.186 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 72.8 m-20 -63.13 -44.26 96.09 Favored 'General case' 0 CA--C 1.542 0.66 0 O-C-N 121.623 -0.673 . . . . 0.0 110.294 173.081 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -63.39 -46.0 93.7 Favored Glycine 0 CA--C 1.529 0.913 0 C-N-CA 124.431 1.015 . . . . 0.0 112.421 179.326 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 81.8 mtt-85 -58.64 -37.15 75.32 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 124.596 1.158 . . . . 0.0 111.434 175.81 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 43.8 t30 -73.53 -44.27 58.01 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 123.767 0.827 . . . . 0.0 111.887 175.603 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 30.1 t30 -59.9 -29.86 68.64 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 125.174 1.39 . . . . 0.0 113.849 179.414 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 32.4 tp -49.49 -26.51 3.45 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 125.695 1.598 . . . . 0.0 114.464 -179.102 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 9.4 pt -53.59 -32.54 20.96 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.745 0 C-N-CA 124.635 1.174 . . . . 0.0 112.939 176.138 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 18.6 tt0 -61.0 -30.85 70.53 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 124.126 0.97 . . . . 0.0 112.318 177.552 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -93.67 2.48 56.3 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 125.539 1.536 . . . . 0.0 112.889 178.28 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 59.6 mtpt -125.44 -16.22 5.92 Favored 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 125.316 1.447 . . . . 0.0 114.765 -178.758 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 45.7 t30 . . . . . 0 CA--C 1.542 0.661 0 C-N-CA 125.629 1.572 . . . . 0.0 111.502 -179.573 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 94.7 mtp . . . . . 0 CA--C 1.545 0.771 0 N-CA-C 113.405 0.891 . . . . 0.0 113.405 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -65.15 157.36 28.89 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 124.897 1.279 . . . . 0.0 113.144 179.022 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 32.8 m -132.66 11.89 1.55 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.239 0 C-N-CA 125.565 1.546 . . . . 0.0 113.407 -179.352 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 20.0 m -60.24 151.53 27.1 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 125.562 1.545 . . . . 0.0 113.825 -179.164 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 40.3 t -140.34 148.25 22.53 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.992 0 C-N-CA 126.291 1.837 . . . . 0.0 109.197 179.057 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 15.2 p -62.03 153.75 72.22 Favored Pre-proline 0 N--CA 1.479 1.003 0 C-N-CA 124.472 1.109 . . . . 0.0 112.867 178.762 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_exo -52.98 144.39 45.64 Favored 'Trans proline' 0 CA--C 1.541 0.825 0 C-N-CA 123.784 2.989 . . . . 0.0 115.083 179.806 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 47.0 pt -133.13 14.13 1.46 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.205 0 C-N-CA 126.027 1.731 . . . . 0.0 113.009 179.113 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 46.9 ptt85 -140.95 11.98 2.23 Favored 'General case' 0 N--CA 1.481 1.111 0 N-CA-C 115.282 1.586 . . . . 0.0 115.282 -177.33 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -53.19 -30.94 40.3 Favored 'General case' 0 CA--C 1.547 0.845 0 N-CA-C 116.291 1.96 . . . . 0.0 116.291 -175.407 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 21.8 p -134.79 -5.72 2.46 Favored 'General case' 0 N--CA 1.483 1.198 0 N-CA-C 115.963 1.838 . . . . 0.0 115.963 -178.735 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 18.6 ptpt -54.56 -25.69 27.63 Favored 'General case' 0 N--CA 1.485 1.279 0 CA-C-N 121.485 1.948 . . . . 0.0 115.606 -178.466 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -77.71 -22.97 49.6 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 123.729 0.812 . . . . 0.0 112.785 175.403 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 85.7 mt -95.06 -20.34 19.4 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 127.269 2.228 . . . . 0.0 114.081 -177.649 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 4.5 m -73.19 73.69 1.26 Allowed 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 125.251 1.42 . . . . 0.0 112.029 -178.957 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 10.2 tp -75.67 145.25 41.12 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 127.137 2.175 . . . . 0.0 112.098 -178.751 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 11.2 mt-10 -72.95 152.19 41.51 Favored 'General case' 0 N--CA 1.471 0.588 0 O-C-N 120.589 -1.319 . . . . 0.0 112.865 179.146 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 18.0 m -85.21 156.18 3.49 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.852 0 C-N-CA 123.333 0.653 . . . . 0.0 111.446 175.559 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 42.6 t -75.69 128.06 34.39 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-O 121.61 0.719 . . . . 0.0 110.44 176.741 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 4.3 mpt_? -66.82 -27.64 67.72 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 124.384 1.073 . . . . 0.0 113.141 -177.658 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -78.92 -40.75 31.27 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.457 0.703 . . . . 0.0 109.518 177.803 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 63.8 t80 -62.79 -35.28 79.36 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 124.752 1.221 . . . . 0.0 111.2 175.745 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 50.3 mm-40 -62.04 -15.92 48.12 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 124.408 1.083 . . . . 0.0 113.406 175.248 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 12.0 mtp-105 -120.82 12.71 11.37 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 127.06 2.144 . . . . 0.0 112.266 -179.852 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 58.06 34.62 73.37 Favored Glycine 0 CA--C 1.535 1.285 0 C-N-CA 125.061 1.315 . . . . 0.0 113.845 -179.791 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 7.6 t -129.87 14.1 5.82 Favored 'General case' 0 N--CA 1.475 0.796 0 N-CA-C 114.597 1.332 . . . . 0.0 114.597 -175.342 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 6.8 t -68.57 173.35 5.14 Favored 'General case' 0 CA--C 1.556 1.176 0 O-C-N 121.409 -0.807 . . . . 0.0 110.837 174.133 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 91.6 p -139.4 9.34 2.47 Favored 'General case' 0 N--CA 1.477 0.878 0 N-CA-C 115.097 1.517 . . . . 0.0 115.097 -176.825 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 48.3 mtt85 -130.86 145.47 57.85 Favored Pre-proline 0 N--CA 1.47 0.569 0 C-N-CA 125.596 1.558 . . . . 0.0 112.116 -177.589 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -69.05 166.44 26.72 Favored 'Trans proline' 0 CA--C 1.543 0.958 0 C-N-CA 121.962 1.775 . . . . 0.0 109.735 171.973 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -54.24 -29.79 47.88 Favored 'General case' 0 N--CA 1.476 0.862 0 O-C-N 121.129 -0.982 . . . . 0.0 113.054 176.946 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 31.7 p -73.1 -7.63 52.17 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 125.991 1.717 . . . . 0.0 115.004 178.317 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 21.8 mt-10 -127.39 -24.33 3.37 Favored 'General case' 0 N--CA 1.476 0.838 0 N-CA-C 116.059 1.874 . . . . 0.0 116.059 -176.167 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 1.1 t -71.71 164.64 25.59 Favored 'General case' 0 CA--C 1.543 0.691 0 N-CA-C 115.415 1.635 . . . . 0.0 115.415 -176.538 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -81.62 -10.81 59.33 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 126.591 1.956 . . . . 0.0 113.717 -178.598 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 63.1 m-85 -140.06 174.0 10.96 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 126.549 1.939 . . . . 0.0 110.336 179.507 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -80.11 150.02 30.4 Favored 'General case' 0 CA--C 1.548 0.871 0 N-CA-C 113.349 0.87 . . . . 0.0 113.349 -176.957 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 65.8 m170 -123.42 86.14 52.19 Favored Pre-proline 0 CA--C 1.553 1.092 0 C-N-CA 126.049 1.74 . . . . 0.0 110.965 -179.327 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_endo -63.82 152.64 79.75 Favored 'Trans proline' 0 CA--C 1.541 0.842 0 C-N-CA 123.704 2.936 . . . . 0.0 114.998 -177.894 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 39.2 p -92.32 -174.44 3.72 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 124.99 1.316 . . . . 0.0 112.096 175.563 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -62.09 -17.02 56.32 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 125.693 1.597 . . . . 0.0 113.559 173.31 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 61.2 m -109.07 -25.71 10.54 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 124.719 1.208 . . . . 0.0 114.081 -179.744 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 75.2 m -60.56 129.52 41.98 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 123.861 0.864 . . . . 0.0 113.137 -179.618 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 33.9 mt-30 -77.05 141.62 40.21 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 123.161 0.584 . . . . 0.0 110.978 176.115 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 14.5 t -129.48 139.59 51.3 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 C-N-CA 125.438 1.495 . . . . 0.0 110.604 -177.695 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 74.1 mm-40 -145.32 129.35 17.49 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 125.213 1.405 . . . . 0.0 111.49 179.943 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 63.3 t30 42.88 37.23 1.03 Allowed 'General case' 0 CA--C 1.555 1.138 0 N-CA-C 116.298 1.962 . . . . 0.0 116.298 176.684 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 85.58 17.18 62.49 Favored Glycine 0 CA--C 1.536 1.399 0 O-C-N 120.975 -1.078 . . . . 0.0 114.813 -179.407 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 60.8 mtt180 -138.72 162.01 35.75 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 125.842 1.657 . . . . 0.0 111.472 -179.1 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 4.9 m -138.35 142.25 35.7 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.626 0 C-N-CA 126.949 2.1 . . . . 0.0 109.938 -177.869 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 31.8 mt -90.36 129.28 41.46 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.766 0 O-C-N 121.289 -0.882 . . . . 0.0 110.337 -178.048 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -75.53 149.24 38.43 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 124.16 0.984 . . . . 0.0 111.733 177.868 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 15.2 t -69.45 99.52 1.25 Allowed 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 124.876 1.27 . . . . 0.0 112.985 -176.696 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 32.1 p90 -61.66 -38.56 88.19 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 115.165 -0.925 . . . . 0.0 110.154 175.108 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 69.9 m-20 -61.26 -41.78 97.52 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 123.17 0.588 . . . . 0.0 111.033 177.187 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 48.2 t -64.63 -41.65 96.03 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-N 119.48 1.036 . . . . 0.0 111.462 177.678 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 31.2 mt -66.5 -41.63 88.6 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 123.804 0.841 . . . . 0.0 112.882 176.504 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 31.4 mmmt -77.77 -10.97 59.82 Favored 'General case' 0 N--CA 1.478 0.966 0 C-N-CA 124.668 1.187 . . . . 0.0 113.71 179.158 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 81.14 38.39 15.44 Favored Glycine 0 CA--C 1.537 1.412 0 C-N-CA 124.605 1.098 . . . . 0.0 113.803 179.644 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 50.9 ttp180 -121.97 -20.78 6.22 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 126.551 1.94 . . . . 0.0 114.555 -176.592 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 5.4 t -67.74 142.84 56.14 Favored 'General case' 0 CA--C 1.544 0.728 0 CA-C-N 119.318 0.963 . . . . 0.0 112.973 -178.286 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 78.0 p -154.07 10.93 0.4 Allowed 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 126.669 1.987 . . . . 0.0 112.846 179.224 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 79.8 mtm-85 -68.5 161.82 26.97 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 126.026 1.731 . . . . 0.0 113.781 -178.507 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -116.04 -5.06 11.96 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 126.353 1.861 . . . . 0.0 112.849 177.023 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 62.1 m-20 -144.33 37.85 1.25 Allowed 'General case' 0 CA--C 1.552 1.03 0 C-N-CA 127.939 2.496 . . . . 0.0 109.912 -178.205 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 7.4 t -52.45 128.4 25.57 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 125.586 1.554 . . . . 0.0 112.167 -177.041 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 30.4 mtmt -84.64 4.49 32.15 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 125.07 1.348 . . . . 0.0 114.089 -177.374 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 86.8 m-85 -127.24 155.71 43.03 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 124.823 1.249 . . . . 0.0 112.173 -175.304 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -77.31 114.43 16.12 Favored 'General case' 0 N--CA 1.467 0.412 0 C-N-CA 123.699 0.799 . . . . 0.0 112.079 -177.306 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 9.3 m170 -69.57 115.16 30.09 Favored Pre-proline 0 CA--C 1.546 0.805 0 N-CA-C 107.741 -1.207 . . . . 0.0 107.741 173.849 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 92.9 Cg_exo -49.71 114.1 1.22 Allowed 'Trans proline' 0 CA--C 1.543 0.967 0 C-N-CA 124.554 3.503 . . . . 0.0 116.238 -174.887 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -77.42 149.76 27.81 Favored 'Trans proline' 0 CA--C 1.542 0.923 0 C-N-CA 122.114 1.876 . . . . 0.0 110.435 175.876 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 88.5 Cg_exo -46.87 -39.47 24.48 Favored 'Trans proline' 0 CA--C 1.539 0.739 0 C-N-CA 123.895 3.064 . . . . 0.0 115.437 -179.968 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 12.7 t-80 -70.71 -17.78 62.82 Favored 'General case' 0 N--CA 1.472 0.666 0 N-CA-C 115.08 1.511 . . . . 0.0 115.08 179.774 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 76.3 mt -113.32 -16.36 12.51 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 124.597 1.159 . . . . 0.0 113.009 178.143 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 53.6 mtpt -54.72 -34.73 62.82 Favored 'General case' 0 N--CA 1.478 0.964 0 CA-C-N 119.742 1.156 . . . . 0.0 111.533 174.365 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 23.0 m -63.75 -43.72 95.62 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 123.461 0.705 . . . . 0.0 111.329 175.805 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 91.1 mm-40 -67.22 -45.7 76.03 Favored 'General case' 0 N--CA 1.469 0.514 0 O-C-N 121.458 -0.776 . . . . 0.0 111.002 177.598 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 81.8 mt -61.82 -49.86 74.59 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 124.376 1.07 . . . . 0.0 112.285 178.467 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.35 -35.84 82.2 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-N 119.541 1.064 . . . . 0.0 112.735 -179.598 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 59.4 mt -62.58 -44.29 99.24 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.785 0 CA-C-N 118.759 0.709 . . . . 0.0 109.851 174.582 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 13.3 t-20 -63.98 -39.8 94.94 Favored 'General case' 0 CA--C 1.546 0.814 0 O-C-N 121.677 -0.639 . . . . 0.0 110.5 175.78 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -57.77 -47.91 85.46 Favored Glycine 0 CA--C 1.532 1.115 0 C-N-CA 124.858 1.218 . . . . 0.0 112.259 176.564 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 91.4 mtt-85 -58.15 -37.03 73.87 Favored 'General case' 0 N--CA 1.48 1.056 0 CA-C-N 118.525 1.163 . . . . 0.0 112.148 176.021 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 17.3 t-20 -76.05 -14.69 60.2 Favored 'General case' 0 CA--C 1.553 1.059 0 C-N-CA 124.897 1.279 . . . . 0.0 113.538 177.808 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 24.2 t-20 -99.85 -46.01 5.53 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 125.763 1.625 . . . . 0.0 112.185 -179.524 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 90.7 mt -74.91 9.28 1.97 Allowed 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 126.417 1.887 . . . . 0.0 114.995 -178.374 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 76.6 mt -48.96 -40.33 12.51 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.056 0 C-N-CA 125.512 1.525 . . . . 0.0 112.813 -179.149 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 91.1 mt-30 -59.57 -23.7 63.13 Favored 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 114.097 1.147 . . . . 0.0 114.097 179.249 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 24.2 tt0 -64.26 -22.1 66.83 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 124.357 1.063 . . . . 0.0 112.72 177.672 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -69.76 -15.24 63.1 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 125.14 1.376 . . . . 0.0 113.832 178.346 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 44.8 t30 . . . . . 0 CA--C 1.545 0.769 0 C-N-CA 125.103 1.361 . . . . 0.0 112.632 179.774 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.3 mpt? . . . . . 0 CA--C 1.545 0.757 0 N-CA-C 113.099 0.778 . . . . 0.0 113.099 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -139.19 15.5 2.61 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 125.807 1.643 . . . . 0.0 113.502 -179.128 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 33.4 m -57.87 -19.79 13.09 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.194 0 N-CA-C 114.734 1.383 . . . . 0.0 114.734 -179.378 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 45.4 p -75.08 -12.99 60.44 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 125.736 1.614 . . . . 0.0 114.291 177.591 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 26.9 m -126.28 159.87 34.54 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.75 0 C-N-CA 124.649 1.18 . . . . 0.0 113.423 -178.817 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 55.8 p -146.17 168.6 11.3 Favored Pre-proline 0 N--CA 1.474 0.769 0 C-N-CA 128.615 2.766 . . . . 0.0 108.53 -177.908 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 75.0 Cg_exo -48.84 -42.43 37.33 Favored 'Trans proline' 0 C--N 1.351 0.708 0 C-N-CA 122.807 2.338 . . . . 0.0 114.343 178.974 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 43.5 pt -71.47 -5.12 5.4 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 N-CA-C 114.647 1.351 . . . . 0.0 114.647 179.281 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 98.4 mtt180 -114.49 4.35 15.21 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 127.15 2.18 . . . . 0.0 111.975 176.741 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -135.04 -39.18 0.77 Allowed 'General case' 0 N--CA 1.473 0.683 0 N-CA-C 114.266 1.21 . . . . 0.0 114.266 -176.021 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 43.5 p -66.42 -6.53 14.82 Favored 'General case' 0 N--CA 1.482 1.172 0 N-CA-C 115.165 1.543 . . . . 0.0 115.165 179.477 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 22.8 tptm -51.87 -38.75 57.28 Favored 'General case' 0 N--CA 1.476 0.867 0 CA-C-N 119.945 1.248 . . . . 0.0 112.933 178.846 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -68.84 -32.97 73.04 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 123.817 0.847 . . . . 0.0 112.923 177.181 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 83.9 mt -85.13 -13.89 48.75 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 126.816 2.046 . . . . 0.0 114.017 -178.714 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 11.1 m -77.97 79.17 4.44 Favored 'General case' 0 N--CA 1.475 0.821 0 CA-C-O 122.442 1.115 . . . . 0.0 110.398 -178.538 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -75.64 140.78 42.76 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 128.492 2.717 . . . . 0.0 111.363 -177.612 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 14.5 mt-10 -74.47 151.49 39.56 Favored 'General case' 0 N--CA 1.472 0.664 0 O-C-N 120.49 -1.381 . . . . 0.0 112.179 177.917 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 13.9 m -83.46 155.77 3.76 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.765 0 C-N-CA 122.848 0.459 . . . . 0.0 110.605 175.372 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 40.5 t -75.0 130.12 38.82 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-O 121.646 0.736 . . . . 0.0 110.648 177.096 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 3.5 mpt_? -67.59 -28.68 67.97 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 124.355 1.062 . . . . 0.0 113.207 -177.32 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -82.26 -33.06 29.34 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 118.262 0.483 . . . . 0.0 110.831 178.436 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 72.9 t80 -64.96 -35.92 82.72 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 123.702 0.801 . . . . 0.0 109.657 172.938 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 60.2 mm-40 -65.01 -18.6 65.44 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 124.132 0.973 . . . . 0.0 112.591 173.786 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 47.9 mtp180 -106.67 3.26 26.59 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 126.481 1.912 . . . . 0.0 112.494 178.523 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 62.61 34.04 88.38 Favored Glycine 0 CA--C 1.537 1.417 0 C-N-CA 125.197 1.379 . . . . 0.0 113.606 -178.077 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 5.3 t -138.12 16.09 2.82 Favored 'General case' 0 N--CA 1.478 0.937 0 N-CA-C 115.464 1.653 . . . . 0.0 115.464 -174.854 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 7.5 t -64.71 168.79 5.69 Favored 'General case' 0 CA--C 1.558 1.277 0 CA-C-N 119.275 0.943 . . . . 0.0 111.441 175.647 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 50.7 m -128.95 7.2 5.54 Favored 'General case' 0 N--CA 1.48 1.046 0 N-CA-C 115.562 1.69 . . . . 0.0 115.562 -175.289 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 87.9 mtt180 -137.07 145.68 51.4 Favored Pre-proline 0 N--CA 1.474 0.748 0 C-N-CA 125.527 1.531 . . . . 0.0 111.921 -178.874 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 74.6 Cg_endo -69.26 167.66 23.13 Favored 'Trans proline' 0 CA--C 1.544 1.005 0 C-N-CA 122.231 1.954 . . . . 0.0 110.141 172.49 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -54.38 -31.19 54.24 Favored 'General case' 0 N--CA 1.48 1.038 0 O-C-N 121.079 -1.013 . . . . 0.0 112.492 177.543 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 23.5 p -71.33 -6.94 43.73 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 126.318 1.847 . . . . 0.0 114.982 177.206 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 29.4 mt-10 -132.56 -21.44 2.24 Favored 'General case' 0 N--CA 1.476 0.836 0 N-CA-C 116.342 1.979 . . . . 0.0 116.342 -176.27 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 3.7 t -72.19 169.87 15.23 Favored 'General case' 0 CA--C 1.552 1.037 0 CA-C-N 119.935 1.243 . . . . 0.0 114.214 -177.977 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 56.0 mtmt -88.26 -10.66 48.91 Favored 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 126.518 1.927 . . . . 0.0 114.081 -178.516 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 66.7 m-85 -139.33 171.63 13.99 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 127.301 2.24 . . . . 0.0 109.389 177.02 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -82.38 150.86 26.91 Favored 'General case' 0 CA--C 1.546 0.809 0 N-CA-C 114.644 1.349 . . . . 0.0 114.644 -175.894 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 57.4 m170 -122.88 88.28 50.52 Favored Pre-proline 0 CA--C 1.552 1.028 0 C-N-CA 126.017 1.727 . . . . 0.0 110.577 179.073 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 26.5 Cg_endo -61.79 148.06 93.92 Favored 'Trans proline' 0 C--N 1.352 0.731 0 C-N-CA 123.148 2.565 . . . . 0.0 114.569 -178.315 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 59.7 p -82.48 -178.92 7.24 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 124.405 1.082 . . . . 0.0 111.908 175.055 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 31.2 mmmt -61.43 -17.36 53.98 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 125.445 1.498 . . . . 0.0 113.352 173.383 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 50.5 m -109.2 -17.94 13.73 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 125.016 1.326 . . . . 0.0 114.535 -178.686 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 83.5 m -69.27 154.14 42.52 Favored 'General case' 0 CA--C 1.543 0.676 0 CA-C-N 119.704 1.138 . . . . 0.0 112.682 177.833 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 39.0 mt-30 -110.13 141.21 43.33 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 124.483 1.113 . . . . 0.0 111.466 178.807 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -133.38 148.34 30.97 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.558 0 C-N-CA 125.054 1.342 . . . . 0.0 112.632 -177.48 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -146.01 140.79 27.09 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 125.934 1.694 . . . . 0.0 110.524 177.015 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 7.3 t-20 46.51 30.7 1.14 Allowed 'General case' 0 CA--C 1.553 1.069 0 C-N-CA 126.083 1.753 . . . . 0.0 115.245 179.207 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 82.09 22.81 58.54 Favored Glycine 0 CA--C 1.537 1.425 0 O-C-N 121.044 -1.035 . . . . 0.0 114.19 -178.253 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 53.2 mtt85 -138.13 160.64 38.87 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 125.249 1.42 . . . . 0.0 112.088 -178.446 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 4.4 m -136.78 138.59 46.01 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.514 0 C-N-CA 127.733 2.413 . . . . 0.0 109.886 -176.99 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 20.6 mt -88.48 129.77 39.09 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.558 0 O-C-N 121.306 -0.871 . . . . 0.0 109.63 -179.033 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -75.39 147.2 40.21 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 123.84 0.856 . . . . 0.0 111.067 178.054 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 11.8 t -69.23 98.79 1.07 Allowed 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 124.489 1.115 . . . . 0.0 112.538 -177.094 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 30.8 p90 -60.91 -38.18 84.82 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.104 175.645 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 70.1 m-20 -62.14 -36.65 82.44 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 123.571 0.748 . . . . 0.0 111.695 177.098 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 29.6 t -66.67 -42.12 87.07 Favored 'General case' 0 CA--C 1.539 0.558 0 CA-C-N 119.613 1.097 . . . . 0.0 111.146 176.461 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 31.8 mt -67.75 -39.89 84.17 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 123.82 0.848 . . . . 0.0 112.836 176.573 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . 0.45 ' HE2' ' HA ' ' A' ' 58' ' ' LYS . 10.0 mmpt? -80.82 -7.55 59.45 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 125.034 1.334 . . . . 0.0 114.161 -179.397 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 78.26 39.45 22.86 Favored Glycine 0 CA--C 1.536 1.366 0 C-N-CA 124.428 1.013 . . . . 0.0 113.837 179.021 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 34.7 ttm105 -120.73 -27.42 5.07 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 126.805 2.042 . . . . 0.0 113.755 -177.17 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 7.2 t -65.81 127.26 31.27 Favored 'General case' 0 CA--C 1.544 0.741 0 CA-C-N 118.991 0.814 . . . . 0.0 112.229 -178.293 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 63.8 p -152.53 17.67 0.62 Allowed 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 126.475 1.91 . . . . 0.0 112.493 -178.968 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 81.9 mtt85 -61.62 153.68 27.2 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 126.445 1.898 . . . . 0.0 114.286 -177.869 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -75.54 -19.9 59.02 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 123.604 0.762 . . . . 0.0 110.853 171.01 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -158.99 131.01 6.56 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 128.128 2.571 . . . . 0.0 108.658 176.879 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 4.2 t -110.67 159.07 17.93 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 124.456 1.103 . . . . 0.0 111.159 -179.998 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 32.5 mtmt -117.55 2.7 12.4 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 125.723 1.609 . . . . 0.0 113.533 -177.304 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 88.4 m-85 -123.45 151.74 42.37 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 125.95 1.7 . . . . 0.0 110.461 -176.987 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -75.08 115.42 14.69 Favored 'General case' 0 N--CA 1.467 0.396 0 O-C-N 121.595 -0.69 . . . . 0.0 112.017 -176.331 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 14.4 m170 -70.53 114.0 22.77 Favored Pre-proline 0 CA--C 1.547 0.857 0 N-CA-C 108.199 -1.038 . . . . 0.0 108.199 175.161 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 66.4 Cg_exo -46.96 109.53 0.22 Allowed 'Trans proline' 0 CA--C 1.544 1.01 0 C-N-CA 125.074 3.849 . . . . 0.0 117.143 -174.168 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_endo -77.59 151.59 28.89 Favored 'Trans proline' 0 CA--C 1.544 1.013 0 C-N-CA 122.815 2.343 . . . . 0.0 111.35 176.462 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_exo -47.26 -40.67 27.94 Favored 'Trans proline' 0 CA--C 1.539 0.769 0 C-N-CA 123.916 3.077 . . . . 0.0 115.496 179.059 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 8.3 m-70 -70.64 -15.79 62.76 Favored 'General case' 0 N--CA 1.476 0.866 0 N-CA-C 114.87 1.433 . . . . 0.0 114.87 178.98 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 85.7 mt -116.42 -15.21 10.94 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 124.116 0.966 . . . . 0.0 113.562 178.956 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 54.9 mtpt -55.73 -32.32 63.26 Favored 'General case' 0 N--CA 1.475 0.808 0 CA-C-N 119.736 1.153 . . . . 0.0 110.527 172.944 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 21.5 m -62.82 -45.45 92.57 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 124.206 1.002 . . . . 0.0 111.227 174.811 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 77.6 mt-30 -64.94 -46.54 81.17 Favored 'General case' 0 CA--C 1.54 0.57 0 O-C-N 121.39 -0.819 . . . . 0.0 110.518 176.636 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 85.1 mt -61.92 -39.8 93.3 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 124.33 1.052 . . . . 0.0 112.711 178.164 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 20.1 mm-40 -55.71 -53.64 54.13 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 124.89 1.276 . . . . 0.0 110.428 174.975 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 62.3 mt -67.68 -38.63 80.71 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.428 0 C-N-CA 125.711 1.605 . . . . 0.0 111.074 -175.97 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 54.7 m-20 -62.32 -43.46 98.76 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 123.157 0.583 . . . . 0.0 110.394 172.65 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -64.04 -48.82 71.86 Favored Glycine 0 CA--C 1.527 0.832 0 C-N-CA 124.209 0.909 . . . . 0.0 111.81 178.558 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 83.1 mtt-85 -56.68 -37.89 71.49 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 124.842 1.257 . . . . 0.0 112.069 176.662 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 52.1 t30 -66.44 -12.46 57.28 Favored 'General case' 0 CA--C 1.553 1.064 0 C-N-CA 124.528 1.131 . . . . 0.0 113.881 175.953 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 47.5 m-80 -113.96 -21.91 10.36 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 125.779 1.632 . . . . 0.0 112.609 178.333 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 33.6 tp -64.83 -22.14 66.93 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 126.628 1.971 . . . . 0.0 113.199 178.105 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 29.6 pt -52.95 135.8 14.45 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.423 0 C-N-CA 126.936 2.094 . . . . 0.0 112.32 178.427 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 63.3 mm-40 -58.72 -17.62 24.43 Favored 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 124.765 1.226 . . . . 0.0 114.144 -179.97 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 54.7 tt0 -66.0 -18.59 65.44 Favored 'General case' 0 CA--C 1.55 0.979 0 C-N-CA 125.117 1.367 . . . . 0.0 112.529 174.829 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -132.19 -40.65 1.02 Allowed 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 125.699 1.6 . . . . 0.0 113.114 -179.967 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 58.2 t-20 . . . . . 0 CA--C 1.543 0.68 0 C-N-CA 125.705 1.602 . . . . 0.0 112.194 178.456 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 64.5 mtt . . . . . 0 CA--C 1.545 0.757 0 N-CA-C 113.467 0.914 . . . . 0.0 113.467 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -150.06 166.89 28.37 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 126.07 1.748 . . . . 0.0 111.849 179.555 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 10.7 p -150.63 153.36 10.35 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.914 0 C-N-CA 125.369 1.467 . . . . 0.0 111.044 179.529 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 62.9 p -70.42 166.22 20.84 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 124.952 1.301 . . . . 0.0 113.198 178.478 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 6.1 p -134.56 4.77 1.17 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.168 0 C-N-CA 125.184 1.393 . . . . 0.0 113.009 -179.536 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 18.6 p -141.91 153.73 64.52 Favored Pre-proline 0 N--CA 1.478 0.931 0 C-N-CA 126.739 2.016 . . . . 0.0 111.074 179.693 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 86.6 Cg_endo -71.71 164.93 34.1 Favored 'Trans proline' 0 CA--C 1.541 0.873 0 C-N-CA 123.298 2.665 . . . . 0.0 112.826 179.85 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 9.6 tp -147.35 149.42 15.58 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.762 0 C-N-CA 125.433 1.493 . . . . 0.0 110.868 178.772 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 35.4 ptt-85 -65.81 160.02 24.04 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 124.989 1.315 . . . . 0.0 114.208 -179.669 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -136.49 11.25 3.22 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 126.538 1.935 . . . . 0.0 112.886 178.608 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 16.9 p -69.78 2.61 3.19 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 127.772 2.429 . . . . 0.0 115.715 -179.19 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -40.55 -43.0 1.78 Allowed 'General case' 0 N--CA 1.481 1.114 0 C-N-CA 126.425 1.89 . . . . 0.0 116.02 -177.346 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -74.55 -22.61 58.92 Favored 'General case' 0 N--CA 1.476 0.875 0 N-CA-C 114.687 1.366 . . . . 0.0 114.687 -179.282 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 67.8 mt -86.09 -10.32 55.12 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 126.72 2.008 . . . . 0.0 114.091 -177.463 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 3.6 m -75.76 76.24 2.72 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 124.752 1.221 . . . . 0.0 110.922 -178.698 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 13.7 tp -75.43 140.76 43.1 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 127.684 2.394 . . . . 0.0 111.51 -177.099 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 47.1 mp0 -67.53 150.88 48.26 Favored 'General case' 0 CA--C 1.543 0.683 0 O-C-N 120.569 -1.332 . . . . 0.0 111.977 178.396 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 21.2 m -87.08 149.58 4.06 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.075 0 C-N-CA 122.915 0.486 . . . . 0.0 111.054 174.588 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.434 ' SG ' ' NZ ' ' A' ' 35' ' ' LYS . 46.9 t -70.89 134.72 47.5 Favored 'General case' 0 CA--C 1.538 0.493 0 O-C-N 121.621 -0.675 . . . . 0.0 110.782 177.035 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 3.7 mpt_? -71.75 -33.39 68.62 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 125.521 1.528 . . . . 0.0 112.721 -178.09 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 34.9 mt-10 -73.91 -38.0 64.46 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 123.731 0.812 . . . . 0.0 110.498 178.539 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 76.8 t80 -63.15 -28.7 70.24 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 124.804 1.242 . . . . 0.0 111.922 177.237 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 53.4 mm-40 -64.04 -19.97 65.59 Favored 'General case' 0 N--CA 1.477 0.9 0 N-CA-C 112.982 0.734 . . . . 0.0 112.982 175.978 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 6.8 mpt_? -110.8 9.36 22.59 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 125.987 1.715 . . . . 0.0 111.865 177.732 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 58.47 35.05 77.92 Favored Glycine 0 CA--C 1.533 1.186 0 C-N-CA 125.065 1.317 . . . . 0.0 114.094 -179.831 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 6.4 t -129.24 8.81 5.58 Favored 'General case' 0 N--CA 1.478 0.959 0 N-CA-C 114.51 1.3 . . . . 0.0 114.51 -175.76 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 12.4 t -60.34 136.66 58.11 Favored 'General case' 0 CA--C 1.55 0.962 0 C-N-CA 123.555 0.742 . . . . 0.0 111.305 177.61 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 33.1 m -80.6 -1.96 44.36 Favored 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 115.984 1.846 . . . . 0.0 115.984 -176.302 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 23.1 mtm-85 -134.21 151.71 76.94 Favored Pre-proline 0 N--CA 1.479 0.991 0 C-N-CA 124.971 1.308 . . . . 0.0 113.277 -174.702 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 89.7 Cg_endo -71.22 167.7 25.45 Favored 'Trans proline' 0 CA--C 1.544 0.983 0 C-N-CA 122.553 2.169 . . . . 0.0 109.924 172.306 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -53.16 -28.52 26.69 Favored 'General case' 0 N--CA 1.475 0.808 0 N-CA-C 114.518 1.303 . . . . 0.0 114.518 178.776 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 12.4 p -75.99 -14.81 60.23 Favored 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 115.024 1.49 . . . . 0.0 115.024 179.057 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -121.42 -18.39 7.31 Favored 'General case' 0 N--CA 1.476 0.843 0 N-CA-C 116.711 2.115 . . . . 0.0 116.711 -173.122 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 2.9 t -72.81 172.23 11.2 Favored 'General case' 0 CA--C 1.55 0.966 0 N-CA-C 116.349 1.981 . . . . 0.0 116.349 -176.763 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.434 ' NZ ' ' SG ' ' A' ' 19' ' ' CYS . 7.0 ptpp? -75.2 -22.69 57.82 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 129.543 3.137 . . . . 0.0 115.274 -178.347 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 11.5 m-85 -144.08 176.36 9.36 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 126.678 1.991 . . . . 0.0 110.268 -176.632 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -77.26 147.57 36.23 Favored 'General case' 0 CA--C 1.548 0.894 0 O-C-N 121.137 -0.977 . . . . 0.0 113.428 -176.577 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 55.0 m170 -120.68 87.36 41.85 Favored Pre-proline 0 CA--C 1.552 1.037 0 C-N-CA 125.843 1.657 . . . . 0.0 110.623 179.854 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_endo -61.57 146.57 96.8 Favored 'Trans proline' 0 CA--C 1.539 0.768 0 C-N-CA 123.552 2.835 . . . . 0.0 115.014 -177.683 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 53.6 p -84.64 -174.7 5.42 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 125.148 1.379 . . . . 0.0 112.266 175.714 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -60.75 -22.12 63.71 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 125.712 1.605 . . . . 0.0 113.67 174.355 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 66.7 p -109.16 -19.75 13.23 Favored 'General case' 0 N--CA 1.478 0.94 0 N-CA-C 114.413 1.264 . . . . 0.0 114.413 179.444 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 98.4 m -60.51 129.87 43.77 Favored 'General case' 0 CA--C 1.542 0.667 0 CA-C-N 119.723 1.147 . . . . 0.0 112.54 179.296 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 48.6 tt0 -83.46 133.76 34.89 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 124.815 1.246 . . . . 0.0 110.395 178.904 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 21.5 t -116.9 141.94 32.9 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.929 0 C-N-CA 125.525 1.53 . . . . 0.0 109.939 -177.719 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 74.5 mm-40 -142.63 125.67 16.29 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 125.239 1.416 . . . . 0.0 111.303 -179.175 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 63.6 t30 42.17 38.16 1.06 Allowed 'General case' 0 CA--C 1.555 1.152 0 N-CA-C 116.708 2.114 . . . . 0.0 116.708 175.718 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 88.62 14.9 60.74 Favored Glycine 0 CA--C 1.536 1.398 0 O-C-N 120.869 -1.144 . . . . 0.0 115.082 -179.656 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 48.3 mtt-85 -139.82 168.48 19.73 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 126.341 1.857 . . . . 0.0 112.099 -178.988 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 3.5 m -139.85 138.17 38.6 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.539 0 C-N-CA 126.947 2.099 . . . . 0.0 109.491 179.636 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 70.8 mt -86.21 135.66 24.57 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.783 0 O-C-N 120.992 -1.068 . . . . 0.0 109.451 179.955 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -80.75 150.08 29.4 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 123.66 0.784 . . . . 0.0 112.454 178.687 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 7.5 t -70.09 94.16 0.86 Allowed 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 126.183 1.793 . . . . 0.0 110.135 -179.479 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 29.5 p90 -56.41 -37.66 70.48 Favored 'General case' 0 N--CA 1.471 0.587 0 O-C-N 121.069 -1.019 . . . . 0.0 112.118 -179.738 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 -60.45 -29.16 68.85 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 123.452 0.701 . . . . 0.0 112.276 177.623 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 47.8 p -71.14 -37.87 72.27 Favored 'General case' 0 N--CA 1.471 0.58 0 O-C-N 121.079 -1.013 . . . . 0.0 111.757 177.035 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 69.8 mt -74.16 -42.82 59.32 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.416 1.086 . . . . 0.0 111.876 176.74 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 31.2 mmmt -74.13 -11.96 60.45 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 124.766 1.227 . . . . 0.0 113.795 179.836 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 80.48 41.22 11.65 Favored Glycine 0 CA--C 1.536 1.355 0 C-N-CA 124.449 1.023 . . . . 0.0 114.052 178.462 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 48.4 ttp180 -127.06 -18.65 4.55 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 126.264 1.826 . . . . 0.0 114.834 -176.694 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 8.4 t -67.46 151.18 47.84 Favored 'General case' 0 CA--C 1.548 0.87 0 CA-C-N 119.286 0.948 . . . . 0.0 112.538 -179.818 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 88.4 p -149.13 2.43 0.57 Allowed 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 126.167 1.787 . . . . 0.0 114.036 -179.603 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 86.3 mtm-85 -88.45 175.12 7.74 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 126.551 1.941 . . . . 0.0 112.56 179.783 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -138.8 24.53 2.6 Favored 'General case' 0 CA--C 1.551 1.01 0 C-N-CA 126.772 2.029 . . . . 0.0 109.749 174.02 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 6.7 p-10 -147.54 10.89 0.97 Allowed 'General case' 0 CA--C 1.547 0.85 0 N-CA-C 115.577 1.695 . . . . 0.0 115.577 -173.789 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 3.8 m -50.03 148.17 3.5 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.805 1.242 . . . . 0.0 113.495 -178.355 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 22.6 mtmt -78.29 6.94 7.19 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 123.152 0.581 . . . . 0.0 111.918 173.485 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 58.0 m-85 -127.55 150.85 49.51 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 126.698 1.999 . . . . 0.0 111.214 -174.149 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -79.17 126.89 31.33 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 124.048 0.939 . . . . 0.0 113.285 -175.445 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 38.1 m170 -75.5 115.49 46.15 Favored Pre-proline 0 CA--C 1.548 0.872 0 N-CA-C 106.717 -1.586 . . . . 0.0 106.717 170.496 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 81.7 Cg_exo -53.2 122.52 11.31 Favored 'Trans proline' 0 CA--C 1.543 0.955 0 C-N-CA 123.659 2.906 . . . . 0.0 115.146 -175.552 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_endo -77.91 155.03 30.2 Favored 'Trans proline' 0 CA--C 1.542 0.908 0 C-N-CA 122.226 1.951 . . . . 0.0 111.119 177.5 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 80.4 Cg_exo -45.32 -37.12 13.68 Favored 'Trans proline' 0 CA--C 1.538 0.724 0 C-N-CA 124.306 3.337 . . . . 0.0 115.848 179.214 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 76.4 m80 -78.66 -13.21 59.94 Favored 'General case' 0 N--CA 1.474 0.729 0 N-CA-C 115.336 1.606 . . . . 0.0 115.336 -179.898 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 50.8 mt -118.7 -9.64 10.16 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.617 1.167 . . . . 0.0 113.252 177.732 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 56.3 mtpt -55.84 -39.2 71.08 Favored 'General case' 0 N--CA 1.481 1.096 0 CA-C-N 120.293 1.406 . . . . 0.0 110.098 171.209 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 20.4 m -62.63 -41.44 99.02 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 124.423 1.089 . . . . 0.0 111.463 175.026 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 47.2 tp60 -66.2 -42.34 88.94 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 124.311 1.044 . . . . 0.0 110.929 178.185 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 27.6 mt -67.74 -42.3 82.07 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-O 118.516 -0.754 . . . . 0.0 112.597 178.054 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 3.1 pt-20 -64.01 -36.83 85.28 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-N 119.869 1.213 . . . . 0.0 111.056 175.665 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 64.2 mt -63.06 -42.91 98.43 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.721 0 CA-C-N 118.97 0.805 . . . . 0.0 109.812 175.332 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 60.0 m-20 -60.97 -48.14 83.2 Favored 'General case' 0 CA--C 1.545 0.783 0 CA-C-N 118.495 0.589 . . . . 0.0 110.28 175.724 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -59.95 -46.25 94.46 Favored Glycine 0 N--CA 1.471 0.991 0 C-N-CA 124.955 1.265 . . . . 0.0 112.51 179.076 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 58.2 mtp180 -60.46 -13.53 14.15 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 125.832 1.653 . . . . 0.0 113.653 175.692 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 53.8 m-80 -114.42 7.57 16.33 Favored 'General case' 0 CA--C 1.553 1.084 0 C-N-CA 125.977 1.711 . . . . 0.0 112.462 177.738 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 28.7 t30 -121.35 -36.8 3.02 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 126.148 1.779 . . . . 0.0 112.221 179.609 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 68.9 mt -81.5 4.18 22.14 Favored 'General case' 0 CA--C 1.551 1.012 0 C-N-CA 126.422 1.889 . . . . 0.0 113.202 178.585 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 41.3 pt -57.62 157.71 1.42 Allowed 'Isoleucine or valine' 0 C--O 1.238 0.466 0 C-N-CA 127.679 2.391 . . . . 0.0 114.968 -177.916 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 5.9 tp-100 -59.76 138.81 57.67 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 124.991 1.316 . . . . 0.0 110.412 175.895 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 6.2 pt20 -147.96 2.91 0.7 Allowed 'General case' 0 CA--C 1.547 0.844 0 N-CA-C 114.827 1.417 . . . . 0.0 114.827 -176.066 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 63.7 tttp -64.77 144.18 57.43 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 124.786 1.234 . . . . 0.0 111.068 176.353 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 44.8 t30 . . . . . 0 CA--C 1.544 0.733 0 C-N-CA 124.429 1.092 . . . . 0.0 112.443 178.744 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.6 mmt . . . . . 0 CA--C 1.544 0.713 0 N-CA-C 113.217 0.821 . . . . 0.0 113.217 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -139.21 14.73 2.61 Favored 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 125.995 1.718 . . . . 0.0 113.31 -179.283 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 30.4 m -67.04 -15.38 19.55 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.145 0 C-N-CA 125.209 1.404 . . . . 0.0 114.527 -179.561 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 85.0 p -151.56 167.1 29.14 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 126.032 1.733 . . . . 0.0 111.711 179.582 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 27.2 m -131.06 2.03 2.02 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.263 0 C-N-CA 124.938 1.295 . . . . 0.0 114.277 -178.242 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 36.0 p -144.31 153.9 56.52 Favored Pre-proline 0 N--CA 1.48 1.047 0 C-N-CA 125.691 1.596 . . . . 0.0 111.047 178.199 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 95.9 Cg_endo -71.71 175.31 9.77 Favored 'Trans proline' 0 CA--C 1.54 0.81 0 C-N-CA 123.427 2.751 . . . . 0.0 112.852 179.596 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 50.3 pt -67.77 -8.59 9.0 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.022 0 N-CA-C 114.662 1.356 . . . . 0.0 114.662 178.928 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 19.8 mmm180 -57.41 117.84 4.54 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 125.955 1.702 . . . . 0.0 113.287 -179.505 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -63.54 -28.88 70.25 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 123.394 0.678 . . . . 0.0 111.637 175.169 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 32.6 p -74.18 5.55 4.32 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 126.071 1.748 . . . . 0.0 114.238 177.29 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 19.0 ptpt -51.07 -31.82 20.05 Favored 'General case' 0 N--CA 1.481 1.108 0 CA-C-N 120.555 1.525 . . . . 0.0 114.859 -179.424 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -78.93 -24.71 43.83 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 123.945 0.898 . . . . 0.0 112.992 176.945 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 71.3 mt -98.08 -18.3 18.61 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 126.536 1.934 . . . . 0.0 114.659 -177.119 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 6.5 m -77.19 77.76 3.73 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 124.508 1.123 . . . . 0.0 110.68 -178.01 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -75.7 143.43 42.13 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 129.022 2.929 . . . . 0.0 111.843 -177.758 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 52.3 mt-10 -71.08 151.29 44.67 Favored 'General case' 0 N--CA 1.472 0.651 0 O-C-N 120.695 -1.253 . . . . 0.0 112.386 177.212 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 15.7 m -84.11 155.79 3.66 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.03 0 C-N-CA 123.277 0.631 . . . . 0.0 111.286 174.04 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 52.8 t -75.59 133.34 40.95 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-O 121.852 0.834 . . . . 0.0 111.199 176.924 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 3.1 mpt_? -69.59 -26.62 64.54 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 124.716 1.207 . . . . 0.0 112.91 -178.876 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -82.79 -36.54 25.53 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 122.966 0.506 . . . . 0.0 109.906 177.353 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 61.3 t80 -65.27 -34.41 78.27 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 124.245 1.018 . . . . 0.0 110.344 175.161 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 12.0 mm100 -63.11 -14.2 45.62 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 124.527 1.131 . . . . 0.0 112.86 173.791 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 81.9 mtt85 -119.16 10.17 11.99 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 127.091 2.156 . . . . 0.0 112.083 -179.845 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 57.34 35.14 70.01 Favored Glycine 0 CA--C 1.534 1.26 0 C-N-CA 125.528 1.537 . . . . 0.0 114.304 -179.637 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 4.8 t -134.65 6.08 3.45 Favored 'General case' 0 N--CA 1.477 0.91 0 N-CA-C 115.205 1.557 . . . . 0.0 115.205 -174.604 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 17.6 t -58.82 128.65 38.28 Favored 'General case' 0 CA--C 1.547 0.835 0 O-C-N 120.938 -1.101 . . . . 0.0 111.037 177.374 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 78.5 p -83.92 6.55 21.31 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 125.616 1.567 . . . . 0.0 114.346 -178.371 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 61.6 mtm-85 -131.35 145.22 56.7 Favored Pre-proline 0 N--CA 1.471 0.618 0 C-N-CA 125.421 1.488 . . . . 0.0 113.979 -172.991 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 98.1 Cg_endo -70.29 166.19 29.08 Favored 'Trans proline' 0 CA--C 1.544 1.001 0 C-N-CA 122.225 1.95 . . . . 0.0 109.816 171.074 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -54.28 -29.23 46.44 Favored 'General case' 0 N--CA 1.476 0.843 0 O-C-N 121.142 -0.973 . . . . 0.0 113.423 176.692 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 30.6 p -73.82 -13.22 60.9 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 125.873 1.669 . . . . 0.0 115.092 178.9 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 29.9 mm-40 -115.94 -29.85 6.23 Favored 'General case' 0 N--CA 1.478 0.926 0 N-CA-C 115.182 1.549 . . . . 0.0 115.182 -177.073 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 4.1 t -65.12 166.5 9.48 Favored 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 115.499 1.666 . . . . 0.0 115.499 -173.883 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.36 -13.03 47.67 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 127.391 2.277 . . . . 0.0 112.524 -179.324 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 57.8 m-85 -137.67 175.97 9.12 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 126.383 1.873 . . . . 0.0 110.237 -179.296 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -83.55 150.89 25.67 Favored 'General case' 0 CA--C 1.544 0.726 0 N-CA-C 113.725 1.009 . . . . 0.0 113.725 -177.487 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 66.0 m170 -122.19 85.85 46.99 Favored Pre-proline 0 CA--C 1.55 0.975 0 C-N-CA 126.116 1.766 . . . . 0.0 111.001 -179.624 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_endo -63.09 144.93 93.52 Favored 'Trans proline' 0 C--N 1.351 0.709 0 C-N-CA 123.402 2.735 . . . . 0.0 114.694 -177.841 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 59.9 p -82.83 -175.76 5.96 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 124.608 1.163 . . . . 0.0 111.906 174.909 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 75.2 mmtt -61.1 -19.91 62.02 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 125.497 1.519 . . . . 0.0 113.481 173.524 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 68.6 p -109.17 -18.22 13.67 Favored 'General case' 0 N--CA 1.477 0.884 0 N-CA-C 114.863 1.431 . . . . 0.0 114.863 -179.594 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 91.2 m -62.74 139.66 58.69 Favored 'General case' 0 CA--C 1.543 0.694 0 CA-C-N 119.576 1.08 . . . . 0.0 113.723 -179.61 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 47.2 tp60 -80.76 130.03 34.85 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 125.422 1.489 . . . . 0.0 110.371 178.235 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 9.9 t -126.52 137.2 58.53 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.022 0 C-N-CA 125.324 1.45 . . . . 0.0 110.509 -178.012 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -147.07 130.89 17.04 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 125.293 1.437 . . . . 0.0 111.745 178.512 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 62.2 t30 40.12 38.85 0.55 Allowed 'General case' 0 CA--C 1.553 1.065 0 C-N-CA 127.211 2.204 . . . . 0.0 116.758 176.802 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 90.12 11.54 62.96 Favored Glycine 0 CA--C 1.537 1.42 0 O-C-N 121.016 -1.053 . . . . 0.0 115.299 179.41 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 44.7 mtm180 -135.91 164.36 28.13 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 125.622 1.569 . . . . 0.0 112.038 179.78 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 8.2 m -139.29 149.19 23.09 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.573 0 C-N-CA 127.581 2.352 . . . . 0.0 109.413 -179.628 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 40.2 mt -97.54 129.42 47.69 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.913 0 O-C-N 121.018 -1.051 . . . . 0.0 110.651 -177.527 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -74.58 145.76 43.1 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 124.125 0.97 . . . . 0.0 111.406 177.206 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 13.2 t -69.47 99.61 1.27 Allowed 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 124.828 1.251 . . . . 0.0 113.175 -176.683 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 41.3 p90 -61.89 -38.92 90.15 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 115.157 -0.929 . . . . 0.0 110.29 175.299 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 65.9 m-20 -60.79 -41.3 95.3 Favored 'General case' 0 CA--C 1.54 0.577 0 O-C-N 121.787 -0.571 . . . . 0.0 110.836 176.78 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 43.8 t -65.09 -41.76 94.72 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-N 119.548 1.067 . . . . 0.0 111.347 177.269 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 31.1 mt -65.41 -41.9 93.13 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 124.009 0.923 . . . . 0.0 112.923 176.492 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 31.4 mmmt -78.33 -12.59 60.01 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 124.948 1.299 . . . . 0.0 113.753 179.325 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 84.03 39.27 9.45 Favored Glycine 0 CA--C 1.536 1.395 0 C-N-CA 124.639 1.114 . . . . 0.0 114.078 179.281 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 50.4 tpt85 -123.09 -23.3 4.97 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 126.44 1.896 . . . . 0.0 114.879 -177.075 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 6.5 t -64.24 131.5 47.56 Favored 'General case' 0 CA--C 1.543 0.709 0 CA-C-N 119.437 1.017 . . . . 0.0 112.895 -176.829 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 48.4 m -141.86 12.0 2.04 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 126.765 2.026 . . . . 0.0 112.234 179.868 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 76.2 mtm-85 -73.48 155.95 38.71 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 125.741 1.617 . . . . 0.0 113.341 -178.135 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 35.7 mm-40 -111.95 -2.31 15.17 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 125.796 1.638 . . . . 0.0 112.275 176.398 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 28.6 m120 -143.13 32.43 1.36 Allowed 'General case' 0 CA--C 1.552 1.02 0 C-N-CA 127.303 2.241 . . . . 0.0 110.916 -177.749 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 8.0 t -51.76 132.79 31.61 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 125.973 1.709 . . . . 0.0 112.219 -177.465 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 26.1 mtmt -90.12 4.08 51.46 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 124.42 1.088 . . . . 0.0 113.365 -179.297 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 85.3 m-85 -120.91 148.85 43.5 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 122.052 0.93 . . . . 0.0 112.375 -174.409 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -73.01 114.27 10.97 Favored 'General case' 0 N--CA 1.464 0.271 0 C-N-CA 123.896 0.878 . . . . 0.0 111.566 -176.879 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 13.2 m170 -71.37 114.61 29.34 Favored Pre-proline 0 CA--C 1.548 0.87 0 N-CA-C 107.382 -1.34 . . . . 0.0 107.382 174.557 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 65.9 Cg_exo -48.74 116.45 2.14 Favored 'Trans proline' 0 CA--C 1.542 0.921 0 C-N-CA 124.611 3.54 . . . . 0.0 116.975 -174.096 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -75.99 149.36 32.71 Favored 'Trans proline' 0 CA--C 1.545 1.044 0 C-N-CA 122.265 1.977 . . . . 0.0 110.518 174.937 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_exo -46.16 -41.04 21.79 Favored 'Trans proline' 0 CA--C 1.537 0.674 0 C-N-CA 124.068 3.179 . . . . 0.0 115.685 -179.789 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 13.8 t-80 -69.38 -17.28 63.66 Favored 'General case' 0 N--CA 1.474 0.765 0 N-CA-C 114.984 1.476 . . . . 0.0 114.984 179.761 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 93.2 mt -112.85 -16.95 12.63 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 124.367 1.067 . . . . 0.0 113.029 178.197 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 54.7 mtpt -54.56 -37.43 65.45 Favored 'General case' 0 N--CA 1.478 0.973 0 CA-C-N 119.791 1.178 . . . . 0.0 111.623 174.798 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 21.9 m -62.24 -41.76 98.72 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 123.731 0.812 . . . . 0.0 111.495 176.469 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 16.5 mm100 -69.67 -45.33 68.6 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 123.734 0.814 . . . . 0.0 110.898 178.324 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 89.4 mt -62.69 -46.2 89.25 Favored 'General case' 0 N--CA 1.466 0.345 0 C-N-CA 124.077 0.951 . . . . 0.0 112.423 178.738 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -64.91 -36.94 85.98 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-N 119.651 1.114 . . . . 0.0 112.28 178.97 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 63.7 mt -65.21 -45.43 93.82 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.707 0 CA-C-N 118.803 0.729 . . . . 0.0 110.064 176.176 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 24.5 m-80 -64.01 -38.82 92.48 Favored 'General case' 0 CA--C 1.54 0.587 0 O-C-N 121.627 -0.67 . . . . 0.0 111.456 176.645 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -66.23 -49.92 54.28 Favored Glycine 0 CA--C 1.529 0.907 0 C-N-CA 123.948 0.785 . . . . 0.0 111.959 177.977 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 72.6 mtp85 -54.88 -33.8 62.32 Favored 'General case' 0 N--CA 1.48 1.035 0 CA-C-N 118.806 1.303 . . . . 0.0 112.953 178.223 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 35.9 m-80 -76.09 -2.15 29.45 Favored 'General case' 0 CA--C 1.552 1.049 0 C-N-CA 125.016 1.326 . . . . 0.0 114.173 176.423 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 53.0 m-80 -126.84 -35.3 2.31 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 125.332 1.453 . . . . 0.0 113.679 -179.94 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -78.08 -11.83 59.94 Favored 'General case' 0 CA--C 1.546 0.803 0 CA-C-N 119.381 0.991 . . . . 0.0 113.199 176.869 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 23.7 pt 0.95 68.31 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.483 1.18 0 C-N-CA 131.092 3.757 . . . . 0.0 117.376 -178.717 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 44.6 tt0 -156.37 161.79 40.11 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 126.767 2.027 . . . . 0.0 109.987 179.677 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -139.44 160.82 38.94 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 125.632 1.573 . . . . 0.0 112.389 -179.988 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 60.8 tttp -62.07 -35.04 77.45 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 125.193 1.397 . . . . 0.0 114.258 -178.727 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 48.4 t-20 . . . . . 0 CA--C 1.54 0.593 0 C-N-CA 125.099 1.359 . . . . 0.0 111.64 -179.547 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.541 0.615 0 N-CA-C 113.964 1.098 . . . . 0.0 113.964 . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -55.29 -23.66 24.37 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 125.433 1.493 . . . . 0.0 114.572 -179.643 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 34.5 m -62.08 -17.6 18.11 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.878 0 C-N-CA 125.19 1.396 . . . . 0.0 113.75 176.986 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 47.4 m -57.71 -15.68 8.61 Favored 'General case' 0 N--CA 1.476 0.836 0 N-CA-C 115.157 1.54 . . . . 0.0 115.157 -179.692 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 27.5 m -60.32 -23.63 28.47 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.987 0 C-N-CA 124.586 1.154 . . . . 0.0 113.856 178.192 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 18.0 p -140.52 105.7 6.47 Favored Pre-proline 0 N--CA 1.475 0.805 0 C-N-CA 125.037 1.335 . . . . 0.0 110.591 178.811 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 94.9 Cg_endo -73.26 -14.16 25.6 Favored 'Trans proline' 0 C--N 1.352 0.761 0 C-N-CA 123.488 2.792 . . . . 0.0 115.207 -177.092 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 19.3 pt -56.97 -17.51 5.69 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.927 0 C-N-CA 126.035 1.734 . . . . 0.0 114.486 -179.171 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 37.0 mtt180 -58.06 -32.98 68.54 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 125.555 1.542 . . . . 0.0 111.665 176.281 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -72.96 -12.6 61.0 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 125.502 1.521 . . . . 0.0 113.774 178.201 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 38.7 p -124.57 5.23 8.26 Favored 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 125.682 1.593 . . . . 0.0 113.56 -179.179 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 83.0 tttt -43.21 -41.98 4.07 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 126.919 2.088 . . . . 0.0 115.335 -178.284 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 1.8 p90 -91.8 -8.22 47.32 Favored 'General case' 0 N--CA 1.474 0.73 0 N-CA-C 114.468 1.284 . . . . 0.0 114.468 -178.773 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 88.4 mt -95.84 -18.19 20.56 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 125.688 1.595 . . . . 0.0 114.766 -175.849 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 2.5 m -75.44 77.35 2.49 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 124.454 1.102 . . . . 0.0 111.898 -178.604 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -75.86 144.63 41.1 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 127.178 2.191 . . . . 0.0 111.534 -179.822 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 11.5 mt-10 -73.57 151.11 41.03 Favored 'General case' 0 N--CA 1.472 0.668 0 O-C-N 120.563 -1.336 . . . . 0.0 111.402 176.014 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 12.3 m -82.82 145.88 7.85 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.789 0 N-CA-C 108.543 -0.91 . . . . 0.0 108.543 173.237 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 42.0 t -60.21 127.52 32.25 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-O 121.687 0.756 . . . . 0.0 111.213 179.643 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 3.6 mpt_? -60.06 -31.69 70.23 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 124.976 1.311 . . . . 0.0 112.94 -176.585 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 28.9 mm-40 -81.44 -34.86 31.23 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 123.343 0.657 . . . . 0.0 110.777 177.782 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 51.3 t80 -63.99 -24.92 67.9 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 124.364 1.066 . . . . 0.0 111.383 173.942 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 80.7 mt-30 -58.86 -23.9 61.45 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 123.533 0.733 . . . . 0.0 112.919 176.003 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -117.24 13.06 14.56 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 125.508 1.523 . . . . 0.0 111.943 176.895 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 62.06 37.5 94.55 Favored Glycine 0 CA--C 1.533 1.204 0 C-N-CA 125.014 1.293 . . . . 0.0 113.986 -178.937 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 7.2 t -127.24 18.46 7.03 Favored 'General case' 0 N--CA 1.479 1.001 0 N-CA-C 114.688 1.366 . . . . 0.0 114.688 -176.28 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 14.5 t -67.32 172.04 5.26 Favored 'General case' 0 CA--C 1.558 1.279 0 O-C-N 121.572 -0.705 . . . . 0.0 110.319 172.733 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 90.4 p -132.26 8.48 4.33 Favored 'General case' 0 N--CA 1.477 0.897 0 N-CA-C 115.088 1.514 . . . . 0.0 115.088 -176.001 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 62.3 mtm-85 -133.23 146.84 62.64 Favored Pre-proline 0 N--CA 1.471 0.62 0 C-N-CA 125.557 1.543 . . . . 0.0 112.424 -178.098 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 77.6 Cg_endo -69.28 166.74 25.96 Favored 'Trans proline' 0 CA--C 1.543 0.963 0 C-N-CA 121.95 1.767 . . . . 0.0 109.61 171.352 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -53.9 -30.98 48.49 Favored 'General case' 0 N--CA 1.477 0.879 0 O-C-N 121.034 -1.041 . . . . 0.0 112.91 176.781 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 40.5 p -72.94 -6.52 45.79 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 125.93 1.692 . . . . 0.0 115.015 178.637 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 18.5 mt-10 -128.08 -24.17 3.2 Favored 'General case' 0 N--CA 1.477 0.907 0 N-CA-C 115.333 1.605 . . . . 0.0 115.333 -177.773 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 3.1 t -70.18 166.28 20.3 Favored 'General case' 0 CA--C 1.546 0.791 0 N-CA-C 114.979 1.474 . . . . 0.0 114.979 -176.556 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 13.2 mmmm -83.37 -11.42 57.64 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 127.057 2.143 . . . . 0.0 113.1 179.557 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 77.0 m-85 -140.43 173.79 11.16 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 126.417 1.887 . . . . 0.0 110.763 -178.125 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -80.17 152.94 28.93 Favored 'General case' 0 CA--C 1.545 0.778 0 O-C-N 121.224 -0.923 . . . . 0.0 113.224 -178.642 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 61.3 m170 -127.04 90.16 50.13 Favored Pre-proline 0 CA--C 1.552 1.039 0 C-N-CA 125.718 1.607 . . . . 0.0 110.307 179.398 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 33.9 Cg_endo -63.19 165.76 16.31 Favored 'Trans proline' 0 CA--C 1.541 0.85 0 C-N-CA 123.685 2.923 . . . . 0.0 114.903 -178.223 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 85.7 p -128.1 -174.22 3.15 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 126.385 1.874 . . . . 0.0 112.687 178.928 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 61.9 pttt -38.53 -37.51 0.32 Allowed 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 128.823 2.849 . . . . 0.0 117.902 -178.216 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 33.1 p -109.19 -16.4 14.09 Favored 'General case' 0 N--CA 1.476 0.842 0 N-CA-C 115.028 1.492 . . . . 0.0 115.028 -177.898 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 80.4 m -61.21 128.3 35.73 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 124.319 1.048 . . . . 0.0 113.33 -177.764 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 44.6 tt0 -81.71 128.96 34.53 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 125.329 1.452 . . . . 0.0 110.008 178.105 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 17.6 t -122.42 134.07 66.74 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.918 0 C-N-CA 125.489 1.515 . . . . 0.0 109.663 -178.226 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -142.92 130.83 21.64 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 125.142 1.377 . . . . 0.0 110.703 -179.576 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 46.1 36.14 2.95 Favored 'General case' 0 CA--C 1.555 1.148 0 C-N-CA 126.177 1.791 . . . . 0.0 115.169 179.47 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 80.54 19.41 68.62 Favored Glycine 0 CA--C 1.537 1.429 0 O-C-N 120.969 -1.082 . . . . 0.0 114.66 -179.592 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 45.3 mtt180 -137.14 161.25 36.66 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 125.901 1.68 . . . . 0.0 111.179 -179.292 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 3.0 m -138.17 137.75 43.96 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.512 0 C-N-CA 127.143 2.177 . . . . 0.0 109.647 -176.877 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 75.8 mt -87.67 131.04 36.37 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.743 0 O-C-N 121.083 -1.011 . . . . 0.0 109.294 179.273 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -73.84 149.27 41.71 Favored 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 123.91 0.884 . . . . 0.0 111.926 177.694 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 8.0 t -67.38 95.64 0.46 Allowed 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 125.19 1.396 . . . . 0.0 111.681 -177.909 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 22.2 p90 -58.16 -36.63 73.3 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 123.673 0.789 . . . . 0.0 111.176 177.817 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 73.1 m-20 -61.02 -34.89 75.55 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 123.099 0.56 . . . . 0.0 111.863 177.137 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 25.3 p -68.51 -41.61 79.74 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-N 119.019 0.827 . . . . 0.0 111.666 177.4 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 38.5 mt -71.5 -40.24 70.32 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 125.183 1.393 . . . . 0.0 113.187 178.165 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . 0.411 ' HE2' ' HA ' ' A' ' 58' ' ' LYS . 11.3 mmpt? -83.46 -10.23 58.5 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 124.794 1.238 . . . . 0.0 114.122 -179.21 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 82.02 39.19 11.88 Favored Glycine 0 CA--C 1.536 1.396 0 C-N-CA 124.319 0.961 . . . . 0.0 114.725 177.773 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 6.9 tpm_? -124.41 -9.78 7.47 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 126.186 1.794 . . . . 0.0 113.863 -178.272 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -56.76 125.12 20.93 Favored 'General case' 0 CA--C 1.544 0.712 0 CA-C-N 119.22 0.918 . . . . 0.0 112.544 -177.349 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 14.7 m -137.93 32.08 2.44 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 126.282 1.833 . . . . 0.0 111.875 -174.658 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 84.0 mtm-85 -130.71 174.11 10.26 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 126.38 1.872 . . . . 0.0 113.418 -175.694 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 76.5 mm-40 -137.83 23.23 2.86 Favored 'General case' 0 CA--C 1.555 1.142 0 C-N-CA 127.65 2.38 . . . . 0.0 109.219 174.075 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 5.5 p-10 -151.67 21.73 0.7 Allowed 'General case' 0 CA--C 1.549 0.94 0 C-N-CA 126.11 1.764 . . . . 0.0 115.075 -171.386 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 38.9 m -51.21 145.01 8.51 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 124.205 1.002 . . . . 0.0 113.696 -178.254 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 24.6 mtmt -88.81 7.79 32.29 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 123.817 0.847 . . . . 0.0 111.682 173.375 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 63.7 m-85 -127.14 148.72 50.16 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 125.818 1.647 . . . . 0.0 111.641 -172.488 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -74.17 117.19 15.69 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 124.168 0.987 . . . . 0.0 113.06 -175.951 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 6.3 m170 -65.21 129.96 94.62 Favored Pre-proline 0 CA--C 1.547 0.835 0 N-CA-C 106.612 -1.625 . . . . 0.0 106.612 170.776 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 83.3 Cg_endo -72.11 120.6 6.91 Favored 'Trans proline' 0 CA--C 1.545 1.057 0 C-N-CA 122.562 2.175 . . . . 0.0 113.142 -172.338 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -75.66 150.85 35.92 Favored 'Trans proline' 0 CA--C 1.541 0.87 0 C-N-CA 122.884 2.39 . . . . 0.0 111.063 178.021 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 84.9 Cg_exo -47.23 -39.01 26.64 Favored 'Trans proline' 0 CA--C 1.537 0.668 0 C-N-CA 123.863 3.042 . . . . 0.0 115.257 179.592 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 7.5 t-80 -69.36 -17.72 63.72 Favored 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 115.057 1.503 . . . . 0.0 115.057 179.452 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 93.4 mt -114.55 -15.61 11.99 Favored 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 124.854 1.262 . . . . 0.0 112.953 178.224 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 57.0 mtpt -54.89 -35.4 64.07 Favored 'General case' 0 N--CA 1.477 0.876 0 CA-C-N 119.736 1.153 . . . . 0.0 111.149 173.591 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 15.3 m -63.3 -41.23 98.94 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 123.902 0.881 . . . . 0.0 111.699 175.917 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 91.0 mm-40 -70.4 -44.44 67.98 Favored 'General case' 0 N--CA 1.468 0.452 0 O-C-N 121.268 -0.895 . . . . 0.0 111.05 177.281 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 95.5 mt -62.5 -40.48 96.86 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 123.748 0.819 . . . . 0.0 111.529 177.629 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 8.2 mm-40 -52.02 -56.12 16.28 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 124.884 1.274 . . . . 0.0 110.639 174.331 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 72.9 mt -68.79 -45.66 80.62 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.25 0 C-N-CA 125.798 1.639 . . . . 0.0 111.977 -173.781 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 38.5 m-80 -64.25 -34.64 78.57 Favored 'General case' 0 CA--C 1.542 0.645 0 CA-C-N 119.069 0.85 . . . . 0.0 111.501 175.878 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -70.25 -52.16 19.01 Favored Glycine 0 CA--C 1.528 0.886 0 C-N-CA 123.684 0.659 . . . . 0.0 111.663 176.738 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 53.0 mtp180 -58.04 -36.18 72.38 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 124.66 1.184 . . . . 0.0 112.485 177.869 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 88.3 m-20 -66.94 -9.59 40.06 Favored 'General case' 0 CA--C 1.551 0.994 0 N-CA-C 113.918 1.081 . . . . 0.0 113.918 175.438 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 58.3 m-80 -120.99 -19.71 7.12 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 125.578 1.551 . . . . 0.0 113.147 178.907 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 47.1 tp -65.28 -24.55 67.34 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 125.814 1.646 . . . . 0.0 112.796 177.826 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 31.2 pt -55.74 150.39 2.63 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.544 0 C-N-CA 127.134 2.173 . . . . 0.0 113.192 178.088 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 78.1 mt-30 -130.74 8.73 4.92 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 125.504 1.521 . . . . 0.0 113.492 -178.932 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 14.5 pt20 -71.13 166.63 21.04 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 125.111 1.364 . . . . 0.0 113.408 178.982 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 8.7 mptt -135.73 160.31 38.93 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 126.23 1.812 . . . . 0.0 110.947 178.31 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 47.2 t-20 . . . . . 0 CA--C 1.542 0.64 0 C-N-CA 125.267 1.427 . . . . 0.0 111.465 -179.841 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.6 ttt . . . . . 0 CA--C 1.545 0.757 0 N-CA-C 112.834 0.679 . . . . 0.0 112.834 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -118.91 5.79 11.41 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 126.09 1.756 . . . . 0.0 113.344 179.722 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 26.9 m -130.4 6.38 2.16 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.197 0 C-N-CA 126.344 1.857 . . . . 0.0 113.02 -179.218 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 63.3 p -121.88 -0.37 9.58 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 125.94 1.696 . . . . 0.0 114.758 -176.995 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 27.4 m -132.44 24.16 1.42 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.199 0 C-N-CA 126.358 1.863 . . . . 0.0 112.497 -178.743 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 41.0 p -58.66 153.46 40.96 Favored Pre-proline 0 N--CA 1.477 0.898 0 C-N-CA 126.307 1.843 . . . . 0.0 113.08 179.739 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -64.0 -15.7 50.69 Favored 'Trans proline' 0 CA--C 1.539 0.749 0 C-N-CA 123.156 2.57 . . . . 0.0 115.311 -178.705 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 45.1 pt -79.19 33.56 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.547 0.848 0 C-N-CA 126.16 1.784 . . . . 0.0 113.987 179.872 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 6.9 mmp_? -52.63 127.35 22.67 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 125.218 1.407 . . . . 0.0 110.856 178.136 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -62.85 145.42 55.1 Favored 'General case' 0 CA--C 1.543 0.696 0 CA-C-O 121.698 0.761 . . . . 0.0 113.001 -179.947 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 32.4 p -134.73 -0.67 2.83 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 126.25 1.82 . . . . 0.0 112.797 177.331 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 20.9 ttmt -54.23 -44.98 72.18 Favored 'General case' 0 N--CA 1.478 0.974 0 CA-C-N 120.077 1.308 . . . . 0.0 111.701 178.41 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -69.54 -25.43 64.01 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 124.541 1.137 . . . . 0.0 113.376 178.003 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 94.7 mt -91.93 -17.52 25.06 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 126.061 1.744 . . . . 0.0 114.762 -177.32 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 17.1 m -78.49 74.7 5.02 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 124.567 1.147 . . . . 0.0 111.534 -177.717 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 10.4 tp -75.8 147.63 39.05 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 127.399 2.28 . . . . 0.0 112.039 -178.647 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 9.5 mt-10 -73.46 150.84 41.35 Favored 'General case' 0 N--CA 1.473 0.684 0 O-C-N 120.54 -1.35 . . . . 0.0 113.095 179.351 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 17.9 m -82.67 153.25 3.93 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.768 0 C-N-CA 122.833 0.453 . . . . 0.0 111.212 175.201 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 48.2 t -74.29 135.43 42.6 Favored 'General case' 0 CA--C 1.539 0.526 0 N-CA-C 109.766 -0.457 . . . . 0.0 109.766 174.911 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 5.3 mpt_? -71.99 -41.21 67.93 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 125.203 1.401 . . . . 0.0 112.856 -177.087 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 17.1 mm-40 -72.69 -33.72 66.7 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 124.414 1.086 . . . . 0.0 111.773 179.969 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 83.5 t80 -62.18 -26.62 68.44 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 124.093 0.957 . . . . 0.0 111.759 175.29 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 77.4 mm-40 -60.61 -20.92 61.96 Favored 'General case' 0 N--CA 1.478 0.926 0 N-CA-C 113.637 0.977 . . . . 0.0 113.637 176.79 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -117.06 13.72 14.85 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 125.693 1.597 . . . . 0.0 112.106 177.083 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 59.14 36.8 90.2 Favored Glycine 0 CA--C 1.533 1.203 0 C-N-CA 125.092 1.329 . . . . 0.0 114.145 -179.78 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 7.2 t -127.54 13.18 7.0 Favored 'General case' 0 N--CA 1.479 1.01 0 N-CA-C 114.48 1.289 . . . . 0.0 114.48 -175.941 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 27.9 t -62.96 137.6 58.31 Favored 'General case' 0 CA--C 1.551 1.004 0 O-C-N 121.435 -0.79 . . . . 0.0 111.749 177.283 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 32.7 m -77.46 -2.99 38.14 Favored 'General case' 0 N--CA 1.475 0.814 0 N-CA-C 115.604 1.705 . . . . 0.0 115.604 -177.501 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 87.3 mtt180 -135.25 148.23 65.49 Favored Pre-proline 0 N--CA 1.475 0.797 0 C-N-CA 125.687 1.595 . . . . 0.0 112.561 -176.825 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -68.96 166.09 27.77 Favored 'Trans proline' 0 CA--C 1.543 0.959 0 C-N-CA 122.241 1.961 . . . . 0.0 110.132 173.348 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 7.4 p-10 -53.51 -28.66 32.34 Favored 'General case' 0 N--CA 1.475 0.792 0 N-CA-C 114.18 1.178 . . . . 0.0 114.18 178.817 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 12.6 p -77.94 -8.91 58.76 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 125.809 1.644 . . . . 0.0 115.02 178.452 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 39.5 mm-40 -124.9 -19.97 5.1 Favored 'General case' 0 N--CA 1.477 0.895 0 N-CA-C 116.315 1.968 . . . . 0.0 116.315 -172.908 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 4.7 t -69.73 170.13 11.53 Favored 'General case' 0 CA--C 1.551 1.011 0 N-CA-C 114.988 1.477 . . . . 0.0 114.988 -177.05 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -89.15 -6.99 56.56 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 127.877 2.471 . . . . 0.0 113.785 -179.762 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 56.2 m-85 -140.41 169.73 17.12 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 126.23 1.812 . . . . 0.0 110.507 178.328 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -78.61 145.93 34.43 Favored 'General case' 0 CA--C 1.548 0.866 0 O-C-N 121.12 -0.987 . . . . 0.0 113.3 -176.753 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 21.4 m170 -120.38 89.23 43.56 Favored Pre-proline 0 CA--C 1.555 1.141 0 C-N-CA 126.047 1.739 . . . . 0.0 110.535 -178.386 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -67.2 173.24 8.84 Favored 'Trans proline' 0 CA--C 1.542 0.924 0 C-N-CA 123.789 2.993 . . . . 0.0 114.943 -178.651 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 73.8 p -129.28 -178.9 4.85 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 126.089 1.756 . . . . 0.0 111.234 175.212 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 29.9 mtpp -49.89 -31.73 12.86 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 126.42 1.888 . . . . 0.0 115.203 -179.884 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 17.5 m -92.76 -25.63 18.09 Favored 'General case' 0 N--CA 1.477 0.913 0 N-CA-C 114.324 1.231 . . . . 0.0 114.324 -178.619 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 59.2 m -63.16 143.06 58.12 Favored 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 114.615 1.339 . . . . 0.0 114.615 -176.793 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 22.2 mt-30 -85.04 132.33 34.34 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 124.944 1.298 . . . . 0.0 110.844 176.689 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 12.8 t -129.11 135.28 62.36 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.731 0 C-N-CA 124.919 1.288 . . . . 0.0 110.677 -178.454 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -146.31 131.88 18.79 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 125.057 1.343 . . . . 0.0 111.234 178.218 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 63.0 t30 41.98 37.71 0.89 Allowed 'General case' 0 CA--C 1.553 1.076 0 C-N-CA 126.835 2.054 . . . . 0.0 116.379 177.405 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 85.78 16.17 64.1 Favored Glycine 0 CA--C 1.536 1.386 0 O-C-N 120.944 -1.098 . . . . 0.0 114.987 -179.751 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 66.5 mtt180 -136.02 161.15 36.47 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 125.6 1.56 . . . . 0.0 111.388 -179.633 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 3.1 m -139.21 144.24 29.64 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.62 0 C-N-CA 127.433 2.293 . . . . 0.0 109.562 -176.965 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 8.7 mt -94.81 126.72 47.18 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.764 0 O-C-N 121.385 -0.822 . . . . 0.0 110.811 -176.746 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -71.15 147.53 48.27 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 124.311 1.045 . . . . 0.0 112.032 178.186 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 23.7 t -70.27 99.87 1.61 Allowed 'General case' 0 C--O 1.24 0.563 0 C-N-CA 125.06 1.344 . . . . 0.0 112.301 -177.894 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 41.0 p90 -61.68 -38.18 86.84 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 115.413 -0.812 . . . . 0.0 110.316 175.531 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 62.2 m-20 -60.72 -44.33 96.77 Favored 'General case' 0 CA--C 1.539 0.545 0 O-C-N 121.856 -0.527 . . . . 0.0 110.444 176.402 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 37.7 t -64.48 -42.91 95.59 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 119.761 1.164 . . . . 0.0 111.447 177.51 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 30.7 mt -62.13 -40.46 96.0 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 124.179 0.992 . . . . 0.0 113.049 176.625 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 31.2 mmmt -83.19 -9.46 59.15 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 124.99 1.316 . . . . 0.0 113.856 179.266 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 81.82 38.36 14.04 Favored Glycine 0 CA--C 1.536 1.402 0 C-N-CA 124.642 1.115 . . . . 0.0 114.269 179.281 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 19.7 tpp180 -120.46 -22.4 6.47 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 126.568 1.947 . . . . 0.0 114.67 -176.893 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 5.4 t -66.25 144.79 56.39 Favored 'General case' 0 CA--C 1.546 0.789 0 CA-C-N 119.277 0.944 . . . . 0.0 113.372 -177.391 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 86.6 p -153.68 9.07 0.39 Allowed 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 126.799 2.04 . . . . 0.0 113.164 179.682 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 76.4 mtm-85 -67.82 162.89 23.02 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 126.137 1.775 . . . . 0.0 113.969 -178.349 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -122.97 8.29 9.3 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 126.376 1.87 . . . . 0.0 112.181 176.512 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -152.34 33.15 0.52 Allowed 'General case' 0 CA--C 1.551 1.012 0 C-N-CA 127.885 2.474 . . . . 0.0 110.053 -179.712 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 7.0 t -51.17 125.61 14.42 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 125.636 1.574 . . . . 0.0 112.276 -176.679 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 32.2 mtmt -84.8 8.15 18.26 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 124.742 1.217 . . . . 0.0 114.137 -176.971 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 89.0 m-85 -128.61 157.74 40.43 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 125.696 1.598 . . . . 0.0 111.488 -177.066 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -79.5 114.02 18.11 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 124.122 0.969 . . . . 0.0 112.289 -177.015 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 10.4 m170 -68.62 119.17 66.97 Favored Pre-proline 0 CA--C 1.545 0.764 0 N-CA-C 105.7 -1.963 . . . . 0.0 105.7 170.966 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -71.46 128.86 14.99 Favored 'Trans proline' 0 CA--C 1.542 0.906 0 C-N-CA 121.865 1.71 . . . . 0.0 114.556 -169.906 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 97.6 Cg_endo -78.69 155.22 27.3 Favored 'Trans proline' 0 CA--C 1.543 0.929 0 C-N-CA 123.403 2.735 . . . . 0.0 112.116 178.751 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 82.9 Cg_exo -45.97 -39.81 19.91 Favored 'Trans proline' 0 CA--C 1.54 0.782 0 C-N-CA 124.454 3.436 . . . . 0.0 115.976 179.385 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 18.3 m-70 -71.48 -15.71 62.33 Favored 'General case' 0 N--CA 1.477 0.89 0 N-CA-C 114.965 1.468 . . . . 0.0 114.965 179.356 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 78.6 mt -115.36 -18.06 11.13 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 124.468 1.107 . . . . 0.0 113.109 -179.776 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 59.2 mtpt -54.56 -38.23 66.41 Favored 'General case' 0 N--CA 1.476 0.849 0 CA-C-N 119.661 1.119 . . . . 0.0 111.328 173.872 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 25.0 m -62.58 -42.66 99.69 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 124.115 0.966 . . . . 0.0 111.673 176.235 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 89.4 mm-40 -67.25 -44.58 79.05 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 123.739 0.815 . . . . 0.0 110.807 178.323 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 93.2 mt -62.24 -46.54 88.41 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 123.992 0.917 . . . . 0.0 112.341 178.417 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -65.14 -30.48 71.41 Favored 'General case' 0 N--CA 1.476 0.838 0 CA-C-N 120.044 1.293 . . . . 0.0 113.191 178.863 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 64.1 mt -71.73 -43.49 70.04 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.757 0 O-C-N 121.367 -0.833 . . . . 0.0 109.583 175.744 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 22.8 m-80 -64.96 -33.72 76.7 Favored 'General case' 0 CA--C 1.542 0.654 0 O-C-N 121.683 -0.636 . . . . 0.0 111.289 174.826 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -62.86 -48.32 81.89 Favored Glycine 0 CA--C 1.528 0.848 0 C-N-CA 124.518 1.056 . . . . 0.0 111.414 177.193 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 82.2 mtt85 -55.21 -32.7 62.46 Favored 'General case' 0 N--CA 1.482 1.128 0 CA-C-N 118.477 1.139 . . . . 0.0 112.926 175.833 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 17.0 t-20 -78.7 -9.25 59.34 Favored 'General case' 0 CA--C 1.552 1.034 0 C-N-CA 125.105 1.362 . . . . 0.0 114.13 178.582 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 63.7 m-80 -126.13 -25.93 3.47 Favored 'General case' 0 N--CA 1.476 0.868 0 N-CA-C 114.923 1.453 . . . . 0.0 114.923 -177.399 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 95.0 mt -78.25 43.83 0.47 Allowed 'General case' 0 CA--C 1.551 1.018 0 C-N-CA 126.459 1.904 . . . . 0.0 111.574 176.877 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 97.3 mt -60.64 -28.21 42.27 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.823 0 C-N-CA 127.107 2.163 . . . . 0.0 112.986 -177.129 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 1.9 tm0? -139.12 133.84 32.06 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.643 1.177 . . . . 0.0 110.585 179.141 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 6.6 tp-100 -50.68 -29.6 11.6 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 126.373 1.869 . . . . 0.0 115.415 -177.572 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 59.8 mttp -62.05 -22.24 65.59 Favored 'General case' 0 N--CA 1.476 0.866 0 N-CA-C 114.76 1.393 . . . . 0.0 114.76 179.724 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 32.6 t-20 . . . . . 0 N--CA 1.471 0.608 0 CA-C-N 119.635 1.107 . . . . 0.0 112.974 179.129 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.541 0.624 0 N-CA-C 113.936 1.087 . . . . 0.0 113.936 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 81.8 mt -95.06 -22.25 18.03 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 125.894 1.677 . . . . 0.0 114.344 -177.174 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 4.6 m -73.53 74.67 1.46 Allowed 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 125.035 1.334 . . . . 0.0 111.206 -179.238 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.545 HD21 HD13 ' A' ' 75' ' ' LEU . 8.5 tp -75.65 142.66 42.53 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 127.234 2.213 . . . . 0.0 111.64 -177.62 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 12.8 mt-10 -72.17 152.15 42.46 Favored 'General case' 0 N--CA 1.47 0.548 0 O-C-N 120.684 -1.26 . . . . 0.0 112.796 179.613 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 14.9 m -84.01 153.44 3.72 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.811 0 C-N-CA 122.737 0.415 . . . . 0.0 110.483 175.093 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 34.9 t -73.48 134.01 43.79 Favored 'General case' 0 CA--C 1.539 0.528 0 N-CA-C 109.724 -0.472 . . . . 0.0 109.724 175.77 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 5.7 mpt_? -68.99 -43.18 75.39 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 124.898 1.279 . . . . 0.0 112.675 -176.958 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 12.8 mm-40 -70.41 -34.49 72.58 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 124.461 1.105 . . . . 0.0 111.947 -179.549 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 78.3 t80 -61.92 -27.0 68.51 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 124.145 0.978 . . . . 0.0 111.753 175.553 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 71.7 mm-40 -61.86 -21.5 64.72 Favored 'General case' 0 N--CA 1.478 0.93 0 N-CA-C 113.734 1.013 . . . . 0.0 113.734 177.185 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -118.62 13.66 13.41 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 125.521 1.528 . . . . 0.0 112.054 177.375 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 59.83 37.11 92.03 Favored Glycine 0 CA--C 1.533 1.165 0 C-N-CA 124.821 1.2 . . . . 0.0 113.933 -179.207 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 6.1 t -124.93 16.26 8.57 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 124.563 1.145 . . . . 0.0 113.66 -176.446 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 12.4 t -66.0 169.96 6.15 Favored 'General case' 0 CA--C 1.558 1.26 0 C-N-CA 124.245 1.018 . . . . 0.0 111.048 173.978 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 94.5 p -128.82 4.01 5.42 Favored 'General case' 0 N--CA 1.477 0.918 0 N-CA-C 115.673 1.731 . . . . 0.0 115.673 -175.646 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 53.1 mtt-85 -133.39 147.29 64.26 Favored Pre-proline 0 N--CA 1.474 0.744 0 C-N-CA 126.12 1.768 . . . . 0.0 111.027 179.403 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 93.5 Cg_endo -72.64 167.73 26.35 Favored 'Trans proline' 0 CA--C 1.541 0.836 0 C-N-CA 122.251 1.968 . . . . 0.0 109.929 175.42 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -53.91 -30.12 44.89 Favored 'General case' 0 N--CA 1.474 0.766 0 O-C-N 121.32 -0.863 . . . . 0.0 112.936 176.329 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 28.1 p -73.95 -10.21 59.41 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 125.536 1.534 . . . . 0.0 115.059 178.427 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -135.25 -13.4 2.08 Favored 'General case' 0 N--CA 1.478 0.952 0 N-CA-C 116.818 2.155 . . . . 0.0 116.818 -176.132 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 5.1 t -70.62 162.3 29.18 Favored 'General case' 0 CA--C 1.552 1.024 0 CA-C-N 120.553 1.524 . . . . 0.0 113.709 -178.969 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -77.01 -12.19 59.9 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 126.78 2.032 . . . . 0.0 114.106 -179.814 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 62.0 m-85 -137.92 172.87 12.3 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 126.191 1.797 . . . . 0.0 110.571 179.287 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -80.67 149.94 29.58 Favored 'General case' 0 CA--C 1.549 0.915 0 O-C-N 121.147 -0.97 . . . . 0.0 113.097 -177.311 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 65.3 m170 -124.81 89.9 51.78 Favored Pre-proline 0 CA--C 1.552 1.021 0 C-N-CA 125.828 1.651 . . . . 0.0 111.243 -179.097 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 31.1 Cg_endo -62.08 143.05 94.38 Favored 'Trans proline' 0 CA--C 1.542 0.907 0 C-N-CA 123.11 2.54 . . . . 0.0 112.729 179.542 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 45.8 p -80.13 -84.94 0.09 Allowed 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 124.799 1.24 . . . . 0.0 113.678 -178.732 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 35.7 mtmm -144.49 -55.87 0.35 Allowed 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 126.979 2.112 . . . . 0.0 111.579 -179.054 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 35.3 m -76.27 -17.95 59.22 Favored 'General case' 0 N--CA 1.477 0.914 0 N-CA-C 113.234 0.828 . . . . 0.0 113.234 178.184 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 73.9 m -57.34 124.19 18.02 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 124.801 1.24 . . . . 0.0 112.341 179.942 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 56.8 tt0 -87.67 134.85 33.58 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 124.869 1.267 . . . . 0.0 110.566 179.169 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 1.6 m -124.3 148.32 28.57 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.599 0 C-N-CA 125.315 1.446 . . . . 0.0 110.937 179.85 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 70.9 mm-40 -141.32 133.57 28.02 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 125.302 1.441 . . . . 0.0 110.152 179.312 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 63.1 t30 44.23 35.8 1.36 Allowed 'General case' 0 CA--C 1.555 1.144 0 N-CA-C 116.002 1.853 . . . . 0.0 116.002 177.963 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 83.9 20.14 60.06 Favored Glycine 0 CA--C 1.538 1.512 0 O-C-N 120.914 -1.116 . . . . 0.0 114.823 -179.246 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 43.1 mtt180 -139.34 163.46 32.43 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 125.703 1.601 . . . . 0.0 111.843 -178.69 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 2.9 m -137.29 135.13 47.27 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.692 0 C-N-CA 126.942 2.097 . . . . 0.0 110.276 -177.719 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 78.4 mt -83.9 125.85 40.18 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.546 0 O-C-N 121.541 -0.724 . . . . 0.0 109.855 -179.202 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -70.72 143.66 51.21 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 123.8 0.84 . . . . 0.0 110.447 176.358 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 17.2 t -65.08 98.86 0.32 Allowed 'General case' 0 C--O 1.239 0.536 0 C-N-CA 124.494 1.117 . . . . 0.0 113.091 -176.921 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 33.4 p90 -62.37 -37.36 85.42 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 115.188 -0.915 . . . . 0.0 109.971 175.391 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 70.7 m-20 -61.46 -43.61 98.56 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 118.522 0.601 . . . . 0.0 110.394 176.339 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 40.2 t -64.88 -43.32 93.3 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 119.773 1.169 . . . . 0.0 111.488 177.336 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 25.8 mt -64.64 -42.73 95.26 Favored 'General case' 0 CA--C 1.543 0.699 0 N-CA-C 113.555 0.946 . . . . 0.0 113.555 177.246 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 31.0 mmmt -80.59 -18.63 47.68 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 124.713 1.205 . . . . 0.0 113.836 -179.427 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 96.21 41.32 3.76 Favored Glycine 0 CA--C 1.537 1.454 0 C-N-CA 124.582 1.087 . . . . 0.0 114.943 177.911 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 50.5 tpt85 -126.75 -22.3 3.91 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 126.247 1.819 . . . . 0.0 115.213 -177.343 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 5.0 t . . . . . 0 CA--C 1.545 0.775 0 CA-C-N 119.997 1.271 . . . . 0.0 113.714 -175.737 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 9.1 t . . . . . 0 CA--C 1.544 0.72 0 CA-C-O 121.413 0.625 . . . . 0.0 111.409 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 23.6 mtmt -82.43 1.03 39.43 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 123.922 0.889 . . . . 0.0 113.242 -178.645 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 76.4 m-85 -120.37 150.01 41.43 Favored 'General case' 0 C--N 1.326 -0.429 0 C-N-CA 124.581 1.152 . . . . 0.0 111.611 -174.413 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -75.09 111.66 10.54 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 123.411 0.685 . . . . 0.0 111.99 -176.323 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 11.5 m170 -65.26 119.83 62.49 Favored Pre-proline 0 CA--C 1.545 0.787 0 N-CA-C 105.212 -2.144 . . . . 0.0 105.212 171.413 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -69.06 125.18 12.18 Favored 'Trans proline' 0 CA--C 1.543 0.94 0 C-N-CA 122.028 1.819 . . . . 0.0 114.528 -169.803 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 90.3 Cg_endo -78.02 154.87 29.7 Favored 'Trans proline' 0 CA--C 1.542 0.882 0 C-N-CA 123.403 2.735 . . . . 0.0 111.734 178.851 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 81.2 Cg_exo -47.47 -41.74 29.09 Favored 'Trans proline' 0 CA--C 1.538 0.723 0 C-N-CA 123.905 3.07 . . . . 0.0 115.176 179.287 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 6.4 t60 -65.35 -22.82 66.86 Favored 'General case' 0 N--CA 1.476 0.843 0 N-CA-C 114.437 1.273 . . . . 0.0 114.437 179.267 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.545 HD13 HD21 ' A' ' 16' ' ' LEU . 67.7 mt -111.11 -17.89 13.13 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 124.332 1.053 . . . . 0.0 113.027 -179.608 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 25.5 mtpp -55.96 -38.55 70.51 Favored 'General case' 0 N--CA 1.475 0.816 0 CA-C-N 120.144 1.338 . . . . 0.0 110.882 173.678 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 24.0 m -59.27 -43.3 92.51 Favored 'General case' 0 N--CA 1.474 0.734 0 CA-C-N 118.621 0.646 . . . . 0.0 110.933 176.62 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 17.4 mm100 -67.71 -47.88 68.1 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 123.537 0.735 . . . . 0.0 111.101 177.647 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 88.4 mt -60.76 -40.82 93.93 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 124.168 0.987 . . . . 0.0 112.618 178.462 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -55.34 -52.75 62.49 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 124.416 1.087 . . . . 0.0 110.6 175.226 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 73.3 mt -69.61 -37.94 75.45 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.436 0 C-N-CA 125.81 1.644 . . . . 0.0 111.386 -176.27 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 93.1 m-20 -63.82 -40.64 97.09 Favored 'General case' 0 CA--C 1.543 0.675 0 O-C-N 121.586 -0.696 . . . . 0.0 110.372 173.87 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.918 0 C-N-CA 124.139 0.876 . . . . 0.0 111.679 177.657 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.474 0.734 0 N-CA-C 113.865 1.061 . . . . 0.0 113.865 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 78.3 mt -95.53 -18.69 20.42 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 126.489 1.916 . . . . 0.0 114.199 -178.328 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 7.2 m -78.41 79.4 4.85 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 125.082 1.353 . . . . 0.0 110.762 -178.138 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -76.55 144.4 39.71 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 128.196 2.598 . . . . 0.0 111.075 -177.569 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 9.2 mt-10 -73.74 150.83 40.89 Favored 'General case' 0 N--CA 1.472 0.665 0 O-C-N 120.788 -1.195 . . . . 0.0 111.659 175.789 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 16.3 m -81.14 149.05 5.09 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.783 0 N-CA-C 109.404 -0.591 . . . . 0.0 109.404 173.568 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 42.4 t -63.9 126.86 29.02 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-O 121.98 0.895 . . . . 0.0 111.244 179.08 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 3.3 mpt_? -63.7 -26.02 68.47 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 124.743 1.217 . . . . 0.0 113.151 -177.317 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 13.9 mm-40 -82.8 -37.77 24.04 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-O 121.136 0.493 . . . . 0.0 109.785 177.017 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 61.2 t80 -62.67 -30.37 71.33 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 124.759 1.224 . . . . 0.0 111.076 174.677 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 79.5 mt-30 -59.48 -21.41 60.07 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.667 0.787 . . . . 0.0 112.869 175.088 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 3.5 mpt_? -118.33 14.47 13.82 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 126.171 1.788 . . . . 0.0 111.842 178.009 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 58.48 36.38 84.29 Favored Glycine 0 CA--C 1.534 1.251 0 C-N-CA 125.225 1.393 . . . . 0.0 114.194 -179.992 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 6.7 t -128.49 16.63 6.5 Favored 'General case' 0 N--CA 1.476 0.87 0 N-CA-C 114.727 1.38 . . . . 0.0 114.727 -175.85 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 10.2 t -68.06 172.05 6.12 Favored 'General case' 0 CA--C 1.559 1.289 0 O-C-N 121.542 -0.724 . . . . 0.0 110.487 173.104 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 51.1 m -133.98 11.88 3.95 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 125.332 1.453 . . . . 0.0 114.764 -176.114 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 70.2 mtm-85 -134.85 146.38 58.56 Favored Pre-proline 0 N--CA 1.476 0.843 0 C-N-CA 125.281 1.433 . . . . 0.0 112.625 -176.906 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -68.68 166.15 27.04 Favored 'Trans proline' 0 CA--C 1.542 0.885 0 C-N-CA 122.154 1.903 . . . . 0.0 109.96 172.457 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 -54.24 -27.75 36.8 Favored 'General case' 0 N--CA 1.474 0.764 0 N-CA-C 113.725 1.009 . . . . 0.0 113.725 177.762 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 11.7 p -76.82 -11.88 59.89 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 125.491 1.516 . . . . 0.0 114.953 178.588 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 51.2 mm-40 -119.59 -27.26 5.55 Favored 'General case' 0 N--CA 1.476 0.869 0 N-CA-C 116.063 1.875 . . . . 0.0 116.063 -174.468 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 3.3 t -67.93 163.77 21.34 Favored 'General case' 0 CA--C 1.548 0.872 0 N-CA-C 115.773 1.768 . . . . 0.0 115.773 -175.033 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.61 -11.94 59.99 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 127.881 2.472 . . . . 0.0 112.659 -179.989 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 75.6 m-85 -143.07 172.99 11.96 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 126.711 2.004 . . . . 0.0 110.138 179.957 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -79.32 152.56 30.41 Favored 'General case' 0 CA--C 1.547 0.848 0 N-CA-C 114.291 1.219 . . . . 0.0 114.291 -177.787 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 63.3 m170 -126.43 89.6 51.84 Favored Pre-proline 0 CA--C 1.551 0.99 0 C-N-CA 126.138 1.775 . . . . 0.0 109.637 178.21 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 33.6 Cg_endo -63.48 148.08 92.8 Favored 'Trans proline' 0 CA--C 1.539 0.775 0 C-N-CA 123.052 2.501 . . . . 0.0 114.648 -177.367 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 58.2 p -87.29 -173.47 4.41 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 125.445 1.498 . . . . 0.0 112.245 176.061 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 67.9 mttm -62.42 -19.38 63.41 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 125.704 1.602 . . . . 0.0 113.478 173.828 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 61.1 p -109.11 -24.04 11.36 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 125.062 1.345 . . . . 0.0 114.326 -179.965 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 82.6 m -60.98 129.13 39.85 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-N 119.329 0.968 . . . . 0.0 112.902 179.839 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 67.1 tp60 -81.41 135.1 35.64 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 124.171 0.988 . . . . 0.0 110.411 177.628 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 15.0 t -117.48 144.68 24.73 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.819 0 C-N-CA 125.693 1.597 . . . . 0.0 109.299 -179.823 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 50.3 mt-10 -146.16 124.43 12.26 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 125.698 1.599 . . . . 0.0 110.404 179.5 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 62.9 t30 43.64 36.94 1.35 Allowed 'General case' 0 CA--C 1.554 1.133 0 N-CA-C 116.357 1.984 . . . . 0.0 116.357 178.043 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 86.49 16.96 61.17 Favored Glycine 0 CA--C 1.537 1.457 0 O-C-N 120.929 -1.107 . . . . 0.0 114.875 -179.873 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 62.8 mtt180 -138.24 163.73 31.01 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 126.373 1.869 . . . . 0.0 110.807 -179.536 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 5.1 m -139.63 144.2 29.12 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.506 0 C-N-CA 126.994 2.118 . . . . 0.0 109.323 -177.918 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 60.4 mt -94.06 132.82 37.1 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.729 0 O-C-N 121.146 -0.971 . . . . 0.0 110.112 -177.925 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -74.43 148.99 40.64 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 124.156 0.982 . . . . 0.0 112.465 178.344 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 7.8 t -69.2 95.72 0.78 Allowed 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 125.025 1.33 . . . . 0.0 109.981 179.531 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 27.2 p90 -58.01 -36.32 72.51 Favored 'General case' 0 N--CA 1.467 0.385 0 C-N-CA 123.439 0.695 . . . . 0.0 111.417 179.373 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 74.5 m-20 -58.5 -36.23 73.46 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.439 0.696 . . . . 0.0 111.447 177.144 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 47.7 t -70.87 -38.22 73.09 Favored 'General case' 0 CA--C 1.54 0.583 0 O-C-N 121.149 -0.969 . . . . 0.0 111.642 178.251 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 50.0 mt -69.26 -42.66 75.29 Favored 'General case' 0 N--CA 1.474 0.732 0 O-C-N 121.316 -0.865 . . . . 0.0 112.352 175.205 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 31.3 mmmt -75.56 -9.94 59.02 Favored 'General case' 0 N--CA 1.478 0.925 0 C-N-CA 125.038 1.335 . . . . 0.0 113.844 -179.992 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 78.44 37.06 28.55 Favored Glycine 0 CA--C 1.536 1.346 0 C-N-CA 124.414 1.007 . . . . 0.0 113.82 179.519 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 51.1 ttp180 -119.86 -22.55 6.74 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 126.852 2.061 . . . . 0.0 114.256 -177.016 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 3.7 t . . . . . 0 CA--C 1.545 0.771 0 CA-C-O 122.245 1.021 . . . . 0.0 113.604 -177.639 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 86.2 m . . . . . 0 CA--C 1.543 0.677 0 N-CA-C 113.684 0.994 . . . . 0.0 113.684 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 43.0 mtmt -93.42 9.15 37.67 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 124.698 1.199 . . . . 0.0 111.16 173.188 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 70.1 m-85 -129.91 149.27 51.71 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 126.797 2.039 . . . . 0.0 111.351 -173.602 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -74.74 117.1 16.19 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 124.312 1.045 . . . . 0.0 112.901 -176.046 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 1.8 m-70 -67.67 121.58 79.91 Favored Pre-proline 0 CA--C 1.544 0.726 0 CA-C-O 118.194 -0.908 . . . . 0.0 108.829 173.994 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 67.6 Cg_exo -45.68 107.7 0.12 Allowed 'Trans proline' 0 CA--C 1.543 0.969 0 C-N-CA 124.894 3.729 . . . . 0.0 115.392 -178.649 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 98.4 Cg_endo -76.34 155.25 36.79 Favored 'Trans proline' 0 CA--C 1.541 0.857 0 C-N-CA 121.515 1.476 . . . . 0.0 110.606 176.362 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_endo -56.19 -29.68 76.57 Favored 'Trans proline' 0 CA--C 1.54 0.816 0 C-N-CA 123.169 2.579 . . . . 0.0 114.839 -177.664 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 11.8 m-70 -80.15 -14.44 58.47 Favored 'General case' 0 N--CA 1.476 0.853 0 N-CA-C 114.598 1.333 . . . . 0.0 114.598 177.238 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 73.6 mt -116.18 -15.84 11.04 Favored 'General case' 0 N--CA 1.476 0.833 0 CA-C-N 119.394 0.997 . . . . 0.0 113.353 179.63 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 67.2 mttt -52.5 -37.43 57.37 Favored 'General case' 0 N--CA 1.476 0.873 0 CA-C-N 119.76 1.163 . . . . 0.0 111.186 173.273 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 19.4 m -63.37 -44.25 95.29 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 123.722 0.809 . . . . 0.0 111.21 176.431 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 18.5 mm100 -67.93 -42.93 80.28 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 124.067 0.947 . . . . 0.0 111.546 178.636 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 80.5 mt -61.47 -47.59 84.96 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 123.846 0.858 . . . . 0.0 110.996 177.284 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 3.8 pt-20 -64.54 -37.2 86.74 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 119.651 1.114 . . . . 0.0 112.232 177.615 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 60.7 mt -62.9 -46.66 95.78 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.691 0 CA-C-N 119.395 0.998 . . . . 0.0 110.051 177.216 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 16.1 t-20 -63.35 -41.01 98.83 Favored 'General case' 0 CA--C 1.545 0.767 0 CA-C-N 118.598 0.635 . . . . 0.0 111.091 177.585 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 1.258 0 O-C-N 121.421 -0.799 . . . . 0.0 111.924 176.942 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.474 0.771 0 N-CA-C 114.224 1.194 . . . . 0.0 114.224 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 96.2 mt -91.3 -9.93 43.22 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 127.233 2.213 . . . . 0.0 114.954 -176.542 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 7.5 m -78.28 79.18 4.73 Favored 'General case' 0 N--CA 1.475 0.818 0 CA-C-O 122.336 1.065 . . . . 0.0 110.705 -179.175 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.407 HD21 HD13 ' A' ' 75' ' ' LEU . 12.4 tp -75.79 142.0 42.4 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 128.81 2.844 . . . . 0.0 112.023 -177.6 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -70.29 150.17 46.64 Favored 'General case' 0 N--CA 1.475 0.786 0 O-C-N 120.46 -1.4 . . . . 0.0 112.137 177.083 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 27.2 m -84.86 151.97 3.72 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.88 0 N-CA-C 109.676 -0.49 . . . . 0.0 109.676 172.104 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 51.3 t -67.54 125.78 27.25 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-O 121.804 0.812 . . . . 0.0 111.434 178.209 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 3.0 mpt_? -63.91 -26.21 68.49 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 124.763 1.225 . . . . 0.0 112.954 -178.158 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 11.1 mm-40 -81.79 -38.4 25.64 Favored 'General case' 0 CA--C 1.538 0.492 0 N-CA-C 109.662 -0.496 . . . . 0.0 109.662 176.877 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 59.7 t80 -63.84 -33.41 75.62 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 124.782 1.233 . . . . 0.0 110.969 175.093 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 84.7 mt-30 -59.31 -24.07 62.99 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 123.701 0.801 . . . . 0.0 112.396 174.277 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 72.9 mtt85 -114.95 12.49 16.81 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 126.453 1.901 . . . . 0.0 112.582 -175.582 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 58.19 34.95 75.51 Favored Glycine 0 CA--C 1.534 1.231 0 C-N-CA 125.256 1.407 . . . . 0.0 113.927 -179.828 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 6.7 t -131.89 14.67 4.8 Favored 'General case' 0 N--CA 1.474 0.762 0 N-CA-C 114.942 1.46 . . . . 0.0 114.942 -175.169 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 8.8 t -67.69 172.54 5.12 Favored 'General case' 0 CA--C 1.557 1.214 0 O-C-N 121.366 -0.834 . . . . 0.0 110.689 173.822 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 89.9 p -140.48 10.69 2.29 Favored 'General case' 0 N--CA 1.477 0.905 0 N-CA-C 115.349 1.611 . . . . 0.0 115.349 -176.309 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 59.0 mtm-85 -131.72 147.08 64.58 Favored Pre-proline 0 N--CA 1.474 0.731 0 C-N-CA 125.522 1.529 . . . . 0.0 112.405 -178.074 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -68.52 165.96 27.39 Favored 'Trans proline' 0 CA--C 1.542 0.889 0 C-N-CA 121.943 1.762 . . . . 0.0 109.633 171.82 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 7.1 p-10 -53.31 -31.8 45.8 Favored 'General case' 0 N--CA 1.473 0.724 0 O-C-N 121.268 -0.895 . . . . 0.0 113.244 177.826 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 22.7 p -72.76 -9.36 58.56 Favored 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 115.136 1.532 . . . . 0.0 115.136 178.468 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 19.8 mt-10 -122.47 -25.41 4.77 Favored 'General case' 0 N--CA 1.477 0.882 0 N-CA-C 115.9 1.815 . . . . 0.0 115.9 -176.421 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 3.0 t -69.68 164.02 24.37 Favored 'General case' 0 CA--C 1.547 0.829 0 N-CA-C 115.195 1.554 . . . . 0.0 115.195 -176.614 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -79.51 -11.14 59.9 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 127.186 2.194 . . . . 0.0 113.764 -179.495 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 65.9 m-85 -141.67 175.55 9.61 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 126.393 1.877 . . . . 0.0 110.673 -179.446 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -79.58 149.97 31.21 Favored 'General case' 0 CA--C 1.547 0.85 0 O-C-N 120.986 -1.071 . . . . 0.0 113.253 -178.078 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 65.2 m170 -123.88 91.99 49.0 Favored Pre-proline 0 CA--C 1.55 0.962 0 C-N-CA 125.785 1.634 . . . . 0.0 110.412 178.859 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_endo -63.0 162.3 26.41 Favored 'Trans proline' 0 CA--C 1.54 0.81 0 C-N-CA 123.356 2.704 . . . . 0.0 114.155 -179.224 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 84.6 p -131.6 -172.26 2.81 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 125.858 1.663 . . . . 0.0 112.531 178.84 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 60.4 pttt -27.14 -48.84 0.04 OUTLIER 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 129.345 3.058 . . . . 0.0 118.425 -175.997 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 5.5 p -109.66 -12.11 14.68 Favored 'General case' 0 N--CA 1.475 0.806 0 N-CA-C 115.697 1.74 . . . . 0.0 115.697 -176.286 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 66.7 m -57.9 128.63 38.04 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 124.546 1.138 . . . . 0.0 113.977 -176.835 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 44.4 tt0 -81.0 125.72 30.5 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 125.575 1.55 . . . . 0.0 110.215 178.333 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 23.2 t -119.67 133.43 66.47 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.976 0 C-N-CA 125.861 1.665 . . . . 0.0 109.608 -178.222 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -144.74 131.39 19.99 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 124.859 1.264 . . . . 0.0 111.504 -179.205 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 62.6 t30 41.41 38.01 0.76 Allowed 'General case' 0 CA--C 1.552 1.043 0 C-N-CA 127.277 2.231 . . . . 0.0 116.714 177.475 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 88.25 15.41 60.63 Favored Glycine 0 CA--C 1.535 1.324 0 O-C-N 120.979 -1.076 . . . . 0.0 114.975 179.536 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 31.6 mtt180 -139.43 168.3 20.13 Favored 'General case' 0 N--CA 1.467 0.4 0 C-N-CA 126.209 1.804 . . . . 0.0 112.185 -179.355 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 2.2 m -141.31 140.31 31.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 C-N-CA 127.737 2.415 . . . . 0.0 108.79 -178.914 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 47.2 mt -89.23 126.19 42.23 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.608 0 O-C-N 121.098 -1.001 . . . . 0.0 109.727 -179.336 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -71.66 146.83 48.02 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 124.071 0.948 . . . . 0.0 111.436 177.303 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 14.7 t -69.1 99.1 1.06 Allowed 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 124.752 1.221 . . . . 0.0 113.03 -177.072 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 28.1 p90 -61.18 -37.73 83.97 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 115.263 -0.88 . . . . 0.0 109.939 174.746 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 75.3 m-20 -62.25 -43.54 98.6 Favored 'General case' 0 CA--C 1.538 0.501 0 O-C-N 121.776 -0.578 . . . . 0.0 110.665 177.293 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 46.6 t -63.83 -44.14 94.13 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 119.633 1.106 . . . . 0.0 111.3 177.313 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 43.7 mt -62.8 -42.24 99.63 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 124.082 0.953 . . . . 0.0 113.294 176.85 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 31.4 mmmt -80.61 -12.65 59.48 Favored 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 124.904 1.281 . . . . 0.0 113.839 179.876 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 85.99 38.42 8.61 Favored Glycine 0 CA--C 1.538 1.485 0 C-N-CA 124.6 1.095 . . . . 0.0 114.274 179.225 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 49.2 ttp180 -122.07 -20.39 6.29 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 126.721 2.008 . . . . 0.0 114.808 -176.825 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 5.6 t . . . . . 0 CA--C 1.546 0.808 0 CA-C-N 119.393 0.997 . . . . 0.0 113.187 -178.187 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 8.9 t . . . . . 0 CA--C 1.543 0.703 0 CA-C-O 121.202 0.525 . . . . 0.0 111.396 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 17.1 mtmt -83.94 0.26 48.59 Favored 'General case' 0 N--CA 1.476 0.838 0 N-CA-C 113.715 1.006 . . . . 0.0 113.715 -178.843 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 72.2 m-85 -120.96 152.07 38.96 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 122.216 1.008 . . . . 0.0 112.231 -173.21 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -75.61 113.37 12.97 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 123.547 0.739 . . . . 0.0 111.766 -176.656 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 15.4 m170 -68.09 116.4 38.58 Favored Pre-proline 0 CA--C 1.546 0.823 0 N-CA-C 105.126 -2.176 . . . . 0.0 105.126 171.256 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 66.3 Cg_endo -70.16 132.14 22.09 Favored 'Trans proline' 0 CA--C 1.543 0.932 0 C-N-CA 121.917 1.744 . . . . 0.0 114.393 -169.86 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_endo -76.05 159.05 37.85 Favored 'Trans proline' 0 CA--C 1.542 0.879 0 C-N-CA 123.902 3.068 . . . . 0.0 111.863 178.543 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 21.1 Cg_endo -55.57 -32.78 84.39 Favored 'Trans proline' 0 CA--C 1.538 0.719 0 C-N-CA 123.484 2.789 . . . . 0.0 114.715 -178.155 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 56.0 m80 -76.84 -13.41 60.01 Favored 'General case' 0 N--CA 1.474 0.773 0 N-CA-C 114.659 1.355 . . . . 0.0 114.659 177.779 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.407 HD13 HD21 ' A' ' 16' ' ' LEU . 91.2 mt -115.86 -18.13 10.83 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 124.551 1.14 . . . . 0.0 113.535 179.344 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 58.3 mtpt -53.8 -37.21 63.28 Favored 'General case' 0 N--CA 1.48 1.072 0 CA-C-N 119.992 1.269 . . . . 0.0 111.233 172.907 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 19.6 m -64.16 -42.13 96.87 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 124.628 1.171 . . . . 0.0 111.709 176.007 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 90.6 mm-40 -67.21 -42.91 83.32 Favored 'General case' 0 N--CA 1.466 0.356 0 C-N-CA 123.517 0.727 . . . . 0.0 110.421 178.531 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 66.7 mt -63.2 -45.66 90.7 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-O 118.391 -0.814 . . . . 0.0 112.183 176.927 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 7.2 pt-20 -63.99 -35.64 81.37 Favored 'General case' 0 N--CA 1.474 0.766 0 CA-C-N 120.476 1.489 . . . . 0.0 111.878 177.196 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 69.1 mt -63.13 -44.54 99.48 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.679 0 CA-C-N 119.049 0.841 . . . . 0.0 109.77 175.185 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 86.4 m-20 -61.12 -42.74 99.08 Favored 'General case' 0 CA--C 1.545 0.774 0 O-C-N 121.707 -0.621 . . . . 0.0 110.728 175.665 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 1.053 0 C-N-CA 124.881 1.229 . . . . 0.0 112.403 178.873 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.544 0.727 0 N-CA-C 114.08 1.141 . . . . 0.0 114.08 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 96.2 mt -91.19 -10.11 42.91 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 127.24 2.216 . . . . 0.0 114.78 -177.141 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 9.7 m -78.45 79.22 4.89 Favored 'General case' 0 N--CA 1.477 0.888 0 CA-C-N 119.728 1.149 . . . . 0.0 110.879 -178.805 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.548 HD21 HD13 ' A' ' 75' ' ' LEU . 10.0 tp -75.71 143.26 42.19 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 128.567 2.747 . . . . 0.0 111.875 -177.728 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 10.1 mt-10 -74.91 151.83 38.9 Favored 'General case' 0 N--CA 1.47 0.559 0 O-C-N 120.5 -1.375 . . . . 0.0 112.888 178.409 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 14.8 m -85.36 154.92 3.49 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.943 0 C-N-CA 123.255 0.622 . . . . 0.0 111.659 175.497 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 47.8 t -74.83 138.59 42.66 Favored 'General case' 0 CA--C 1.538 0.519 0 O-C-N 121.704 -0.622 . . . . 0.0 110.883 176.439 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.27 -39.57 74.85 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 124.811 1.244 . . . . 0.0 113.229 -178.422 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 13.5 mm-40 -73.97 -32.9 63.65 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 123.551 0.74 . . . . 0.0 111.351 179.268 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 67.3 t80 -62.75 -27.57 69.37 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 123.89 0.876 . . . . 0.0 111.471 175.844 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 57.9 mm-40 -65.28 -20.01 66.22 Favored 'General case' 0 N--CA 1.476 0.862 0 N-CA-C 112.815 0.672 . . . . 0.0 112.815 175.359 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 7.3 mpt_? -108.71 8.48 26.88 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 126.315 1.846 . . . . 0.0 111.607 176.894 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 58.64 36.12 84.22 Favored Glycine 0 CA--C 1.533 1.179 0 C-N-CA 125.421 1.486 . . . . 0.0 114.127 -179.677 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 4.8 t -130.96 7.81 4.73 Favored 'General case' 0 N--CA 1.477 0.917 0 N-CA-C 114.892 1.442 . . . . 0.0 114.892 -174.944 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 27.8 t -60.2 132.86 55.25 Favored 'General case' 0 CA--C 1.55 0.959 0 O-C-N 120.902 -1.124 . . . . 0.0 110.615 175.972 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 77.9 p -82.66 3.98 26.76 Favored 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 115.457 1.651 . . . . 0.0 115.457 -176.67 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 67.4 mtm-85 -130.23 146.2 60.58 Favored Pre-proline 0 N--CA 1.475 0.805 0 C-N-CA 125.252 1.421 . . . . 0.0 113.311 -176.216 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 95.2 Cg_endo -70.35 167.76 24.3 Favored 'Trans proline' 0 CA--C 1.543 0.958 0 C-N-CA 122.385 2.056 . . . . 0.0 110.021 171.706 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 -54.22 -29.12 45.28 Favored 'General case' 0 N--CA 1.475 0.81 0 N-CA-C 113.538 0.94 . . . . 0.0 113.538 177.158 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 16.2 p -75.52 -8.35 56.51 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 125.59 1.556 . . . . 0.0 114.981 178.642 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 19.3 mt-10 -124.78 -25.53 3.93 Favored 'General case' 0 N--CA 1.478 0.931 0 N-CA-C 116.092 1.886 . . . . 0.0 116.092 -176.012 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 4.3 t -68.92 163.14 25.11 Favored 'General case' 0 CA--C 1.548 0.895 0 N-CA-C 115.215 1.561 . . . . 0.0 115.215 -176.631 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -79.59 -9.99 59.72 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 127.286 2.234 . . . . 0.0 113.236 179.627 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 65.6 m-85 -140.54 174.0 10.95 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 126.411 1.885 . . . . 0.0 110.523 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -81.99 150.78 27.47 Favored 'General case' 0 CA--C 1.546 0.804 0 O-C-N 121.129 -0.982 . . . . 0.0 113.464 -177.742 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 66.5 m170 -123.82 86.52 53.24 Favored Pre-proline 0 CA--C 1.551 0.982 0 C-N-CA 126.043 1.737 . . . . 0.0 110.739 -179.587 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 29.5 Cg_endo -62.18 146.44 95.99 Favored 'Trans proline' 0 CA--C 1.54 0.811 0 C-N-CA 123.6 2.867 . . . . 0.0 114.923 -177.444 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 51.6 p -84.98 -176.05 6.04 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 124.867 1.267 . . . . 0.0 112.386 175.604 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 75.0 mmtt -60.67 -19.51 58.58 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 125.819 1.648 . . . . 0.0 113.553 173.558 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 43.0 m -109.06 -20.58 12.97 Favored 'General case' 0 N--CA 1.478 0.933 0 N-CA-C 114.216 1.191 . . . . 0.0 114.216 179.372 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 87.2 m -61.5 138.46 58.28 Favored 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 113.915 1.08 . . . . 0.0 113.915 -178.638 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 47.8 tt0 -83.57 127.66 33.91 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 125.832 1.653 . . . . 0.0 110.308 178.594 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 15.0 t -123.11 133.49 68.93 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.958 0 C-N-CA 125.666 1.587 . . . . 0.0 109.908 -177.852 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -144.24 129.29 18.57 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 125.114 1.366 . . . . 0.0 111.255 -179.136 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 61.9 t30 43.42 36.54 1.14 Allowed 'General case' 0 CA--C 1.552 1.051 0 C-N-CA 126.82 2.048 . . . . 0.0 116.462 177.94 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 87.41 14.24 64.17 Favored Glycine 0 CA--C 1.536 1.347 0 O-C-N 120.993 -1.067 . . . . 0.0 114.947 179.845 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 71.4 mtt180 -136.86 164.25 28.74 Favored 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 125.823 1.649 . . . . 0.0 111.087 -179.929 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 4.1 m -139.34 142.74 32.64 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.564 0 C-N-CA 127.13 2.172 . . . . 0.0 109.085 -177.926 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 29.1 mt -90.94 127.84 43.12 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.647 0 O-C-N 121.09 -1.006 . . . . 0.0 109.995 -178.51 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -73.38 147.46 44.29 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 123.962 0.905 . . . . 0.0 111.229 177.642 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 15.1 t -70.58 97.06 1.26 Allowed 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 125.655 1.582 . . . . 0.0 113.267 -175.82 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 28.1 p90 -59.66 -37.53 79.01 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 123.428 0.691 . . . . 0.0 110.407 175.179 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 69.7 m-20 -61.43 -36.82 81.42 Favored 'General case' 0 CA--C 1.54 0.574 0 O-C-N 121.645 -0.659 . . . . 0.0 111.632 177.273 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 46.7 p -67.19 -38.53 85.52 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-N 119.733 1.151 . . . . 0.0 111.976 177.304 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 42.1 mt -71.73 -42.97 66.64 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 124.51 1.124 . . . . 0.0 112.261 177.444 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 31.1 mmmt -76.12 -15.6 60.05 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 124.69 1.196 . . . . 0.0 113.7 179.573 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 87.76 42.41 6.07 Favored Glycine 0 CA--C 1.537 1.416 0 C-N-CA 124.519 1.057 . . . . 0.0 114.502 178.085 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 19.4 tpp180 -127.19 -23.43 3.57 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 125.865 1.666 . . . . 0.0 115.241 -176.922 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 8.2 t . . . . . 0 CA--C 1.546 0.8 0 CA-C-N 119.444 1.02 . . . . 0.0 113.142 -176.542 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 9.4 t . . . . . 0 CA--C 1.543 0.706 0 CA-C-O 121.299 0.571 . . . . 0.0 111.436 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 6.8 mtmp? -84.78 3.78 36.03 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 124.077 0.951 . . . . 0.0 113.457 -177.982 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 67.5 m-85 -124.76 152.79 43.37 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 124.207 1.003 . . . . 0.0 112.353 -173.881 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -79.65 116.4 19.83 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 123.712 0.805 . . . . 0.0 112.249 -175.788 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 32.7 m170 -68.99 114.42 23.1 Favored Pre-proline 0 CA--C 1.548 0.902 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 174.649 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 67.8 Cg_exo -47.23 112.99 0.6 Allowed 'Trans proline' 0 CA--C 1.541 0.861 0 C-N-CA 125.011 3.807 . . . . 0.0 116.267 -175.926 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 96.0 Cg_endo -76.0 157.01 38.7 Favored 'Trans proline' 0 CA--C 1.541 0.873 0 C-N-CA 121.74 1.627 . . . . 0.0 110.889 176.406 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_endo -57.41 -31.2 90.55 Favored 'Trans proline' 0 CA--C 1.539 0.734 0 C-N-CA 123.155 2.57 . . . . 0.0 114.839 -176.669 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 61.6 m80 -80.68 -10.84 59.7 Favored 'General case' 0 N--CA 1.475 0.803 0 N-CA-C 114.749 1.388 . . . . 0.0 114.749 178.169 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.548 HD13 HD21 ' A' ' 16' ' ' LEU . 77.3 mt -117.0 -16.96 10.47 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 124.214 1.005 . . . . 0.0 113.179 178.527 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 62.3 mttt -52.99 -35.47 59.29 Favored 'General case' 0 N--CA 1.475 0.825 0 CA-C-N 119.502 1.047 . . . . 0.0 111.58 173.249 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 24.5 m -63.64 -46.05 87.45 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 124.206 1.002 . . . . 0.0 111.295 175.969 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 92.4 mm-40 -65.57 -44.51 86.51 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 123.637 0.775 . . . . 0.0 110.659 177.661 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 87.9 mt -60.75 -46.52 90.13 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 123.833 0.853 . . . . 0.0 111.974 177.305 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -65.91 -35.42 80.58 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-N 119.934 1.243 . . . . 0.0 112.098 177.52 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 64.9 mt -62.6 -43.56 98.6 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.786 0 CA-C-N 119.258 0.935 . . . . 0.0 109.647 175.337 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 83.8 m-20 -61.77 -44.12 97.51 Favored 'General case' 0 CA--C 1.542 0.668 0 O-C-N 121.778 -0.576 . . . . 0.0 110.482 175.307 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.856 0 C-N-CA 124.701 1.143 . . . . 0.0 112.559 179.354 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.473 0.724 0 N-CA-C 113.372 0.878 . . . . 0.0 113.372 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 91.2 mt -88.2 -12.22 44.48 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 127.202 2.201 . . . . 0.0 113.886 -179.119 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 12.9 m -79.59 79.37 6.07 Favored 'General case' 0 N--CA 1.474 0.732 0 CA-C-O 122.487 1.137 . . . . 0.0 110.218 -178.377 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.483 HD21 HD13 ' A' ' 75' ' ' LEU . 11.9 tp -75.61 143.81 42.1 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 128.512 2.725 . . . . 0.0 111.548 -177.357 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 62.5 mt-10 -74.03 150.57 40.57 Favored 'General case' 0 CA--C 1.541 0.614 0 O-C-N 120.765 -1.21 . . . . 0.0 112.362 178.622 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 13.7 m -86.33 153.24 3.44 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.232 0 C-N-CA 123.539 0.736 . . . . 0.0 111.149 174.59 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 41.5 t -72.29 130.15 40.1 Favored 'General case' 0 CA--C 1.543 0.695 0 O-C-N 121.129 -0.982 . . . . 0.0 112.081 178.76 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.2 -28.94 69.73 Favored 'General case' 0 N--CA 1.479 0.992 0 O-C-N 121.287 -0.883 . . . . 0.0 113.09 179.821 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -77.03 -41.4 42.77 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 123.726 0.811 . . . . 0.0 110.142 178.884 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 65.0 t80 -63.54 -34.4 77.72 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 124.331 1.052 . . . . 0.0 111.517 175.907 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 13.6 mm100 -62.65 -14.51 44.33 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 124.03 0.932 . . . . 0.0 113.161 175.081 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 11.8 mtp-105 -121.41 12.67 10.9 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 127.428 2.291 . . . . 0.0 112.197 179.27 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 57.2 35.73 71.8 Favored Glycine 0 CA--C 1.534 1.261 0 C-N-CA 125.259 1.409 . . . . 0.0 114.0 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 7.4 t -131.73 15.6 4.84 Favored 'General case' 0 N--CA 1.476 0.842 0 N-CA-C 114.898 1.444 . . . . 0.0 114.898 -174.958 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 5.9 t -67.83 172.53 5.29 Favored 'General case' 0 CA--C 1.556 1.182 0 CA-C-N 119.137 0.88 . . . . 0.0 111.432 175.295 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 94.3 p -134.79 6.1 3.41 Favored 'General case' 0 N--CA 1.476 0.85 0 N-CA-C 115.55 1.685 . . . . 0.0 115.55 -175.782 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 81.5 mtt180 -133.1 143.34 48.04 Favored Pre-proline 0 N--CA 1.472 0.64 0 C-N-CA 125.53 1.532 . . . . 0.0 111.91 -179.39 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -68.17 165.72 27.54 Favored 'Trans proline' 0 CA--C 1.542 0.913 0 C-N-CA 122.144 1.896 . . . . 0.0 109.919 173.155 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -51.89 -32.7 33.59 Favored 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 113.765 1.024 . . . . 0.0 113.765 178.486 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 17.6 p -71.05 -14.08 62.2 Favored 'General case' 0 N--CA 1.473 0.725 0 C-N-CA 125.906 1.682 . . . . 0.0 115.021 178.481 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 74.3 mm-40 -123.78 -22.85 4.82 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 125.692 1.597 . . . . 0.0 115.23 -174.268 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 4.6 t -65.14 168.18 7.08 Favored 'General case' 0 CA--C 1.548 0.898 0 N-CA-C 115.937 1.829 . . . . 0.0 115.937 -175.527 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -80.41 -18.98 47.27 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 128.075 2.55 . . . . 0.0 113.102 -179.755 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 67.5 m-85 -145.2 178.37 8.12 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 126.625 1.97 . . . . 0.0 110.598 -178.061 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -79.37 151.13 31.15 Favored 'General case' 0 CA--C 1.547 0.864 0 O-C-N 120.812 -1.18 . . . . 0.0 113.404 -178.071 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 59.5 m170 -125.41 87.73 55.24 Favored Pre-proline 0 CA--C 1.549 0.932 0 C-N-CA 126.128 1.771 . . . . 0.0 110.355 179.576 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -64.32 147.32 90.9 Favored 'Trans proline' 0 C--N 1.352 0.754 0 C-N-CA 123.237 2.625 . . . . 0.0 114.379 -177.885 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 60.2 p -84.59 -176.31 6.18 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 124.685 1.194 . . . . 0.0 111.79 174.735 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 47.1 mmtm -61.04 -18.75 59.52 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 125.259 1.424 . . . . 0.0 113.253 173.084 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 42.1 m -109.17 -20.6 12.93 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 125.133 1.373 . . . . 0.0 114.563 -178.9 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 97.0 m -65.45 132.93 50.19 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-N 119.357 0.981 . . . . 0.0 112.659 179.862 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 33.9 mt-30 -77.24 138.43 39.41 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 123.271 0.628 . . . . 0.0 111.011 176.766 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 11.8 t -127.87 147.08 32.58 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.897 0 C-N-CA 125.666 1.586 . . . . 0.0 110.986 -176.895 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 4.3 pt-20 -149.02 117.48 6.51 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 125.188 1.395 . . . . 0.0 114.062 -179.349 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 75.0 m-20 40.66 30.46 0.09 Allowed 'General case' 0 CA--C 1.553 1.073 0 C-N-CA 127.536 2.334 . . . . 0.0 116.986 174.987 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 109.17 5.5 30.41 Favored Glycine 0 CA--C 1.536 1.371 0 C-N-CA 124.656 1.122 . . . . 0.0 114.932 -178.995 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 34.3 mtt180 -133.87 165.41 25.07 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 119.236 1.518 . . . . 0.0 112.508 179.04 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 3.8 m -140.42 145.79 25.39 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.534 0 C-N-CA 127.992 2.517 . . . . 0.0 109.107 -179.417 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 17.8 mt -94.13 131.44 41.01 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 O-C-N 121.003 -1.061 . . . . 0.0 110.201 -178.485 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -77.65 148.21 35.16 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 124.095 0.958 . . . . 0.0 111.659 178.632 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 21.5 t -70.63 98.94 1.58 Allowed 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 124.9 1.28 . . . . 0.0 112.582 -177.409 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 29.5 p90 -60.78 -38.34 84.95 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 123.652 0.781 . . . . 0.0 110.512 175.789 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 60.9 m-20 -59.59 -38.44 81.25 Favored 'General case' 0 CA--C 1.543 0.703 0 O-C-N 121.719 -0.613 . . . . 0.0 110.436 176.66 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 24.7 p -65.49 -41.71 92.98 Favored 'General case' 0 N--CA 1.472 0.632 0 CA-C-N 119.929 1.241 . . . . 0.0 112.164 177.832 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 33.6 mt -68.71 -41.25 79.34 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 124.756 1.222 . . . . 0.0 112.638 177.913 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 14.2 mmmm -77.53 -8.78 58.34 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 124.586 1.155 . . . . 0.0 113.437 178.743 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 78.71 41.12 16.02 Favored Glycine 0 CA--C 1.536 1.369 0 C-N-CA 124.733 1.158 . . . . 0.0 113.632 179.265 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 65.1 ttt-85 -123.64 -22.9 4.86 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 126.85 2.06 . . . . 0.0 114.873 -175.571 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 5.6 t . . . . . 0 CA--C 1.545 0.768 0 CA-C-N 119.24 0.927 . . . . 0.0 112.973 -178.0 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 4.5 t . . . . . 0 CA--C 1.546 0.813 0 CA-C-O 121.542 0.687 . . . . 0.0 112.525 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 32.3 mtmt -84.17 3.11 36.51 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 125.182 1.393 . . . . 0.0 113.868 -177.98 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 87.9 m-85 -125.46 152.87 44.34 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 124.944 1.298 . . . . 0.0 111.935 -175.298 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -76.38 117.42 18.03 Favored 'General case' 0 N--CA 1.465 0.307 0 C-N-CA 123.708 0.803 . . . . 0.0 112.213 -176.471 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 12.9 m170 -72.31 115.7 41.68 Favored Pre-proline 0 CA--C 1.547 0.859 0 N-CA-C 107.962 -1.125 . . . . 0.0 107.962 174.215 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_exo -48.87 115.22 1.56 Allowed 'Trans proline' 0 CA--C 1.542 0.905 0 C-N-CA 124.802 3.668 . . . . 0.0 115.696 -176.104 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 92.2 Cg_endo -78.88 153.65 25.77 Favored 'Trans proline' 0 CA--C 1.544 1.02 0 C-N-CA 121.887 1.725 . . . . 0.0 111.283 177.6 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 86.6 Cg_exo -47.16 -36.99 22.78 Favored 'Trans proline' 0 CA--C 1.537 0.664 0 C-N-CA 124.189 3.26 . . . . 0.0 115.704 179.682 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 69.8 m80 -79.63 -10.35 59.78 Favored 'General case' 0 N--CA 1.473 0.704 0 N-CA-C 115.588 1.699 . . . . 0.0 115.588 -179.643 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.483 HD13 HD21 ' A' ' 16' ' ' LEU . 79.9 mt -119.42 -14.55 9.16 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 124.512 1.125 . . . . 0.0 113.287 177.721 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 23.8 mtpp -54.45 -34.8 62.16 Favored 'General case' 0 N--CA 1.477 0.915 0 CA-C-N 119.451 1.023 . . . . 0.0 111.409 173.363 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 21.7 m -62.92 -45.71 91.2 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 123.877 0.871 . . . . 0.0 111.202 176.068 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 92.6 mm-40 -66.03 -44.99 83.05 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 123.604 0.761 . . . . 0.0 110.954 177.665 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 76.5 mt -60.72 -45.24 94.99 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 123.742 0.817 . . . . 0.0 112.212 177.809 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -66.85 -36.5 82.47 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-N 119.578 1.081 . . . . 0.0 111.886 177.343 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 63.9 mt -62.06 -42.05 93.49 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.754 0 CA-C-N 119.117 0.871 . . . . 0.0 109.797 175.384 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 86.4 m-20 -61.74 -47.12 86.64 Favored 'General case' 0 CA--C 1.543 0.704 0 O-C-N 121.861 -0.525 . . . . 0.0 110.395 175.32 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 1.058 0 C-N-CA 124.595 1.093 . . . . 0.0 113.105 179.355 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.475 0.79 0 N-CA-C 114.113 1.153 . . . . 0.0 114.113 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 90.7 mt -91.72 -12.02 35.18 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 127.22 2.208 . . . . 0.0 114.423 -177.822 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 9.6 m -79.03 74.2 5.56 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 124.678 1.191 . . . . 0.0 110.898 -177.792 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.533 HD21 HD13 ' A' ' 75' ' ' LEU . 9.8 tp -75.7 143.73 41.96 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 126.845 2.058 . . . . 0.0 111.853 -178.047 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 8.2 mt-10 -69.54 150.29 47.28 Favored 'General case' 0 N--CA 1.472 0.67 0 O-C-N 120.766 -1.209 . . . . 0.0 112.308 178.735 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 21.3 m -82.15 148.85 5.01 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 N-CA-C 109.303 -0.628 . . . . 0.0 109.303 173.545 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 49.6 t -66.01 130.92 44.91 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-O 121.757 0.789 . . . . 0.0 111.01 178.124 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 2.8 mpt_? -69.41 -33.75 73.47 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 125.667 1.587 . . . . 0.0 112.192 -177.725 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 14.8 mm-40 -77.9 -34.5 51.42 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 123.676 0.79 . . . . 0.0 110.998 178.36 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 74.6 t80 -62.59 -27.51 69.24 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 124.452 1.101 . . . . 0.0 111.365 175.222 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 54.4 mm-40 -65.03 -19.5 66.03 Favored 'General case' 0 N--CA 1.475 0.825 0 N-CA-C 112.806 0.669 . . . . 0.0 112.806 175.337 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 6.9 mpt_? -111.75 10.2 20.9 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 126.477 1.911 . . . . 0.0 111.56 177.012 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 58.32 36.31 82.83 Favored Glycine 0 CA--C 1.533 1.213 0 C-N-CA 125.463 1.506 . . . . 0.0 114.287 -179.957 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 6.2 t -130.84 11.9 5.2 Favored 'General case' 0 N--CA 1.478 0.963 0 N-CA-C 115.117 1.525 . . . . 0.0 115.117 -175.388 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 36.8 t -61.45 139.11 58.27 Favored 'General case' 0 CA--C 1.551 1.017 0 O-C-N 121.318 -0.864 . . . . 0.0 110.988 176.165 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 78.2 p -89.23 0.67 56.59 Favored 'General case' 0 N--CA 1.472 0.631 0 N-CA-C 115.686 1.735 . . . . 0.0 115.686 -176.755 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 68.0 mtt180 -132.65 145.35 56.79 Favored Pre-proline 0 N--CA 1.475 0.803 0 C-N-CA 125.19 1.396 . . . . 0.0 113.042 -177.131 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -68.94 166.14 27.58 Favored 'Trans proline' 0 CA--C 1.543 0.965 0 C-N-CA 122.39 2.06 . . . . 0.0 110.125 172.878 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -52.23 -32.1 35.21 Favored 'General case' 0 N--CA 1.477 0.89 0 N-CA-C 113.868 1.062 . . . . 0.0 113.868 178.022 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 22.4 p -72.14 -13.71 61.63 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 125.585 1.554 . . . . 0.0 114.941 178.553 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 70.8 mm-40 -125.35 -22.25 4.38 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 125.574 1.55 . . . . 0.0 115.182 -174.623 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' CYS . . . . . 0.42 ' SG ' ' NZ ' ' A' ' 35' ' ' LYS . 14.3 t -60.03 162.75 5.35 Favored 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 115.37 1.618 . . . . 0.0 115.37 -176.509 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.42 ' NZ ' ' SG ' ' A' ' 34' ' ' CYS . 0.0 OUTLIER -80.42 -13.65 58.95 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 126.748 2.019 . . . . 0.0 112.821 177.959 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 70.3 m-85 -141.61 175.92 9.31 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 126.657 1.983 . . . . 0.0 111.151 -178.76 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -81.57 151.3 27.77 Favored 'General case' 0 CA--C 1.551 1.008 0 O-C-N 120.753 -1.217 . . . . 0.0 113.599 -178.283 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 56.0 m170 -124.67 91.28 49.7 Favored Pre-proline 0 CA--C 1.551 1.001 0 C-N-CA 126.006 1.722 . . . . 0.0 111.168 179.419 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo -66.49 167.05 19.81 Favored 'Trans proline' 0 CA--C 1.542 0.922 0 C-N-CA 123.678 2.919 . . . . 0.0 114.395 -179.237 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 59.7 p -125.04 -174.28 3.01 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 126.116 1.766 . . . . 0.0 111.954 177.401 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 30.9 mmmt -49.48 -26.58 3.49 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 127.31 2.244 . . . . 0.0 116.323 -179.378 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 21.1 m -109.05 -19.07 13.51 Favored 'General case' 0 N--CA 1.481 1.082 0 N-CA-C 114.506 1.299 . . . . 0.0 114.506 -179.389 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 58.3 m -63.49 135.43 56.88 Favored 'General case' 0 CA--C 1.543 0.7 0 CA-C-N 119.359 0.981 . . . . 0.0 113.137 -178.734 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 40.4 tt0 -85.29 127.6 34.38 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 125.519 1.527 . . . . 0.0 110.044 178.716 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 20.1 t -120.45 133.6 66.64 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 C-N-CA 125.523 1.529 . . . . 0.0 109.51 -178.162 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 -143.19 130.44 20.89 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 125.016 1.326 . . . . 0.0 110.864 -179.118 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 45.59 36.65 2.68 Favored 'General case' 0 CA--C 1.555 1.147 0 C-N-CA 126.451 1.9 . . . . 0.0 115.366 178.936 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 81.18 19.94 65.88 Favored Glycine 0 CA--C 1.536 1.387 0 O-C-N 120.956 -1.09 . . . . 0.0 114.579 -179.856 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 63.4 mtt180 -138.69 163.25 32.61 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 125.995 1.718 . . . . 0.0 110.938 -179.16 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 3.3 m -138.17 140.07 40.94 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.501 0 C-N-CA 126.613 1.965 . . . . 0.0 109.381 -177.91 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 54.7 mt -90.32 130.63 39.25 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.662 0 O-C-N 121.544 -0.723 . . . . 0.0 109.528 -178.952 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -74.99 150.56 38.94 Favored 'General case' 0 CA--C 1.551 0.982 0 C-N-CA 123.782 0.833 . . . . 0.0 112.556 178.642 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 2.5 t -68.35 91.51 0.39 Allowed 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 125.614 1.566 . . . . 0.0 110.85 -178.375 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 25.2 p90 -56.48 -36.94 69.69 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 124.167 0.987 . . . . 0.0 111.498 178.996 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 72.7 m-20 -61.82 -33.7 74.6 Favored 'General case' 0 CA--C 1.54 0.592 0 O-C-N 121.878 -0.514 . . . . 0.0 111.597 177.43 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 30.4 t -70.39 -41.21 73.32 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-N 119.678 1.126 . . . . 0.0 110.769 177.254 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 42.0 mt -66.74 -41.11 88.38 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.01 0.924 . . . . 0.0 112.912 176.075 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 32.1 mmmt -81.32 -7.53 59.59 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 125.114 1.365 . . . . 0.0 114.203 -179.302 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 77.61 39.95 23.98 Favored Glycine 0 CA--C 1.537 1.431 0 C-N-CA 124.505 1.05 . . . . 0.0 114.12 178.889 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 50.4 ttp180 -125.98 -16.54 5.57 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 126.758 2.023 . . . . 0.0 114.79 -176.546 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 4.7 t . . . . . 0 CA--C 1.544 0.713 0 CA-C-N 119.448 1.022 . . . . 0.0 113.322 -176.233 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 63.2 m . . . . . 0 CA--C 1.537 0.48 0 N-CA-C 114.506 1.298 . . . . 0.0 114.506 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 19.1 mtmt -80.66 4.0 20.17 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-N 114.916 -1.038 . . . . 0.0 111.459 173.991 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 65.5 m-85 -125.61 144.94 50.36 Favored 'General case' 0 N--CA 1.447 -0.605 0 C-N-CA 126.416 1.886 . . . . 0.0 110.21 -174.24 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -72.81 117.56 14.66 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 123.817 0.847 . . . . 0.0 112.252 -176.017 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 3.8 m-70 -65.4 123.97 85.82 Favored Pre-proline 0 CA--C 1.546 0.801 0 N-CA-C 105.865 -1.902 . . . . 0.0 105.865 170.328 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -70.02 122.87 9.46 Favored 'Trans proline' 0 CA--C 1.544 0.992 0 C-N-CA 121.946 1.764 . . . . 0.0 113.938 -170.932 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 94.5 Cg_endo -77.82 153.29 29.41 Favored 'Trans proline' 0 CA--C 1.543 0.962 0 C-N-CA 123.264 2.643 . . . . 0.0 112.015 179.261 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 80.6 Cg_exo -45.69 -42.9 19.09 Favored 'Trans proline' 0 CA--C 1.538 0.72 0 C-N-CA 124.319 3.346 . . . . 0.0 115.844 179.883 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 17.4 t-80 -70.77 -15.22 62.66 Favored 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 114.938 1.458 . . . . 0.0 114.938 -179.786 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.533 HD13 HD21 ' A' ' 16' ' ' LEU . 81.1 mt -112.55 -18.17 12.46 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 124.562 1.145 . . . . 0.0 112.975 178.622 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 57.4 mtpt -54.09 -35.76 62.45 Favored 'General case' 0 N--CA 1.478 0.941 0 CA-C-N 119.83 1.195 . . . . 0.0 111.593 174.852 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 22.4 m -62.83 -45.63 91.72 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 124.081 0.952 . . . . 0.0 111.374 175.691 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 76.2 mt-30 -64.21 -46.93 81.71 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 123.634 0.774 . . . . 0.0 110.711 177.449 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 92.4 mt -61.42 -45.8 92.77 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 124.205 1.002 . . . . 0.0 112.549 179.244 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 7.5 pt-20 -66.03 -37.01 84.79 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-N 119.91 1.232 . . . . 0.0 111.98 177.972 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 61.9 mt -61.59 -40.74 87.65 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 CA-C-N 119.215 0.916 . . . . 0.0 110.131 176.304 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 79.5 m-20 -67.59 -47.03 70.87 Favored 'General case' 0 CA--C 1.546 0.819 0 O-C-N 121.918 -0.489 . . . . 0.0 110.803 175.477 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.954 0 C-N-CA 125.114 1.34 . . . . 0.0 113.62 -179.278 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.543 0.696 0 N-CA-C 114.743 1.386 . . . . 0.0 114.743 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 83.5 mt -93.12 -18.52 22.49 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 126.362 1.865 . . . . 0.0 114.555 -176.605 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 2.6 m -73.71 75.3 1.56 Allowed 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 124.645 1.178 . . . . 0.0 111.863 -178.847 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -75.65 146.07 40.56 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 128.391 2.676 . . . . 0.0 111.094 -178.456 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 12.0 mt-10 -76.04 153.0 36.76 Favored 'General case' 0 N--CA 1.472 0.667 0 O-C-N 120.215 -1.553 . . . . 0.0 112.835 178.386 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 10.8 m -84.4 154.43 3.63 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.73 0 C-N-CA 122.748 0.419 . . . . 0.0 110.279 173.904 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 48.8 t -71.41 139.18 49.63 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-O 121.23 0.538 . . . . 0.0 110.361 176.609 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 3.8 mpt_? -68.59 -38.39 80.61 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 125.306 1.443 . . . . 0.0 112.452 -177.635 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 17.0 mm-40 -74.63 -33.78 62.64 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 123.918 0.887 . . . . 0.0 110.927 178.489 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 51.1 t80 -64.71 -22.78 67.06 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 123.801 0.841 . . . . 0.0 112.065 175.315 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 76.9 mt-30 -59.12 -22.58 61.09 Favored 'General case' 0 N--CA 1.477 0.882 0 O-C-N 121.568 -0.707 . . . . 0.0 112.872 175.526 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -116.62 14.26 15.41 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 125.741 1.616 . . . . 0.0 111.91 177.24 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 58.36 37.75 88.48 Favored Glycine 0 CA--C 1.534 1.227 0 C-N-CA 125.333 1.444 . . . . 0.0 114.228 -179.61 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 5.5 t -127.73 9.61 6.47 Favored 'General case' 0 N--CA 1.479 1.023 0 N-CA-C 114.632 1.345 . . . . 0.0 114.632 -175.279 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 34.6 t -62.7 134.61 56.57 Favored 'General case' 0 CA--C 1.55 0.947 0 O-C-N 120.927 -1.108 . . . . 0.0 111.021 175.729 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 27.8 m -79.37 2.79 20.34 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 125.69 1.596 . . . . 0.0 115.293 -177.358 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 71.2 mtm-85 -132.62 146.93 63.53 Favored Pre-proline 0 N--CA 1.474 0.775 0 C-N-CA 125.033 1.333 . . . . 0.0 113.733 -174.876 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 95.0 Cg_endo -71.01 166.87 27.75 Favored 'Trans proline' 0 CA--C 1.545 1.047 0 C-N-CA 122.337 2.024 . . . . 0.0 109.792 170.738 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -53.9 -32.4 53.22 Favored 'General case' 0 N--CA 1.477 0.924 0 O-C-N 121.157 -0.965 . . . . 0.0 112.79 177.681 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 26.9 p -71.16 -8.28 52.46 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 125.876 1.671 . . . . 0.0 115.147 178.158 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 20.5 mt-10 -125.14 -25.81 3.77 Favored 'General case' 0 N--CA 1.476 0.854 0 N-CA-C 115.439 1.644 . . . . 0.0 115.439 -177.587 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 4.2 t -70.16 164.23 24.65 Favored 'General case' 0 CA--C 1.548 0.878 0 N-CA-C 115.154 1.539 . . . . 0.0 115.154 -177.01 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 75.0 mmtt -81.31 -10.55 59.55 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 127.272 2.229 . . . . 0.0 113.25 179.949 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 73.7 m-85 -139.15 175.66 9.36 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 126.878 2.071 . . . . 0.0 110.196 179.497 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -86.11 150.13 24.64 Favored 'General case' 0 CA--C 1.546 0.805 0 O-C-N 121.213 -0.93 . . . . 0.0 113.458 -177.655 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 61.5 m170 -122.17 90.62 49.02 Favored Pre-proline 0 CA--C 1.554 1.128 0 C-N-CA 125.573 1.549 . . . . 0.0 111.056 179.222 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 30.8 Cg_endo -62.36 161.35 27.64 Favored 'Trans proline' 0 C--N 1.355 0.878 0 C-N-CA 123.62 2.88 . . . . 0.0 114.878 -178.874 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 52.5 p -113.44 -174.21 2.42 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 125.655 1.582 . . . . 0.0 112.265 177.439 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 58.0 mtmt -52.55 -25.4 10.36 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 126.873 2.069 . . . . 0.0 115.512 178.981 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 42.7 m -109.07 -19.83 13.23 Favored 'General case' 0 N--CA 1.478 0.968 0 N-CA-C 114.827 1.418 . . . . 0.0 114.827 -179.07 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 63.8 m -62.82 133.72 55.16 Favored 'General case' 0 CA--C 1.541 0.611 0 CA-C-N 119.471 1.032 . . . . 0.0 113.419 -179.107 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 35.5 mt-30 -81.92 139.14 34.81 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 123.41 0.684 . . . . 0.0 110.888 175.769 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 12.0 t -131.49 138.71 52.44 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.794 0 C-N-CA 125.413 1.485 . . . . 0.0 110.59 -177.275 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -145.69 132.75 20.33 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 125.093 1.357 . . . . 0.0 111.128 177.879 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 63.1 t30 42.78 37.14 0.97 Allowed 'General case' 0 CA--C 1.552 1.021 0 C-N-CA 126.684 1.994 . . . . 0.0 116.105 177.89 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 84.25 17.18 65.23 Favored Glycine 0 CA--C 1.536 1.402 0 O-C-N 120.998 -1.064 . . . . 0.0 114.848 -179.62 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 64.1 mtt180 -136.48 160.28 39.24 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 125.617 1.567 . . . . 0.0 111.736 -179.546 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 3.2 m -138.79 139.31 41.02 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.491 0 C-N-CA 127.63 2.372 . . . . 0.0 110.392 -176.459 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 59.1 mt -87.19 129.08 39.23 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.78 0 O-C-N 121.118 -0.988 . . . . 0.0 109.716 -179.788 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -75.13 149.87 38.92 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 124.185 0.994 . . . . 0.0 111.74 178.14 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 18.8 t -68.93 99.87 1.12 Allowed 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 124.682 1.193 . . . . 0.0 113.061 -177.045 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 33.2 p90 -61.83 -38.0 86.55 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 115.071 -0.968 . . . . 0.0 110.229 175.064 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 70.0 m-20 -62.22 -44.28 96.93 Favored 'General case' 0 CA--C 1.537 0.452 0 O-C-N 121.755 -0.591 . . . . 0.0 110.612 176.962 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 41.6 t -63.94 -41.79 97.51 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-N 119.631 1.105 . . . . 0.0 111.509 177.516 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 31.3 mt -63.57 -40.53 97.21 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 123.774 0.83 . . . . 0.0 112.875 176.286 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 32.2 mmmt -82.87 -9.07 59.49 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 124.878 1.271 . . . . 0.0 113.845 179.589 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 80.84 38.18 17.01 Favored Glycine 0 CA--C 1.537 1.463 0 C-N-CA 124.722 1.154 . . . . 0.0 114.103 179.571 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 50.3 ttp180 -120.75 -19.47 7.35 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 126.631 1.972 . . . . 0.0 114.83 -176.525 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 4.8 t . . . . . 0 CA--C 1.546 0.796 0 CA-C-N 119.311 0.96 . . . . 0.0 113.562 -177.789 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 7.9 t . . . . . 0 CA--C 1.542 0.67 0 CA-C-O 121.655 0.74 . . . . 0.0 111.465 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 25.7 mtmt -80.46 0.78 32.03 Favored 'General case' 0 N--CA 1.474 0.771 0 N-CA-C 114.007 1.114 . . . . 0.0 114.007 -177.532 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 80.8 m-85 -125.58 154.35 42.36 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 125.127 1.371 . . . . 0.0 111.394 -175.127 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -76.69 113.15 14.02 Favored 'General case' 0 CA--C 1.533 0.312 0 O-C-N 121.654 -0.654 . . . . 0.0 112.265 -176.258 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 8.3 m170 -64.49 127.08 91.9 Favored Pre-proline 0 CA--C 1.545 0.768 0 N-CA-C 106.892 -1.521 . . . . 0.0 106.892 172.48 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 89.7 Cg_endo -72.97 120.73 6.79 Favored 'Trans proline' 0 CA--C 1.546 1.075 0 C-N-CA 122.401 2.067 . . . . 0.0 114.06 -170.757 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 94.3 Cg_endo -77.05 153.41 32.31 Favored 'Trans proline' 0 CA--C 1.544 1.001 0 C-N-CA 123.206 2.604 . . . . 0.0 111.973 178.297 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_exo -46.27 -41.45 22.28 Favored 'Trans proline' 0 CA--C 1.538 0.706 0 C-N-CA 124.156 3.237 . . . . 0.0 115.753 179.449 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 57.3 m80 -72.4 -13.7 61.52 Favored 'General case' 0 N--CA 1.475 0.805 0 N-CA-C 115.181 1.548 . . . . 0.0 115.181 179.605 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 92.1 mt -114.13 -17.21 11.96 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 124.426 1.091 . . . . 0.0 112.949 177.565 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 56.0 mtpt -54.89 -38.91 68.16 Favored 'General case' 0 N--CA 1.478 0.944 0 CA-C-N 119.931 1.241 . . . . 0.0 111.85 174.944 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 4.7 m -63.02 -38.51 91.48 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 123.728 0.811 . . . . 0.0 111.777 176.753 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 92.5 mm-40 -69.95 -49.57 50.49 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 123.175 0.59 . . . . 0.0 109.721 177.638 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 95.4 mt -58.47 -47.04 85.37 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 124.134 0.974 . . . . 0.0 113.056 178.767 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -62.97 -32.25 73.54 Favored 'General case' 0 N--CA 1.475 0.811 0 CA-C-N 119.932 1.242 . . . . 0.0 112.444 178.759 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 57.0 mt -74.73 -42.58 47.63 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.584 0 C-N-CA 123.858 0.863 . . . . 0.0 110.269 175.783 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 26.5 m120 -60.64 -36.17 78.01 Favored 'General case' 0 CA--C 1.543 0.692 0 CA-C-N 119.406 1.003 . . . . 0.0 110.423 174.75 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 1.295 0 C-N-CA 125.18 1.371 . . . . 0.0 113.643 176.56 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 2.5 p90 . . . . . 0 N--CA 1.476 0.857 0 N-CA-C 114.308 1.225 . . . . 0.0 114.308 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 94.8 mt -105.03 -10.13 17.4 Favored 'General case' 0 CA--C 1.539 0.522 0 N-CA-C 116.269 1.952 . . . . 0.0 116.269 -172.263 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 4.0 m -75.01 79.7 2.2 Favored 'General case' 0 N--CA 1.479 1.015 0 CA-C-N 120.474 1.488 . . . . 0.0 112.208 -179.044 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -75.68 144.59 41.53 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 127.066 2.146 . . . . 0.0 112.41 -177.908 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 10.3 mt-10 -74.89 150.96 38.99 Favored 'General case' 0 N--CA 1.474 0.771 0 O-C-N 120.688 -1.258 . . . . 0.0 111.916 176.577 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 15.9 m -82.06 150.89 4.3 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.795 0 N-CA-C 109.816 -0.439 . . . . 0.0 109.816 174.362 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 53.5 t -63.82 130.7 45.23 Favored 'General case' 0 C--O 1.237 0.43 0 CA-C-O 122.552 1.168 . . . . 0.0 111.349 177.671 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 3.3 mpt_? -68.45 -25.3 64.93 Favored 'General case' 0 N--CA 1.465 0.296 0 C-N-CA 124.716 1.207 . . . . 0.0 112.244 -178.582 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -84.21 -37.61 21.6 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 123.125 0.57 . . . . 0.0 110.017 177.303 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 63.5 t80 -62.0 -31.24 71.6 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 124.823 1.249 . . . . 0.0 110.884 174.982 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 12.4 mm100 -62.98 -15.81 57.44 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 123.928 0.891 . . . . 0.0 113.294 175.264 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 6.2 mpt_? -120.32 13.4 11.91 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 126.605 1.962 . . . . 0.0 111.464 177.058 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 57.96 35.82 77.84 Favored Glycine 0 CA--C 1.533 1.197 0 C-N-CA 125.396 1.474 . . . . 0.0 114.375 179.888 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 6.4 t -131.13 11.04 5.0 Favored 'General case' 0 N--CA 1.477 0.91 0 N-CA-C 115.128 1.529 . . . . 0.0 115.128 -175.527 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 44.3 t -60.7 136.57 58.11 Favored 'General case' 0 CA--C 1.548 0.891 0 CA-C-N 119.091 0.86 . . . . 0.0 110.523 176.078 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 80.2 p -93.01 6.37 48.15 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 125.541 1.537 . . . . 0.0 114.394 -178.235 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 57.2 mtm-85 -129.64 151.49 78.14 Favored Pre-proline 0 N--CA 1.474 0.76 0 C-N-CA 125.253 1.421 . . . . 0.0 113.795 -173.946 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 95.1 Cg_endo -74.59 163.88 35.01 Favored 'Trans proline' 0 CA--C 1.542 0.88 0 C-N-CA 122.429 2.086 . . . . 0.0 109.419 172.338 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 -54.62 -28.11 44.29 Favored 'General case' 0 N--CA 1.475 0.821 0 N-CA-C 113.407 0.891 . . . . 0.0 113.407 176.477 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 22.1 p -73.85 -17.43 61.06 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 125.57 1.548 . . . . 0.0 115.126 178.948 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -115.65 -31.08 5.96 Favored 'General case' 0 N--CA 1.478 0.939 0 N-CA-C 114.295 1.22 . . . . 0.0 114.295 -179.277 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 4.7 t -56.77 147.11 23.91 Favored 'General case' 0 CA--C 1.545 0.756 0 CA-C-O 122.735 1.255 . . . . 0.0 113.887 -175.63 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 39.6 mmtm -81.88 4.83 20.92 Favored 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 126.475 1.91 . . . . 0.0 113.145 -177.706 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 75.6 m-85 -143.76 170.18 16.35 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 128.633 2.773 . . . . 0.0 108.631 175.913 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -84.24 153.53 23.55 Favored 'General case' 0 CA--C 1.547 0.863 0 N-CA-C 114.526 1.306 . . . . 0.0 114.526 -177.048 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 65.0 m170 -124.58 90.66 50.61 Favored Pre-proline 0 CA--C 1.55 0.943 0 C-N-CA 126.203 1.801 . . . . 0.0 110.361 178.048 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 34.7 Cg_endo -64.0 148.53 91.56 Favored 'Trans proline' 0 CA--C 1.539 0.754 0 C-N-CA 123.31 2.674 . . . . 0.0 114.483 -177.535 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 52.9 p -86.72 -175.88 5.58 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 125.114 1.366 . . . . 0.0 112.228 175.847 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 58.0 mtmt -60.72 -20.04 60.2 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 125.556 1.542 . . . . 0.0 113.472 173.645 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 49.1 m -109.11 -20.81 12.87 Favored 'General case' 0 N--CA 1.477 0.897 0 N-CA-C 114.436 1.273 . . . . 0.0 114.436 -179.594 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 84.5 m -63.94 134.87 55.89 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 119.498 1.044 . . . . 0.0 113.193 179.878 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 35.7 mt-30 -81.45 142.1 33.27 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 123.181 0.592 . . . . 0.0 111.253 176.669 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 11.8 t -132.34 138.16 52.87 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.865 0 C-N-CA 125.404 1.481 . . . . 0.0 110.573 -177.748 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -146.21 132.66 19.68 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 125.298 1.439 . . . . 0.0 111.391 178.194 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 62.5 t30 41.26 37.94 0.7 Allowed 'General case' 0 CA--C 1.553 1.073 0 C-N-CA 126.99 2.116 . . . . 0.0 116.578 177.16 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 87.77 13.73 64.32 Favored Glycine 0 CA--C 1.535 1.335 0 O-C-N 120.997 -1.064 . . . . 0.0 115.188 179.777 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 56.0 mtt180 -136.56 164.16 28.85 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 125.421 1.488 . . . . 0.0 111.432 179.39 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 5.2 m -134.34 176.81 8.0 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 C-N-CA 129.127 2.971 . . . . 0.0 107.493 179.623 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 59.1 mt -126.71 130.07 71.57 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.833 0 CA-C-N 119.78 1.173 . . . . 0.0 108.786 179.589 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -73.04 147.62 44.89 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 123.758 0.823 . . . . 0.0 111.931 177.873 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 13.9 t -69.75 99.37 1.34 Allowed 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 125.067 1.347 . . . . 0.0 113.35 -176.432 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 26.4 p90 -61.92 -37.94 86.56 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 115.191 -0.913 . . . . 0.0 110.013 174.34 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 70.3 m-20 -61.44 -43.09 99.47 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 123.099 0.559 . . . . 0.0 110.851 177.193 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 44.6 t -64.66 -43.23 94.26 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-N 119.506 1.048 . . . . 0.0 111.566 177.911 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 34.3 mt -65.39 -36.99 85.65 Favored 'General case' 0 CA--C 1.542 0.665 0 N-CA-C 113.378 0.881 . . . . 0.0 113.378 177.124 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 29.7 mmmt -88.17 -5.62 58.32 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 125.197 1.399 . . . . 0.0 114.509 -178.32 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 81.02 39.84 12.48 Favored Glycine 0 CA--C 1.536 1.38 0 C-N-CA 124.506 1.05 . . . . 0.0 114.384 178.221 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 71.9 ttt-85 -123.64 -21.52 5.21 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 126.546 1.939 . . . . 0.0 114.695 -176.63 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 5.5 t . . . . . 0 CA--C 1.545 0.765 0 CA-C-N 119.431 1.014 . . . . 0.0 113.387 -177.396 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 9.0 t . . . . . 0 CA--C 1.544 0.744 0 CA-C-O 121.531 0.681 . . . . 0.0 111.607 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 31.8 mtmt -84.17 2.33 40.21 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 124.62 1.168 . . . . 0.0 113.63 -177.87 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 84.4 m-85 -125.08 154.36 41.5 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 125.384 1.473 . . . . 0.0 111.908 -175.521 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -78.07 114.72 17.22 Favored 'General case' 0 N--CA 1.465 0.318 0 C-N-CA 123.989 0.915 . . . . 0.0 112.155 -176.619 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 11.0 m170 -70.2 115.17 31.73 Favored Pre-proline 0 CA--C 1.546 0.8 0 N-CA-C 108.094 -1.076 . . . . 0.0 108.094 174.654 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 81.1 Cg_exo -48.89 114.07 1.12 Allowed 'Trans proline' 0 CA--C 1.543 0.928 0 C-N-CA 124.621 3.547 . . . . 0.0 116.794 -174.757 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_endo -77.02 155.78 33.9 Favored 'Trans proline' 0 CA--C 1.546 1.114 0 C-N-CA 122.658 2.238 . . . . 0.0 111.479 175.965 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 92.9 Cg_exo -43.58 -45.79 10.44 Favored 'Trans proline' 0 CA--C 1.539 0.73 0 C-N-CA 124.861 3.707 . . . . 0.0 116.531 -179.777 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -73.53 -12.61 60.83 Favored 'General case' 0 N--CA 1.478 0.971 0 N-CA-C 114.676 1.362 . . . . 0.0 114.676 -179.431 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 87.0 mt -112.64 -19.56 12.02 Favored 'General case' 0 N--CA 1.475 0.789 0 CA-C-N 119.458 1.026 . . . . 0.0 113.71 -179.717 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 54.3 mtpt -52.69 -39.66 62.17 Favored 'General case' 0 N--CA 1.48 1.035 0 CA-C-N 119.908 1.231 . . . . 0.0 111.426 174.252 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 24.7 m -63.19 -41.59 99.21 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 124.781 1.232 . . . . 0.0 111.92 176.926 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 16.9 mm100 -68.57 -44.39 74.54 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 123.56 0.744 . . . . 0.0 110.521 179.206 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 81.0 mt -62.31 -46.63 87.89 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 123.376 0.67 . . . . 0.0 112.235 177.769 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -64.21 -29.78 70.87 Favored 'General case' 0 N--CA 1.476 0.854 0 CA-C-N 120.361 1.437 . . . . 0.0 113.106 178.147 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 63.9 mt -71.15 -44.88 73.77 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.69 0 O-C-N 121.354 -0.841 . . . . 0.0 109.242 174.854 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 75.7 m-20 -62.15 -36.72 82.68 Favored 'General case' 0 CA--C 1.542 0.639 0 O-C-N 121.644 -0.66 . . . . 0.0 110.955 175.773 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.93 0 C-N-CA 124.513 1.054 . . . . 0.0 111.494 177.95 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.476 0.858 0 CA-C-O 120.804 0.335 . . . . 0.0 111.29 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 92.5 mt -89.76 -8.45 52.17 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 126.615 1.966 . . . . 0.0 114.268 -179.146 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 18.2 m -81.15 80.52 7.59 Favored 'General case' 0 N--CA 1.475 0.781 0 CA-C-O 122.13 0.966 . . . . 0.0 110.477 -178.625 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -75.77 145.21 40.95 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 128.613 2.765 . . . . 0.0 111.983 -178.232 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 52.8 mt-10 -72.33 150.99 43.02 Favored 'General case' 0 N--CA 1.47 0.564 0 O-C-N 120.487 -1.383 . . . . 0.0 112.615 176.899 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 16.8 m -86.69 156.49 3.3 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.971 0 C-N-CA 123.506 0.723 . . . . 0.0 111.418 174.359 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 49.1 t -77.66 129.69 35.88 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-O 121.607 0.718 . . . . 0.0 110.649 177.238 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 4.2 mpt_? -66.64 -28.99 68.92 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 124.418 1.087 . . . . 0.0 113.247 -177.462 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -78.13 -40.21 38.83 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 123.443 0.697 . . . . 0.0 109.518 177.79 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 64.3 t80 -63.24 -35.07 79.11 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 124.486 1.115 . . . . 0.0 111.298 175.957 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 13.8 mm100 -62.12 -15.31 44.65 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 124.227 1.011 . . . . 0.0 113.38 175.424 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 11.8 mtp-105 -120.76 12.67 11.41 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 127.233 2.213 . . . . 0.0 112.28 179.569 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 57.99 34.69 73.15 Favored Glycine 0 CA--C 1.536 1.354 0 C-N-CA 125.086 1.327 . . . . 0.0 113.9 -179.771 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 7.3 t -129.88 13.36 5.8 Favored 'General case' 0 N--CA 1.475 0.801 0 N-CA-C 114.906 1.447 . . . . 0.0 114.906 -175.196 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 6.5 t -69.53 171.7 8.45 Favored 'General case' 0 CA--C 1.556 1.182 0 O-C-N 121.413 -0.804 . . . . 0.0 110.542 173.823 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 50.7 m -135.45 13.57 3.49 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 125.059 1.344 . . . . 0.0 114.457 -176.796 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 51.0 mtt85 -135.45 145.97 55.81 Favored Pre-proline 0 N--CA 1.47 0.553 0 C-N-CA 125.301 1.44 . . . . 0.0 112.756 -176.349 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_endo -69.69 165.34 31.21 Favored 'Trans proline' 0 CA--C 1.545 1.06 0 C-N-CA 121.943 1.762 . . . . 0.0 109.744 171.323 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -54.6 -30.25 54.09 Favored 'General case' 0 N--CA 1.477 0.91 0 O-C-N 121.124 -0.985 . . . . 0.0 112.678 177.882 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 29.9 p -72.37 -8.43 54.93 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 126.268 1.827 . . . . 0.0 115.135 177.792 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 27.0 mm-40 -124.61 -24.86 4.1 Favored 'General case' 0 N--CA 1.476 0.868 0 N-CA-C 115.53 1.678 . . . . 0.0 115.53 -175.993 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 1.4 t -73.45 170.33 15.34 Favored 'General case' 0 CA--C 1.545 0.753 0 N-CA-C 115.361 1.615 . . . . 0.0 115.361 -175.921 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 13.0 mmmm -85.24 -13.16 50.74 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 126.807 2.043 . . . . 0.0 113.285 -179.377 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 56.7 m-85 -140.02 174.86 10.09 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 126.761 2.025 . . . . 0.0 109.598 179.001 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -83.65 151.04 25.51 Favored 'General case' 0 CA--C 1.545 0.784 0 N-CA-C 114.177 1.177 . . . . 0.0 114.177 -177.034 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 64.2 m170 -121.86 87.27 46.59 Favored Pre-proline 0 CA--C 1.553 1.068 0 C-N-CA 126.158 1.783 . . . . 0.0 110.888 179.572 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 39.5 Cg_endo -64.4 150.54 88.08 Favored 'Trans proline' 0 CA--C 1.54 0.808 0 C-N-CA 123.568 2.845 . . . . 0.0 114.912 -177.797 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 53.4 p -88.01 -174.93 4.9 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 124.945 1.298 . . . . 0.0 111.985 175.578 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 63.0 mttp -62.01 -18.67 61.28 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 125.523 1.529 . . . . 0.0 113.368 173.421 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 25.1 m -109.12 -22.4 12.14 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.917 1.287 . . . . 0.0 114.153 -179.079 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 89.6 m -63.58 138.35 58.47 Favored 'General case' 0 CA--C 1.542 0.651 0 CA-C-N 119.394 0.997 . . . . 0.0 113.175 179.586 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 16.3 mt-30 -80.66 136.2 36.17 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 124.663 1.185 . . . . 0.0 111.466 179.004 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 9.2 t -129.75 136.25 59.49 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.816 0 C-N-CA 124.958 1.303 . . . . 0.0 110.913 -178.084 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -146.99 131.8 18.01 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 125.286 1.435 . . . . 0.0 111.79 178.185 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 62.5 t30 39.46 39.3 0.47 Allowed 'General case' 0 CA--C 1.554 1.106 0 C-N-CA 127.28 2.232 . . . . 0.0 116.863 176.63 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 90.58 11.55 62.11 Favored Glycine 0 CA--C 1.536 1.374 0 O-C-N 121.101 -1.0 . . . . 0.0 115.393 179.465 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 42.1 mtm180 -136.17 164.9 26.98 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 125.53 1.532 . . . . 0.0 112.358 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 5.2 m -137.2 151.21 26.64 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.642 0 C-N-CA 128.12 2.568 . . . . 0.0 109.135 -179.93 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 17.2 mt -100.5 130.68 49.38 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.78 0 O-C-N 121.191 -0.943 . . . . 0.0 110.181 -178.306 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -78.31 149.79 33.41 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 123.946 0.898 . . . . 0.0 111.99 178.637 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 19.2 t -71.79 99.21 2.12 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 125.242 1.417 . . . . 0.0 113.039 -176.362 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 24.3 p90 -60.88 -36.83 80.21 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 123.574 0.75 . . . . 0.0 110.514 174.76 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 73.6 m-20 -61.3 -38.24 86.1 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 123.397 0.679 . . . . 0.0 111.199 177.338 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 31.2 p -64.72 -41.37 96.02 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 119.5 1.045 . . . . 0.0 112.216 178.058 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 38.5 mt -69.7 -40.74 76.13 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 124.575 1.15 . . . . 0.0 112.04 177.613 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 30.9 mmmt -76.31 -11.87 59.98 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 124.464 1.106 . . . . 0.0 113.71 178.482 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 78.5 35.75 31.96 Favored Glycine 0 CA--C 1.537 1.457 0 C-N-CA 124.563 1.078 . . . . 0.0 113.43 -179.508 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 50.8 ttp180 -116.66 -19.85 9.8 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 126.623 1.969 . . . . 0.0 114.378 -176.67 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 5.1 t . . . . . 0 CA--C 1.545 0.784 0 CA-C-N 119.078 0.854 . . . . 0.0 112.949 -177.879 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 4.2 t . . . . . 0 CA--C 1.542 0.647 0 CA-C-O 122.038 0.923 . . . . 0.0 112.518 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 33.8 mtmt -84.88 6.97 22.61 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 125.556 1.542 . . . . 0.0 113.636 -177.399 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 84.8 m-85 -129.14 151.88 49.33 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 125.192 1.397 . . . . 0.0 112.258 -174.589 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -77.2 118.61 19.88 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 123.723 0.809 . . . . 0.0 112.096 -176.992 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 11.2 m170 -71.4 115.91 41.96 Favored Pre-proline 0 CA--C 1.548 0.876 0 N-CA-C 108.045 -1.094 . . . . 0.0 108.045 174.381 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_exo -47.3 112.18 0.5 Allowed 'Trans proline' 0 CA--C 1.543 0.969 0 C-N-CA 125.015 3.81 . . . . 0.0 115.507 -176.231 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -75.68 148.82 33.19 Favored 'Trans proline' 0 CA--C 1.542 0.887 0 C-N-CA 122.052 1.835 . . . . 0.0 110.366 176.866 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_exo -47.32 -37.64 25.1 Favored 'Trans proline' 0 CA--C 1.539 0.748 0 C-N-CA 123.723 2.949 . . . . 0.0 115.193 179.433 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 6.8 t-80 -72.04 -16.94 62.05 Favored 'General case' 0 N--CA 1.472 0.659 0 N-CA-C 115.177 1.547 . . . . 0.0 115.177 179.778 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 90.9 mt -115.22 -15.78 11.6 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 124.735 1.214 . . . . 0.0 112.898 177.791 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 52.9 mtpt -53.98 -34.36 59.58 Favored 'General case' 0 N--CA 1.475 0.78 0 CA-C-N 119.662 1.119 . . . . 0.0 111.384 174.37 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 27.5 m -61.82 -47.13 86.47 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-N 118.723 0.692 . . . . 0.0 111.462 175.381 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 93.3 mm-40 -66.23 -43.56 86.28 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 123.772 0.829 . . . . 0.0 111.316 178.04 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 76.3 mt -62.53 -45.49 92.75 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 123.896 0.879 . . . . 0.0 111.984 178.085 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 5.3 pt-20 -66.11 -36.48 83.27 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-N 119.459 1.027 . . . . 0.0 112.153 177.859 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 51.2 mt -61.11 -39.84 83.75 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 CA-C-N 119.509 1.05 . . . . 0.0 110.386 177.193 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 29.4 m-80 -70.76 -43.5 68.66 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 123.216 0.606 . . . . 0.0 111.4 175.436 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.533 1.179 0 C-N-CA 124.242 0.925 . . . . 0.0 113.71 -179.665 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.542 0.666 0 N-CA-C 113.814 1.042 . . . . 0.0 113.814 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 82.6 mt -91.77 -16.6 26.6 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 127.021 2.128 . . . . 0.0 114.994 -176.998 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 7.0 m -77.41 77.14 3.94 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 124.314 1.046 . . . . 0.0 111.543 -177.096 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.442 HD21 HD13 ' A' ' 75' ' ' LEU . 13.0 tp -75.62 143.76 42.11 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 128.757 2.823 . . . . 0.0 112.007 -178.375 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 10.1 mt-10 -73.32 150.5 41.85 Favored 'General case' 0 N--CA 1.474 0.743 0 O-C-N 120.448 -1.407 . . . . 0.0 112.886 178.788 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 16.0 m -84.48 154.66 3.62 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.838 0 C-N-CA 122.805 0.442 . . . . 0.0 111.673 176.256 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 44.8 t -74.98 131.02 40.35 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-O 121.192 0.52 . . . . 0.0 109.829 175.316 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 4.5 mpt_? -68.29 -37.34 80.55 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 125.623 1.569 . . . . 0.0 112.976 -176.836 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 15.9 mm-40 -76.65 -33.54 58.31 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 123.848 0.859 . . . . 0.0 111.151 179.334 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 78.3 t80 -63.3 -27.79 69.57 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 123.964 0.906 . . . . 0.0 111.287 174.923 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 52.9 mm-40 -63.59 -19.6 64.97 Favored 'General case' 0 N--CA 1.476 0.858 0 N-CA-C 112.855 0.687 . . . . 0.0 112.855 175.307 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 6.7 mpt_? -111.85 10.67 20.76 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 126.404 1.882 . . . . 0.0 111.645 177.008 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 58.05 36.34 80.97 Favored Glycine 0 CA--C 1.534 1.26 0 C-N-CA 125.542 1.544 . . . . 0.0 114.216 -179.879 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 6.1 t -132.54 13.46 4.51 Favored 'General case' 0 N--CA 1.479 0.983 0 N-CA-C 115.143 1.534 . . . . 0.0 115.143 -175.031 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 39.6 t -59.9 131.77 51.88 Favored 'General case' 0 CA--C 1.55 0.967 0 O-C-N 121.379 -0.825 . . . . 0.0 111.157 176.984 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 21.8 m -73.95 1.89 9.81 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 125.985 1.714 . . . . 0.0 115.217 -177.347 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 63.4 mtm-85 -132.49 148.67 70.55 Favored Pre-proline 0 N--CA 1.474 0.75 0 C-N-CA 125.657 1.583 . . . . 0.0 112.867 -175.466 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -67.81 162.21 40.54 Favored 'Trans proline' 0 CA--C 1.542 0.923 0 C-N-CA 121.92 1.747 . . . . 0.0 109.425 171.674 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 17.2 m-20 -53.45 -25.44 16.1 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 125.025 1.33 . . . . 0.0 114.205 -177.437 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 16.8 p -83.84 -12.75 55.12 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 127.342 2.257 . . . . 0.0 115.317 178.855 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 16.2 mt-10 -111.5 -22.77 11.1 Favored 'General case' 0 N--CA 1.478 0.943 0 N-CA-C 115.291 1.589 . . . . 0.0 115.291 -176.835 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 3.8 t -66.92 164.85 16.63 Favored 'General case' 0 CA--C 1.545 0.769 0 N-CA-C 114.059 1.133 . . . . 0.0 114.059 -178.571 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 44.1 mmtm -100.58 6.66 44.22 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 126.541 1.937 . . . . 0.0 113.6 -176.94 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 51.9 m-85 -141.3 167.57 21.86 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 127.64 2.376 . . . . 0.0 108.448 173.503 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -80.08 148.04 31.19 Favored 'General case' 0 CA--C 1.544 0.75 0 O-C-N 120.94 -1.1 . . . . 0.0 113.584 -176.372 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 20.6 m170 -120.27 87.86 40.79 Favored Pre-proline 0 CA--C 1.554 1.097 0 C-N-CA 125.79 1.636 . . . . 0.0 110.563 -179.366 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -59.67 146.08 96.35 Favored 'Trans proline' 0 C--N 1.354 0.863 0 C-N-CA 123.442 2.761 . . . . 0.0 114.871 -178.032 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 48.1 p -82.86 -178.78 7.23 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 124.305 1.042 . . . . 0.0 112.474 175.942 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -59.8 -19.85 53.19 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 125.698 1.599 . . . . 0.0 113.599 173.934 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 51.8 m -109.23 -15.59 14.25 Favored 'General case' 0 N--CA 1.476 0.828 0 N-CA-C 114.888 1.44 . . . . 0.0 114.888 -179.259 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 78.8 m -65.67 159.52 24.76 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-N 119.896 1.225 . . . . 0.0 114.046 179.459 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 41.1 mt-30 -119.37 140.81 49.76 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 125.257 1.423 . . . . 0.0 111.063 178.15 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 1.1 m -131.79 149.87 33.29 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.576 0 C-N-CA 125.118 1.367 . . . . 0.0 112.546 -177.388 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 -144.59 139.13 27.92 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 125.929 1.692 . . . . 0.0 110.455 176.445 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 89.4 m-20 45.54 34.83 1.77 Allowed 'General case' 0 CA--C 1.554 1.124 0 N-CA-C 115.464 1.653 . . . . 0.0 115.464 176.18 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 81.07 19.81 66.41 Favored Glycine 0 CA--C 1.536 1.359 0 C-N-CA 124.243 0.925 . . . . 0.0 114.781 -179.363 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 44.3 mtt180 -137.33 160.83 37.94 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 125.145 1.378 . . . . 0.0 112.311 -179.067 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 3.3 m -137.41 142.63 36.39 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.648 0 C-N-CA 127.817 2.447 . . . . 0.0 109.972 -177.075 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 43.4 mt -91.26 126.34 43.94 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.567 0 O-C-N 121.386 -0.821 . . . . 0.0 109.871 -178.504 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -70.05 146.15 51.19 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 123.954 0.901 . . . . 0.0 111.334 177.689 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 29.4 t -67.08 100.22 0.74 Allowed 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 124.675 1.19 . . . . 0.0 112.244 -178.122 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 32.9 p90 -61.3 -37.8 84.51 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 115.017 -0.992 . . . . 0.0 110.017 175.557 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 70.9 m-20 -61.89 -44.63 96.41 Favored 'General case' 0 CA--C 1.539 0.55 0 O-C-N 121.8 -0.562 . . . . 0.0 110.475 176.746 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 43.3 t -63.57 -46.11 87.36 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 119.748 1.158 . . . . 0.0 111.247 177.763 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 34.4 mt -61.16 -40.75 95.02 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 124.059 0.944 . . . . 0.0 113.42 176.759 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 31.3 mmmt -81.23 -12.88 59.01 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 124.78 1.232 . . . . 0.0 113.746 179.297 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 85.66 38.08 9.07 Favored Glycine 0 CA--C 1.539 1.539 0 C-N-CA 124.681 1.134 . . . . 0.0 114.336 179.438 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 47.8 ttp180 -121.86 -20.76 6.28 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 126.716 2.006 . . . . 0.0 114.764 -176.705 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 5.0 t . . . . . 0 CA--C 1.544 0.742 0 CA-C-N 119.442 1.019 . . . . 0.0 113.349 -177.835 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 7.8 t . . . . . 0 CA--C 1.544 0.733 0 CA-C-O 121.219 0.533 . . . . 0.0 111.272 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 27.0 mtmt -83.47 0.83 44.62 Favored 'General case' 0 N--CA 1.477 0.899 0 N-CA-C 113.731 1.011 . . . . 0.0 113.731 -177.856 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 84.7 m-85 -122.82 154.0 38.81 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 125.203 1.401 . . . . 0.0 111.438 -175.778 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -75.56 112.32 11.78 Favored 'General case' 0 CA--C 1.531 0.242 0 N-CA-C 113.513 0.931 . . . . 0.0 113.513 -175.548 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 12.0 m170 -69.05 117.36 51.04 Favored Pre-proline 0 CA--C 1.545 0.777 0 N-CA-C 105.111 -2.181 . . . . 0.0 105.111 169.972 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -71.41 132.51 20.84 Favored 'Trans proline' 0 CA--C 1.541 0.849 0 C-N-CA 121.821 1.68 . . . . 0.0 114.719 -169.948 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 86.7 Cg_endo -77.16 153.88 32.24 Favored 'Trans proline' 0 CA--C 1.544 0.979 0 C-N-CA 123.39 2.727 . . . . 0.0 111.501 178.18 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 98.6 Cg_exo -44.81 -39.96 14.25 Favored 'Trans proline' 0 CA--C 1.539 0.771 0 C-N-CA 124.561 3.507 . . . . 0.0 116.11 179.902 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 72.7 m80 -73.4 -14.38 61.26 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 115.138 1.533 . . . . 0.0 115.138 179.796 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.442 HD13 HD21 ' A' ' 16' ' ' LEU . 92.8 mt -116.04 -16.29 11.07 Favored 'General case' 0 N--CA 1.474 0.725 0 C-N-CA 124.817 1.247 . . . . 0.0 113.383 179.814 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 61.2 mtpt -54.5 -36.68 64.45 Favored 'General case' 0 N--CA 1.48 1.033 0 CA-C-N 119.572 1.078 . . . . 0.0 111.11 172.569 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 19.6 m -63.97 -42.73 97.16 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 124.644 1.178 . . . . 0.0 111.65 176.211 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 89.9 mm-40 -66.85 -43.73 82.85 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 123.543 0.737 . . . . 0.0 110.51 178.827 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 93.8 mt -63.32 -43.46 97.73 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-O 118.405 -0.807 . . . . 0.0 112.401 177.378 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -65.81 -35.81 81.73 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-N 120.339 1.427 . . . . 0.0 111.827 176.58 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 66.7 mt -62.48 -42.48 95.87 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.845 0 CA-C-N 119.034 0.834 . . . . 0.0 109.677 175.25 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 82.4 m-20 -63.92 -44.49 92.74 Favored 'General case' 0 CA--C 1.544 0.743 0 O-C-N 121.658 -0.651 . . . . 0.0 110.537 174.927 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.865 0 C-N-CA 125.328 1.442 . . . . 0.0 112.452 179.294 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.476 0.867 0 N-CA-C 113.982 1.105 . . . . 0.0 113.982 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 65.4 mt -98.44 -11.92 21.88 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 126.344 1.858 . . . . 0.0 115.454 -175.479 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 4.8 m -77.09 75.66 3.66 Favored 'General case' 0 N--CA 1.478 0.944 0 CA-C-O 122.366 1.079 . . . . 0.0 110.949 -179.788 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.523 HD21 HD13 ' A' ' 75' ' ' LEU . 12.2 tp -75.98 143.24 41.64 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 128.027 2.531 . . . . 0.0 112.455 -177.757 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -68.44 148.78 50.14 Favored 'General case' 0 N--CA 1.474 0.755 0 O-C-N 120.729 -1.232 . . . . 0.0 112.255 177.578 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 20.9 m -82.68 149.95 4.48 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.827 0 C-N-CA 122.927 0.491 . . . . 0.0 110.286 173.142 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 48.1 t -67.31 123.4 20.24 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-O 122.352 1.073 . . . . 0.0 111.463 178.071 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 2.7 mpt_? -64.39 -28.74 69.89 Favored 'General case' 0 N--CA 1.467 0.41 0 C-N-CA 124.965 1.306 . . . . 0.0 113.372 -175.903 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 11.5 mm-40 -82.93 -38.87 22.2 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 123.18 0.592 . . . . 0.0 110.138 177.839 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 81.1 t80 -61.65 -31.98 72.12 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 124.669 1.188 . . . . 0.0 111.042 174.772 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 12.6 mm100 -61.56 -16.86 51.81 Favored 'General case' 0 CA--C 1.545 0.771 0 N-CA-C 113.429 0.9 . . . . 0.0 113.429 175.698 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 5.6 mpt_? -121.69 14.04 10.88 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 126.338 1.855 . . . . 0.0 111.727 177.737 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 58.61 36.1 83.9 Favored Glycine 0 CA--C 1.535 1.289 0 C-N-CA 125.16 1.362 . . . . 0.0 114.183 -179.984 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 6.9 t -128.63 16.73 6.42 Favored 'General case' 0 N--CA 1.477 0.896 0 N-CA-C 114.489 1.292 . . . . 0.0 114.489 -176.005 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 9.1 t -67.31 173.98 3.58 Favored 'General case' 0 CA--C 1.558 1.264 0 O-C-N 121.633 -0.667 . . . . 0.0 110.858 173.985 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 90.7 p -136.24 9.43 3.22 Favored 'General case' 0 N--CA 1.477 0.902 0 N-CA-C 115.359 1.614 . . . . 0.0 115.359 -176.241 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 65.6 mtm-85 -132.69 153.61 81.16 Favored Pre-proline 0 N--CA 1.475 0.793 0 C-N-CA 125.941 1.696 . . . . 0.0 112.13 -178.449 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_endo -73.51 161.81 41.45 Favored 'Trans proline' 0 CA--C 1.541 0.827 0 C-N-CA 122.0 1.8 . . . . 0.0 109.109 173.109 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 -53.9 -28.44 36.55 Favored 'General case' 0 N--CA 1.473 0.709 0 N-CA-C 113.241 0.83 . . . . 0.0 113.241 177.69 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 27.2 p -72.1 -20.16 61.69 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 125.933 1.693 . . . . 0.0 115.069 178.887 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -114.84 -30.7 6.35 Favored 'General case' 0 N--CA 1.477 0.892 0 N-CA-C 114.295 1.221 . . . . 0.0 114.295 -178.014 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 3.1 t -59.04 158.1 9.11 Favored 'General case' 0 CA--C 1.549 0.905 0 N-CA-C 114.675 1.361 . . . . 0.0 114.675 -175.654 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 36.7 mmtm -86.89 -0.31 56.28 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 126.773 2.029 . . . . 0.0 115.102 -173.095 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 75.3 m-85 -144.29 168.41 20.15 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 127.015 2.126 . . . . 0.0 109.388 175.692 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -73.7 150.69 41.06 Favored 'General case' 0 CA--C 1.548 0.871 0 O-C-N 120.414 -1.428 . . . . 0.0 113.842 -177.052 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 17.0 m-70 -127.33 84.16 64.15 Favored Pre-proline 0 CA--C 1.55 0.945 0 C-N-CA 125.451 1.5 . . . . 0.0 110.782 -177.415 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 35.2 Cg_endo -63.87 150.44 88.41 Favored 'Trans proline' 0 C--N 1.353 0.779 0 C-N-CA 123.636 2.891 . . . . 0.0 115.146 -177.078 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 54.1 p -89.35 -176.25 5.01 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 125.109 1.363 . . . . 0.0 111.695 174.536 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 60.9 mtpt -59.6 -21.9 61.05 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 125.516 1.526 . . . . 0.0 113.605 174.274 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 40.0 m -109.14 -16.13 14.16 Favored 'General case' 0 N--CA 1.477 0.923 0 N-CA-C 114.716 1.376 . . . . 0.0 114.716 -179.346 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 92.3 m -64.88 136.28 56.68 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-N 119.465 1.03 . . . . 0.0 112.218 179.462 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 42.0 tt0 -81.53 126.3 31.52 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 124.669 1.188 . . . . 0.0 110.502 179.165 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 18.7 t -119.75 134.65 62.59 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.941 0 C-N-CA 125.927 1.691 . . . . 0.0 109.688 -178.37 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -144.06 130.17 19.61 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 125.128 1.371 . . . . 0.0 111.331 -179.057 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 61.9 t30 42.75 37.01 0.93 Allowed 'General case' 0 CA--C 1.553 1.082 0 C-N-CA 126.989 2.115 . . . . 0.0 116.526 177.885 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 88.1 14.35 62.62 Favored Glycine 0 CA--C 1.536 1.35 0 O-C-N 121.103 -0.998 . . . . 0.0 114.929 179.653 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 31.1 mtt180 -138.52 167.56 21.67 Favored 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 126.101 1.76 . . . . 0.0 111.95 -179.57 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 4.4 m -140.03 146.56 24.71 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.571 0 C-N-CA 127.119 2.167 . . . . 0.0 108.911 -179.892 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 26.1 mt -95.72 127.98 47.3 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.814 0 O-C-N 121.108 -0.995 . . . . 0.0 109.611 -179.071 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -73.27 151.66 41.28 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 123.462 0.705 . . . . 0.0 111.683 177.44 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 13.2 t -73.46 98.87 2.85 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 124.421 1.089 . . . . 0.0 113.064 -176.881 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 30.0 p90 -61.66 -38.22 86.95 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 123.942 0.897 . . . . 0.0 110.139 174.843 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 66.1 m-20 -61.08 -42.38 98.39 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 123.011 0.524 . . . . 0.0 110.509 176.978 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 47.6 t -64.4 -42.37 96.14 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-N 119.519 1.054 . . . . 0.0 111.441 177.425 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 31.0 mt -63.73 -40.38 96.59 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 123.763 0.825 . . . . 0.0 112.921 176.399 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 31.4 mmmt -81.35 -9.46 59.74 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 124.763 1.225 . . . . 0.0 114.017 179.486 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 79.41 37.16 24.86 Favored Glycine 0 CA--C 1.536 1.4 0 C-N-CA 124.477 1.037 . . . . 0.0 113.525 -179.644 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 72.8 ttt-85 -117.19 -24.02 7.66 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 127.163 2.185 . . . . 0.0 113.966 -176.826 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 5.8 t . . . . . 0 CA--C 1.544 0.716 0 CA-C-O 121.768 0.794 . . . . 0.0 112.734 -177.92 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 7.4 t . . . . . 0 CA--C 1.543 0.68 0 CA-C-O 121.58 0.705 . . . . 0.0 111.876 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 30.4 mtmt -85.25 1.28 48.92 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 124.578 1.151 . . . . 0.0 113.308 -178.558 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 87.3 m-85 -115.13 147.65 39.98 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 124.191 0.997 . . . . 0.0 111.469 -175.402 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -73.42 112.79 9.82 Favored 'General case' 0 N--CA 1.465 0.287 0 C-N-CA 123.473 0.709 . . . . 0.0 111.9 -176.18 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 12.1 m170 -68.71 114.02 19.74 Favored Pre-proline 0 CA--C 1.547 0.831 0 N-CA-C 107.487 -1.301 . . . . 0.0 107.487 174.285 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 67.7 Cg_exo -47.93 112.56 0.59 Allowed 'Trans proline' 0 CA--C 1.543 0.943 0 C-N-CA 124.842 3.694 . . . . 0.0 117.153 -173.691 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -76.69 153.55 34.03 Favored 'Trans proline' 0 CA--C 1.547 1.149 0 C-N-CA 122.068 1.845 . . . . 0.0 111.734 176.215 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 81.4 Cg_exo -42.27 -49.52 6.02 Favored 'Trans proline' 0 CA--C 1.539 0.73 0 C-N-CA 125.046 3.831 . . . . 0.0 116.823 -179.059 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 1.7 t60 -66.8 -29.94 70.01 Favored 'General case' 0 N--CA 1.478 0.954 0 N-CA-C 113.585 0.957 . . . . 0.0 113.585 -179.393 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.523 HD13 HD21 ' A' ' 16' ' ' LEU . 85.5 mt -93.64 -21.35 19.44 Favored 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 114.026 1.121 . . . . 0.0 114.026 -178.058 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 54.1 mtpt -53.5 -38.87 64.12 Favored 'General case' 0 N--CA 1.48 1.037 0 CA-C-N 120.204 1.366 . . . . 0.0 111.611 175.397 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 29.7 m -62.73 -43.98 97.4 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 124.937 1.295 . . . . 0.0 111.561 175.855 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 94.5 mm-40 -66.21 -43.04 87.86 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 123.622 0.769 . . . . 0.0 110.933 178.33 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 88.1 mt -62.02 -50.44 72.02 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 123.876 0.87 . . . . 0.0 111.554 177.632 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -62.61 -28.85 70.18 Favored 'General case' 0 N--CA 1.476 0.843 0 CA-C-N 120.025 1.284 . . . . 0.0 113.489 178.919 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 61.2 mt -70.23 -43.59 78.53 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.727 0 C-N-CA 123.723 0.809 . . . . 0.0 109.743 174.892 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 24.8 m-80 -66.2 -35.97 81.84 Favored 'General case' 0 CA--C 1.542 0.647 0 O-C-N 121.352 -0.842 . . . . 0.0 110.958 175.453 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.532 1.109 0 C-N-CA 124.487 1.041 . . . . 0.0 112.158 177.247 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.542 0.669 0 N-CA-C 113.473 0.916 . . . . 0.0 113.473 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 95.0 mt -91.67 -14.92 29.28 Favored 'General case' 0 N--CA 1.467 0.376 0 C-N-CA 126.064 1.746 . . . . 0.0 114.429 -177.802 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 12.8 m -75.83 78.93 2.75 Favored 'General case' 0 N--CA 1.475 0.791 0 CA-C-N 119.508 1.049 . . . . 0.0 110.785 -179.208 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.47 HD21 HD13 ' A' ' 75' ' ' LEU . 10.6 tp -75.52 141.42 43.03 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 128.021 2.528 . . . . 0.0 111.985 -176.352 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 53.0 mt-10 -71.77 151.32 43.62 Favored 'General case' 0 N--CA 1.472 0.642 0 O-C-N 120.933 -1.104 . . . . 0.0 112.452 178.623 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 16.9 m -86.71 156.54 3.29 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.904 0 C-N-CA 123.107 0.563 . . . . 0.0 111.201 174.487 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 42.2 t -75.89 132.09 40.09 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-O 121.725 0.774 . . . . 0.0 110.677 176.685 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 3.8 mpt_? -66.62 -28.17 68.28 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 124.641 1.176 . . . . 0.0 113.167 -177.79 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -84.47 -36.13 22.49 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 118.36 0.527 . . . . 0.0 110.415 178.62 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 59.1 t80 -62.69 -31.28 72.14 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 123.686 0.794 . . . . 0.0 110.835 173.565 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 12.2 mm100 -62.48 -17.93 60.7 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 124.028 0.931 . . . . 0.0 113.334 175.387 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 1.7 mpp_? -118.16 13.12 13.73 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 126.417 1.887 . . . . 0.0 111.673 176.159 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 58.76 36.04 84.78 Favored Glycine 0 CA--C 1.533 1.218 0 C-N-CA 125.12 1.343 . . . . 0.0 113.894 -179.572 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 6.4 t -130.08 15.27 5.71 Favored 'General case' 0 N--CA 1.477 0.91 0 N-CA-C 114.827 1.418 . . . . 0.0 114.827 -175.333 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 8.8 t -67.99 169.8 9.39 Favored 'General case' 0 CA--C 1.557 1.212 0 CA-C-N 118.865 0.757 . . . . 0.0 110.454 173.435 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 50.5 m -132.23 13.58 4.65 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 125.302 1.441 . . . . 0.0 114.394 -176.09 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 75.5 mtm-85 -135.8 144.87 50.53 Favored Pre-proline 0 N--CA 1.472 0.63 0 C-N-CA 125.493 1.517 . . . . 0.0 112.337 -177.184 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_endo -69.37 165.72 29.55 Favored 'Trans proline' 0 CA--C 1.544 0.986 0 C-N-CA 121.955 1.77 . . . . 0.0 109.697 171.472 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -54.27 -31.31 53.43 Favored 'General case' 0 N--CA 1.478 0.939 0 O-C-N 121.196 -0.94 . . . . 0.0 112.468 177.554 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 24.6 p -70.15 -10.9 60.25 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 126.496 1.918 . . . . 0.0 115.141 177.47 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 44.6 mm-40 -122.83 -29.91 3.91 Favored 'General case' 0 N--CA 1.476 0.841 0 N-CA-C 115.184 1.55 . . . . 0.0 115.184 -177.003 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 3.4 t -66.99 164.75 17.02 Favored 'General case' 0 CA--C 1.546 0.81 0 N-CA-C 115.123 1.527 . . . . 0.0 115.123 -175.364 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -80.96 -12.31 59.41 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 126.777 2.031 . . . . 0.0 113.433 -179.632 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 60.5 m-85 -139.81 176.55 8.65 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 126.556 1.943 . . . . 0.0 110.173 179.408 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -84.58 148.49 26.44 Favored 'General case' 0 CA--C 1.547 0.845 0 O-C-N 121.134 -0.979 . . . . 0.0 113.361 -177.214 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 66.8 m170 -119.64 87.98 38.2 Favored Pre-proline 0 CA--C 1.55 0.958 0 C-N-CA 125.847 1.659 . . . . 0.0 111.177 179.385 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_endo -62.92 144.41 93.19 Favored 'Trans proline' 0 CA--C 1.539 0.759 0 C-N-CA 123.458 2.772 . . . . 0.0 114.45 -178.323 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 45.1 p -81.78 -175.09 5.39 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 124.438 1.095 . . . . 0.0 111.941 175.233 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 61.2 mtpt -60.12 -21.3 61.38 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 125.359 1.464 . . . . 0.0 113.152 173.198 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 46.1 m -109.27 -21.03 12.74 Favored 'General case' 0 N--CA 1.478 0.951 0 N-CA-C 114.548 1.314 . . . . 0.0 114.548 -179.958 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 81.9 m -61.59 135.6 57.7 Favored 'General case' 0 CA--C 1.544 0.718 0 CA-C-N 119.653 1.115 . . . . 0.0 112.352 179.39 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 38.4 tt0 -79.2 129.46 34.48 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.695 1.198 . . . . 0.0 111.091 179.993 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 13.7 t -122.87 133.45 68.94 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.037 0 C-N-CA 125.692 1.597 . . . . 0.0 110.025 -178.268 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 50.7 mt-10 -145.16 129.05 17.38 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 125.156 1.382 . . . . 0.0 111.813 -178.594 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 61.7 t30 39.66 38.82 0.46 Allowed 'General case' 0 CA--C 1.553 1.08 0 C-N-CA 127.572 2.349 . . . . 0.0 117.273 176.735 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 93.79 9.64 59.63 Favored Glycine 0 CA--C 1.535 1.3 0 O-C-N 120.955 -1.091 . . . . 0.0 115.168 178.961 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 31.7 mtt180 -137.69 170.91 15.24 Favored 'General case' 0 N--CA 1.466 0.331 0 C-N-CA 125.682 1.593 . . . . 0.0 111.827 179.591 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 5.3 m -135.85 171.95 16.38 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.675 0 C-N-CA 128.876 2.87 . . . . 0.0 107.324 177.593 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 38.7 mt -122.29 129.04 75.62 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.941 0 CA-C-N 120.209 1.368 . . . . 0.0 109.099 -179.927 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -73.72 146.08 44.67 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 124.176 0.99 . . . . 0.0 111.636 178.458 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 15.5 t -70.3 100.47 1.72 Allowed 'General case' 0 C--O 1.24 0.584 0 C-N-CA 124.972 1.309 . . . . 0.0 113.133 -176.918 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 31.3 p90 -61.51 -38.57 87.85 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 115.281 -0.872 . . . . 0.0 110.207 175.021 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 73.7 m-20 -61.38 -42.11 98.18 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 123.116 0.566 . . . . 0.0 110.855 177.433 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 48.4 t -64.31 -42.22 96.45 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 119.452 1.024 . . . . 0.0 111.472 177.538 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 29.9 mt -64.94 -40.89 95.71 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 123.636 0.774 . . . . 0.0 112.862 176.397 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 31.4 mmmt -79.51 -10.44 59.8 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 124.703 1.201 . . . . 0.0 113.872 179.087 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 80.25 37.52 21.08 Favored Glycine 0 CA--C 1.537 1.409 0 C-N-CA 124.642 1.115 . . . . 0.0 113.712 -179.932 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 50.5 ttp180 -120.24 -19.82 7.55 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 126.822 2.049 . . . . 0.0 114.507 -176.614 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 6.2 t . . . . . 0 CA--C 1.545 0.774 0 CA-C-N 119.247 0.93 . . . . 0.0 112.603 -178.376 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 8.1 t . . . . . 0 CA--C 1.544 0.737 0 CA-C-O 121.602 0.715 . . . . 0.0 111.866 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 27.4 mtmt -84.12 2.09 41.1 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 124.607 1.163 . . . . 0.0 113.374 -178.588 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 80.6 m-85 -117.65 149.19 41.12 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 124.334 1.053 . . . . 0.0 111.591 -174.763 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -76.09 117.75 18.12 Favored 'General case' 0 N--CA 1.464 0.253 0 C-N-CA 123.516 0.727 . . . . 0.0 111.293 -176.49 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 15.3 m170 -72.25 114.32 28.48 Favored Pre-proline 0 CA--C 1.549 0.907 0 N-CA-C 107.46 -1.311 . . . . 0.0 107.46 174.602 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 63.6 Cg_exo -47.27 115.9 1.55 Allowed 'Trans proline' 0 CA--C 1.543 0.96 0 C-N-CA 124.855 3.703 . . . . 0.0 116.522 -174.433 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -76.3 149.36 31.47 Favored 'Trans proline' 0 CA--C 1.542 0.887 0 C-N-CA 121.906 1.737 . . . . 0.0 110.472 175.955 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 84.6 Cg_exo -47.05 -39.32 25.41 Favored 'Trans proline' 0 CA--C 1.537 0.671 0 C-N-CA 123.868 3.045 . . . . 0.0 115.192 179.547 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 12.6 t-80 -69.8 -17.76 63.42 Favored 'General case' 0 N--CA 1.473 0.698 0 N-CA-C 114.99 1.478 . . . . 0.0 114.99 179.473 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.47 HD13 HD21 ' A' ' 16' ' ' LEU . 84.3 mt -114.19 -16.87 12.0 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 124.64 1.176 . . . . 0.0 112.848 178.742 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 54.2 mtpt -54.65 -36.2 64.3 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-N 119.725 1.148 . . . . 0.0 111.449 174.103 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 25.1 m -63.21 -43.73 97.31 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 123.635 0.774 . . . . 0.0 111.455 176.168 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 16.4 mm100 -67.5 -44.84 77.5 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 123.664 0.786 . . . . 0.0 110.75 178.129 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 81.7 mt -61.74 -48.69 79.57 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 124.2 1.0 . . . . 0.0 112.233 177.921 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -63.85 -35.67 81.39 Favored 'General case' 0 N--CA 1.474 0.741 0 CA-C-N 119.886 1.221 . . . . 0.0 112.733 179.725 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 60.2 mt -64.23 -45.49 96.09 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.763 0 CA-C-N 118.802 0.728 . . . . 0.0 110.062 176.203 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 32.2 m-80 -65.85 -37.88 87.35 Favored 'General case' 0 CA--C 1.542 0.672 0 O-C-N 121.696 -0.627 . . . . 0.0 111.354 175.956 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.846 0 C-N-CA 124.502 1.048 . . . . 0.0 111.981 177.653 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.475 0.781 0 N-CA-C 113.051 0.76 . . . . 0.0 113.051 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 86.8 mt -89.37 -14.65 35.12 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 126.127 1.771 . . . . 0.0 114.375 -178.227 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 6.8 m -78.03 75.86 4.56 Favored 'General case' 0 N--CA 1.477 0.907 0 CA-C-N 119.289 0.95 . . . . 0.0 111.008 -178.958 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.458 HD21 HD13 ' A' ' 75' ' ' LEU . 12.0 tp -75.66 145.88 40.67 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 127.531 2.332 . . . . 0.0 112.374 -178.227 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 15.9 mt-10 -75.24 150.9 38.48 Favored 'General case' 0 N--CA 1.472 0.638 0 O-C-N 120.602 -1.311 . . . . 0.0 112.752 179.29 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 13.0 m -83.52 155.56 3.75 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 C-N-CA 122.787 0.435 . . . . 0.0 111.596 176.29 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 42.6 t -72.89 129.5 38.28 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-O 122.063 0.935 . . . . 0.0 110.608 176.046 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 3.9 mpt_? -67.82 -27.82 67.05 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 124.925 1.29 . . . . 0.0 113.211 -177.542 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 15.8 mm-40 -84.13 -36.38 22.97 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 123.297 0.639 . . . . 0.0 110.11 178.423 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 72.7 t80 -63.27 -30.93 71.98 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 124.214 1.005 . . . . 0.0 110.917 174.19 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 12.6 mm100 -62.17 -16.03 50.16 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 123.886 0.874 . . . . 0.0 113.045 174.899 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 6.5 mpt_? -119.4 12.84 12.56 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 126.72 2.008 . . . . 0.0 111.622 176.684 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 58.22 36.12 81.18 Favored Glycine 0 CA--C 1.534 1.249 0 C-N-CA 125.479 1.514 . . . . 0.0 114.565 179.742 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 6.4 t -132.07 12.25 4.69 Favored 'General case' 0 N--CA 1.478 0.962 0 N-CA-C 115.202 1.556 . . . . 0.0 115.202 -175.384 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 31.0 t -61.03 131.84 51.91 Favored 'General case' 0 CA--C 1.548 0.897 0 O-C-N 121.175 -0.953 . . . . 0.0 110.783 176.53 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 75.4 p -83.18 6.67 18.52 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 125.94 1.696 . . . . 0.0 114.645 -178.04 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 75.3 mtm-85 -127.38 152.87 76.97 Favored Pre-proline 0 N--CA 1.473 0.685 0 C-N-CA 125.851 1.661 . . . . 0.0 113.476 -175.69 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo -72.66 160.61 46.03 Favored 'Trans proline' 0 CA--C 1.54 0.79 0 C-N-CA 122.098 1.865 . . . . 0.0 109.053 172.461 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 16.7 m-20 -55.3 -22.12 17.46 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 124.759 1.223 . . . . 0.0 113.822 -178.71 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 14.9 p -83.55 -22.08 32.48 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 127.306 2.242 . . . . 0.0 115.5 179.296 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -101.51 -31.9 10.65 Favored 'General case' 0 N--CA 1.477 0.883 0 CA-C-N 119.742 1.155 . . . . 0.0 113.839 -177.519 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 4.3 t -56.67 150.31 16.07 Favored 'General case' 0 CA--C 1.545 0.763 0 N-CA-C 115.007 1.484 . . . . 0.0 115.007 -174.105 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 13.4 mptt -81.9 -2.24 50.58 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 127.046 2.139 . . . . 0.0 113.134 -177.241 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 63.8 m-85 -138.79 169.8 17.14 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 127.461 2.304 . . . . 0.0 109.587 174.622 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -80.37 149.06 30.36 Favored 'General case' 0 CA--C 1.547 0.857 0 N-CA-C 114.382 1.253 . . . . 0.0 114.382 -175.948 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 21.2 m170 -121.07 86.78 42.88 Favored Pre-proline 0 CA--C 1.556 1.178 0 C-N-CA 125.99 1.716 . . . . 0.0 111.173 -179.179 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 35.2 Cg_endo -65.25 150.01 87.93 Favored 'Trans proline' 0 CA--C 1.539 0.771 0 C-N-CA 123.279 2.653 . . . . 0.0 114.671 -178.8 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 46.1 p -88.4 -175.34 4.96 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 124.476 1.11 . . . . 0.0 111.536 174.19 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 62.8 mttp -61.21 -18.53 58.72 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 125.379 1.471 . . . . 0.0 113.388 173.221 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 47.8 m -109.19 -20.99 12.78 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 125.078 1.351 . . . . 0.0 114.645 -178.783 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 71.6 m -63.58 137.55 58.16 Favored 'General case' 0 CA--C 1.543 0.701 0 CA-C-N 119.304 0.956 . . . . 0.0 113.32 -179.883 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 4.3 tm0? -82.88 134.28 35.09 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 124.774 1.23 . . . . 0.0 111.257 178.817 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -139.07 145.06 28.11 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.677 0 C-N-CA 125.251 1.42 . . . . 0.0 112.259 179.775 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -147.27 140.6 25.36 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 126.019 1.727 . . . . 0.0 110.911 176.802 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 61.1 t30 41.4 38.13 0.78 Allowed 'General case' 0 CA--C 1.553 1.073 0 C-N-CA 126.585 1.954 . . . . 0.0 116.166 177.53 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 84.53 16.65 65.76 Favored Glycine 0 CA--C 1.537 1.424 0 O-C-N 121.091 -1.006 . . . . 0.0 115.358 -179.938 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 55.5 mtt85 -136.92 160.87 37.6 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 124.913 1.285 . . . . 0.0 112.043 -179.945 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 5.8 m -135.89 150.1 28.24 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.698 0 C-N-CA 128.034 2.533 . . . . 0.0 109.847 -177.512 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 40.4 mt -98.84 127.63 51.25 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.75 0 O-C-N 121.28 -0.887 . . . . 0.0 109.992 -179.055 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -73.44 147.43 44.2 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 124.268 1.027 . . . . 0.0 111.716 177.6 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 17.9 t -69.26 100.08 1.26 Allowed 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 124.93 1.292 . . . . 0.0 112.784 -177.392 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 30.2 p90 -61.57 -38.47 87.63 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 115.23 -0.895 . . . . 0.0 110.163 175.183 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 71.1 m-20 -61.47 -42.69 99.17 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 123.127 0.571 . . . . 0.0 110.761 177.29 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 47.6 t -64.11 -42.32 96.93 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-N 119.491 1.041 . . . . 0.0 111.574 177.669 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 28.6 mt -65.46 -40.57 93.35 Favored 'General case' 0 CA--C 1.543 0.674 0 O-C-N 121.436 -0.79 . . . . 0.0 112.881 176.625 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 31.3 mmmt -79.84 -11.31 59.83 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 124.679 1.191 . . . . 0.0 113.928 179.167 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 82.17 37.79 14.53 Favored Glycine 0 CA--C 1.537 1.409 0 C-N-CA 124.577 1.085 . . . . 0.0 113.959 179.76 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 50.5 ttp180 -121.23 -18.29 7.44 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 126.652 1.981 . . . . 0.0 114.518 -176.646 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 6.0 t . . . . . 0 CA--C 1.545 0.765 0 CA-C-N 119.298 0.954 . . . . 0.0 112.747 -178.331 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 8.4 t . . . . . 0 CA--C 1.545 0.754 0 CA-C-O 121.716 0.77 . . . . 0.0 112.28 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 36.1 mtmt -85.02 5.63 28.6 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 125.324 1.45 . . . . 0.0 113.612 -177.281 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 84.4 m-85 -126.57 155.34 42.6 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 124.87 1.268 . . . . 0.0 112.061 -175.532 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -76.99 114.94 16.34 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 123.679 0.792 . . . . 0.0 112.267 -176.598 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 10.7 m170 -71.5 113.62 21.2 Favored Pre-proline 0 CA--C 1.546 0.807 0 N-CA-C 107.605 -1.257 . . . . 0.0 107.605 173.539 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 89.3 Cg_exo -50.1 111.36 0.51 Allowed 'Trans proline' 0 CA--C 1.542 0.901 0 C-N-CA 124.801 3.667 . . . . 0.0 117.226 -173.871 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 97.1 Cg_endo -76.34 152.97 35.2 Favored 'Trans proline' 0 CA--C 1.547 1.15 0 C-N-CA 122.109 1.873 . . . . 0.0 111.109 175.254 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 91.6 Cg_exo -43.95 -44.92 11.87 Favored 'Trans proline' 0 CA--C 1.538 0.717 0 C-N-CA 124.755 3.637 . . . . 0.0 116.308 -179.51 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 25.6 m170 -74.76 -5.82 45.45 Favored 'General case' 0 N--CA 1.478 0.95 0 N-CA-C 115.111 1.523 . . . . 0.0 115.111 -179.523 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.458 HD13 HD21 ' A' ' 16' ' ' LEU . 95.5 mt -116.16 -21.24 9.49 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 124.852 1.261 . . . . 0.0 113.122 177.198 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 57.4 mtpt -54.09 -35.46 62.13 Favored 'General case' 0 N--CA 1.477 0.922 0 CA-C-N 119.752 1.16 . . . . 0.0 111.439 175.304 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 23.0 m -63.62 -46.82 83.98 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 124.798 1.239 . . . . 0.0 111.416 174.902 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 75.1 mt-30 -62.51 -44.98 95.03 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.64 0.776 . . . . 0.0 110.884 177.708 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 82.2 mt -61.77 -50.18 73.41 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 124.205 1.002 . . . . 0.0 111.861 177.998 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 7.5 pt-20 -63.6 -35.16 79.59 Favored 'General case' 0 N--CA 1.474 0.726 0 CA-C-N 119.838 1.199 . . . . 0.0 112.895 179.279 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 60.4 mt -60.62 -41.21 87.18 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.795 0 CA-C-N 119.269 0.941 . . . . 0.0 110.063 176.369 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 12.7 t-20 -69.67 -45.0 69.36 Favored 'General case' 0 CA--C 1.545 0.783 0 O-C-N 121.827 -0.545 . . . . 0.0 110.595 175.316 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 1.273 0 C-N-CA 125.171 1.367 . . . . 0.0 113.357 177.726 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.474 0.772 0 N-CA-C 113.818 1.044 . . . . 0.0 113.818 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 87.1 mt -88.81 -8.9 53.54 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 127.26 2.224 . . . . 0.0 113.797 -179.418 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 4.1 m -77.43 76.94 3.97 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-O 122.738 1.256 . . . . 0.0 110.366 -179.632 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -75.65 142.26 42.62 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 128.428 2.691 . . . . 0.0 111.716 -177.139 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 51.8 mt-10 -70.89 149.86 46.33 Favored 'General case' 0 N--CA 1.471 0.612 0 O-C-N 120.718 -1.239 . . . . 0.0 112.08 176.927 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 16.5 m -84.1 155.2 3.66 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.921 0 C-N-CA 123.163 0.585 . . . . 0.0 111.191 174.555 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 42.3 t -74.76 133.56 41.96 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-O 121.861 0.839 . . . . 0.0 110.841 176.861 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 3.4 mpt_? -67.95 -26.96 66.21 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 124.994 1.317 . . . . 0.0 113.437 -177.562 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 7.8 mm-40 -87.86 -32.9 18.75 Favored 'General case' 0 N--CA 1.465 0.32 0 C-N-CA 123.053 0.541 . . . . 0.0 110.701 178.427 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 64.2 t80 -64.15 -31.69 72.98 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 123.513 0.725 . . . . 0.0 110.212 172.93 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 12.0 mm100 -61.61 -24.21 66.54 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 123.669 0.788 . . . . 0.0 112.541 174.382 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 28.0 mtm105 -103.48 -2.36 26.98 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 125.967 1.707 . . . . 0.0 112.575 177.649 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 72.58 35.86 59.02 Favored Glycine 0 CA--C 1.533 1.191 0 C-N-CA 126.223 1.868 . . . . 0.0 113.983 179.927 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 5.3 t -137.15 10.62 3.03 Favored 'General case' 0 N--CA 1.48 1.053 0 N-CA-C 116.122 1.897 . . . . 0.0 116.122 -175.033 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 28.9 t -60.77 131.73 51.61 Favored 'General case' 0 CA--C 1.55 0.971 0 CA-C-N 119.723 1.147 . . . . 0.0 111.518 177.545 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 29.0 m -80.16 5.14 15.26 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 125.811 1.644 . . . . 0.0 114.894 -177.581 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 79.1 mtm-85 -129.69 145.22 56.12 Favored Pre-proline 0 N--CA 1.475 0.798 0 C-N-CA 125.243 1.417 . . . . 0.0 113.491 -175.28 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 93.5 Cg_endo -70.22 166.79 27.01 Favored 'Trans proline' 0 CA--C 1.543 0.959 0 C-N-CA 122.251 1.967 . . . . 0.0 109.803 171.382 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 7.1 p-10 -54.61 -28.76 48.83 Favored 'General case' 0 N--CA 1.475 0.821 0 O-C-N 121.031 -1.043 . . . . 0.0 113.507 177.088 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 35.0 p -75.52 -9.25 58.42 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 125.472 1.509 . . . . 0.0 114.995 178.874 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 25.5 mm-40 -122.12 -25.16 4.96 Favored 'General case' 0 N--CA 1.477 0.901 0 N-CA-C 115.763 1.764 . . . . 0.0 115.763 -175.748 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 4.3 t -71.02 164.55 25.33 Favored 'General case' 0 CA--C 1.545 0.788 0 N-CA-C 115.181 1.549 . . . . 0.0 115.181 -175.164 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -83.33 -13.29 55.37 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 126.888 2.075 . . . . 0.0 113.428 -179.805 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 59.5 m-85 -136.76 171.79 13.98 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 127.093 2.157 . . . . 0.0 110.105 179.068 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -81.26 151.96 27.85 Favored 'General case' 0 CA--C 1.545 0.757 0 N-CA-C 114.555 1.317 . . . . 0.0 114.555 -176.15 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 67.7 m170 -124.25 85.32 55.3 Favored Pre-proline 0 CA--C 1.553 1.072 0 C-N-CA 126.315 1.846 . . . . 0.0 110.638 -179.788 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_endo -63.42 151.71 83.62 Favored 'Trans proline' 0 C--N 1.352 0.762 0 C-N-CA 123.606 2.871 . . . . 0.0 115.166 -177.43 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 59.6 p -84.77 -176.31 6.16 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 124.785 1.234 . . . . 0.0 111.93 174.492 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 67.7 mttm -63.24 -18.34 63.43 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 125.477 1.511 . . . . 0.0 113.407 173.686 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 70.8 p -109.26 -21.23 12.65 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 125.368 1.467 . . . . 0.0 114.696 -178.92 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 84.0 m -63.68 138.89 58.68 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 119.463 1.029 . . . . 0.0 113.581 179.522 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 24.3 mt-30 -78.79 136.82 37.47 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 124.808 1.243 . . . . 0.0 111.449 178.242 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 11.2 t -130.23 135.4 60.88 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.687 0 C-N-CA 124.789 1.235 . . . . 0.0 110.478 -179.484 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -145.91 132.72 20.06 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 125.149 1.379 . . . . 0.0 111.202 178.236 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 63.2 t30 41.16 38.39 0.73 Allowed 'General case' 0 CA--C 1.552 1.038 0 C-N-CA 126.951 2.1 . . . . 0.0 116.419 177.622 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 87.26 14.99 63.11 Favored Glycine 0 CA--C 1.536 1.377 0 O-C-N 121.071 -1.018 . . . . 0.0 115.136 179.892 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 30.0 mtt180 -137.01 163.75 30.0 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 125.452 1.501 . . . . 0.0 112.702 -179.664 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 6.2 m -137.6 141.35 39.51 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.562 0 C-N-CA 127.87 2.468 . . . . 0.0 109.91 -179.243 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 49.8 mt -90.2 142.29 13.14 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.964 0 O-C-N 121.092 -1.005 . . . . 0.0 108.991 178.591 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -90.8 152.28 20.85 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 123.54 0.736 . . . . 0.0 112.693 -179.718 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 3.7 t -70.29 88.87 0.64 Allowed 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.997 1.719 . . . . 0.0 111.398 -177.061 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 28.9 p90 -57.7 -36.86 72.55 Favored 'General case' 0 N--CA 1.469 0.508 0 O-C-N 121.341 -0.849 . . . . 0.0 111.934 179.374 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 66.8 m-20 -59.48 -30.79 68.79 Favored 'General case' 0 CA--C 1.542 0.648 0 O-C-N 121.807 -0.558 . . . . 0.0 111.66 177.269 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 47.9 t -71.28 -41.46 69.99 Favored 'General case' 0 N--CA 1.469 0.513 0 O-C-N 120.744 -1.223 . . . . 0.0 111.104 177.054 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 48.3 mt -66.94 -40.25 87.53 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 123.912 0.885 . . . . 0.0 112.49 175.731 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 14.2 mmmm -78.48 -8.4 58.49 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 125.078 1.351 . . . . 0.0 114.591 -179.381 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 76.05 49.59 8.47 Favored Glycine 0 CA--C 1.534 1.219 0 CA-C-N 118.786 0.721 . . . . 0.0 112.26 -179.222 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.13 -21.8 1.19 Allowed 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 125.981 1.713 . . . . 0.0 115.588 -174.843 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 7.4 t . . . . . 0 CA--C 1.546 0.816 0 N-CA-C 114.362 1.245 . . . . 0.0 114.362 -174.159 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 59.0 m . . . . . 0 CA--C 1.537 0.471 0 CA-C-O 121.84 0.829 . . . . 0.0 111.138 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 35.2 mtmt -115.51 15.65 16.66 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 125.788 1.635 . . . . 0.0 111.144 176.457 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 68.7 m-85 -139.03 150.43 45.79 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 127.714 2.405 . . . . 0.0 111.381 -174.683 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -73.63 122.06 21.69 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 124.598 1.159 . . . . 0.0 112.874 -178.406 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 4.0 m170 -72.92 117.59 61.06 Favored Pre-proline 0 CA--C 1.547 0.83 0 N-CA-C 107.609 -1.256 . . . . 0.0 107.609 171.455 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 90.1 Cg_exo -48.89 111.47 0.48 Allowed 'Trans proline' 0 CA--C 1.545 1.045 0 C-N-CA 124.475 3.45 . . . . 0.0 116.238 -176.301 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 68.1 Cg_endo -74.53 154.1 44.68 Favored 'Trans proline' 0 CA--C 1.542 0.893 0 C-N-CA 122.391 2.061 . . . . 0.0 111.048 176.38 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -54.95 -34.66 87.21 Favored 'Trans proline' 0 CA--C 1.536 0.59 0 C-N-CA 123.532 2.821 . . . . 0.0 114.682 -177.413 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 19.4 t-80 -75.66 -13.44 60.33 Favored 'General case' 0 N--CA 1.474 0.734 0 N-CA-C 114.519 1.303 . . . . 0.0 114.519 178.308 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 87.7 mt -115.55 -14.6 11.5 Favored 'General case' 0 N--CA 1.474 0.769 0 N-CA-C 113.948 1.092 . . . . 0.0 113.948 178.461 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 56.0 mtpt -54.55 -32.71 58.88 Favored 'General case' 0 N--CA 1.475 0.78 0 CA-C-N 119.728 1.149 . . . . 0.0 110.638 173.103 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 17.4 m -62.89 -42.98 99.97 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 124.648 1.179 . . . . 0.0 111.585 175.208 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 -66.65 -47.23 73.19 Favored 'General case' 0 CA--C 1.536 0.438 0 O-C-N 121.419 -0.801 . . . . 0.0 110.093 176.663 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 44.3 mt -61.92 -39.15 91.03 Favored 'General case' 0 N--CA 1.471 0.584 0 N-CA-C 113.183 0.809 . . . . 0.0 113.183 178.287 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 17.7 mm-40 -53.49 -54.29 39.28 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 124.733 1.213 . . . . 0.0 110.443 174.485 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 69.5 mt -68.45 -37.52 77.93 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.402 0 C-N-CA 126.032 1.733 . . . . 0.0 111.197 -176.186 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 72.8 m-20 -63.13 -44.26 96.09 Favored 'General case' 0 CA--C 1.542 0.66 0 O-C-N 121.623 -0.673 . . . . 0.0 110.294 173.081 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.913 0 C-N-CA 124.431 1.015 . . . . 0.0 112.421 179.326 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.475 0.798 0 N-CA-C 112.785 0.661 . . . . 0.0 112.785 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 85.7 mt -95.06 -20.34 19.4 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 127.269 2.228 . . . . 0.0 114.081 -177.649 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 4.5 m -73.19 73.69 1.26 Allowed 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 125.251 1.42 . . . . 0.0 112.029 -178.957 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.545 HD21 HD13 ' A' ' 75' ' ' LEU . 10.2 tp -75.67 145.25 41.12 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 127.137 2.175 . . . . 0.0 112.098 -178.751 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 11.2 mt-10 -72.95 152.19 41.51 Favored 'General case' 0 N--CA 1.471 0.588 0 O-C-N 120.589 -1.319 . . . . 0.0 112.865 179.146 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 18.0 m -85.21 156.18 3.49 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.852 0 C-N-CA 123.333 0.653 . . . . 0.0 111.446 175.559 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 42.6 t -75.69 128.06 34.39 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-O 121.61 0.719 . . . . 0.0 110.44 176.741 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 4.3 mpt_? -66.82 -27.64 67.72 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 124.384 1.073 . . . . 0.0 113.141 -177.658 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -78.92 -40.75 31.27 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.457 0.703 . . . . 0.0 109.518 177.803 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 63.8 t80 -62.79 -35.28 79.36 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 124.752 1.221 . . . . 0.0 111.2 175.745 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 50.3 mm-40 -62.04 -15.92 48.12 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 124.408 1.083 . . . . 0.0 113.406 175.248 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 12.0 mtp-105 -120.82 12.71 11.37 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 127.06 2.144 . . . . 0.0 112.266 -179.852 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 58.06 34.62 73.37 Favored Glycine 0 CA--C 1.535 1.285 0 C-N-CA 125.061 1.315 . . . . 0.0 113.845 -179.791 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 7.6 t -129.87 14.1 5.82 Favored 'General case' 0 N--CA 1.475 0.796 0 N-CA-C 114.597 1.332 . . . . 0.0 114.597 -175.342 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 6.8 t -68.57 173.35 5.14 Favored 'General case' 0 CA--C 1.556 1.176 0 O-C-N 121.409 -0.807 . . . . 0.0 110.837 174.133 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 91.6 p -139.4 9.34 2.47 Favored 'General case' 0 N--CA 1.477 0.878 0 N-CA-C 115.097 1.517 . . . . 0.0 115.097 -176.825 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 48.3 mtt85 -130.86 145.47 57.85 Favored Pre-proline 0 N--CA 1.47 0.569 0 C-N-CA 125.596 1.558 . . . . 0.0 112.116 -177.589 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -69.05 166.44 26.72 Favored 'Trans proline' 0 CA--C 1.543 0.958 0 C-N-CA 121.962 1.775 . . . . 0.0 109.735 171.973 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -54.24 -29.79 47.88 Favored 'General case' 0 N--CA 1.476 0.862 0 O-C-N 121.129 -0.982 . . . . 0.0 113.054 176.946 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 31.7 p -73.1 -7.63 52.17 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 125.991 1.717 . . . . 0.0 115.004 178.317 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 21.8 mt-10 -127.39 -24.33 3.37 Favored 'General case' 0 N--CA 1.476 0.838 0 N-CA-C 116.059 1.874 . . . . 0.0 116.059 -176.167 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 1.1 t -71.71 164.64 25.59 Favored 'General case' 0 CA--C 1.543 0.691 0 N-CA-C 115.415 1.635 . . . . 0.0 115.415 -176.538 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -81.62 -10.81 59.33 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 126.591 1.956 . . . . 0.0 113.717 -178.598 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 63.1 m-85 -140.06 174.0 10.96 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 126.549 1.939 . . . . 0.0 110.336 179.507 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -80.11 150.02 30.4 Favored 'General case' 0 CA--C 1.548 0.871 0 N-CA-C 113.349 0.87 . . . . 0.0 113.349 -176.957 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 65.8 m170 -123.42 86.14 52.19 Favored Pre-proline 0 CA--C 1.553 1.092 0 C-N-CA 126.049 1.74 . . . . 0.0 110.965 -179.327 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_endo -63.82 152.64 79.75 Favored 'Trans proline' 0 CA--C 1.541 0.842 0 C-N-CA 123.704 2.936 . . . . 0.0 114.998 -177.894 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 39.2 p -92.32 -174.44 3.72 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 124.99 1.316 . . . . 0.0 112.096 175.563 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -62.09 -17.02 56.32 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 125.693 1.597 . . . . 0.0 113.559 173.31 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 61.2 m -109.07 -25.71 10.54 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 124.719 1.208 . . . . 0.0 114.081 -179.744 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 75.2 m -60.56 129.52 41.98 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 123.861 0.864 . . . . 0.0 113.137 -179.618 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 33.9 mt-30 -77.05 141.62 40.21 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 123.161 0.584 . . . . 0.0 110.978 176.115 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 14.5 t -129.48 139.59 51.3 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 C-N-CA 125.438 1.495 . . . . 0.0 110.604 -177.695 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 74.1 mm-40 -145.32 129.35 17.49 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 125.213 1.405 . . . . 0.0 111.49 179.943 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 63.3 t30 42.88 37.23 1.03 Allowed 'General case' 0 CA--C 1.555 1.138 0 N-CA-C 116.298 1.962 . . . . 0.0 116.298 176.684 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 85.58 17.18 62.49 Favored Glycine 0 CA--C 1.536 1.399 0 O-C-N 120.975 -1.078 . . . . 0.0 114.813 -179.407 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 60.8 mtt180 -138.72 162.01 35.75 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 125.842 1.657 . . . . 0.0 111.472 -179.1 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 4.9 m -138.35 142.25 35.7 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.626 0 C-N-CA 126.949 2.1 . . . . 0.0 109.938 -177.869 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 31.8 mt -90.36 129.28 41.46 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.766 0 O-C-N 121.289 -0.882 . . . . 0.0 110.337 -178.048 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -75.53 149.24 38.43 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 124.16 0.984 . . . . 0.0 111.733 177.868 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 15.2 t -69.45 99.52 1.25 Allowed 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 124.876 1.27 . . . . 0.0 112.985 -176.696 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 32.1 p90 -61.66 -38.56 88.19 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 115.165 -0.925 . . . . 0.0 110.154 175.108 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 69.9 m-20 -61.26 -41.78 97.52 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 123.17 0.588 . . . . 0.0 111.033 177.187 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 48.2 t -64.63 -41.65 96.03 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-N 119.48 1.036 . . . . 0.0 111.462 177.678 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 31.2 mt -66.5 -41.63 88.6 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 123.804 0.841 . . . . 0.0 112.882 176.504 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 31.4 mmmt -77.77 -10.97 59.82 Favored 'General case' 0 N--CA 1.478 0.966 0 C-N-CA 124.668 1.187 . . . . 0.0 113.71 179.158 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 81.14 38.39 15.44 Favored Glycine 0 CA--C 1.537 1.412 0 C-N-CA 124.605 1.098 . . . . 0.0 113.803 179.644 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 50.9 ttp180 -121.97 -20.78 6.22 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 126.551 1.94 . . . . 0.0 114.555 -176.592 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 5.4 t . . . . . 0 CA--C 1.544 0.728 0 CA-C-N 119.318 0.963 . . . . 0.0 112.973 -178.286 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 7.4 t . . . . . 0 CA--C 1.545 0.751 0 CA-C-O 121.625 0.726 . . . . 0.0 112.167 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 30.4 mtmt -84.64 4.49 32.15 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 125.07 1.348 . . . . 0.0 114.089 -177.374 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 86.8 m-85 -127.24 155.71 43.03 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 124.823 1.249 . . . . 0.0 112.173 -175.304 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -77.31 114.43 16.12 Favored 'General case' 0 N--CA 1.467 0.412 0 C-N-CA 123.699 0.799 . . . . 0.0 112.079 -177.306 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 9.3 m170 -69.57 115.16 30.09 Favored Pre-proline 0 CA--C 1.546 0.805 0 N-CA-C 107.741 -1.207 . . . . 0.0 107.741 173.849 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 92.9 Cg_exo -49.71 114.1 1.22 Allowed 'Trans proline' 0 CA--C 1.543 0.967 0 C-N-CA 124.554 3.503 . . . . 0.0 116.238 -174.887 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -77.42 149.76 27.81 Favored 'Trans proline' 0 CA--C 1.542 0.923 0 C-N-CA 122.114 1.876 . . . . 0.0 110.435 175.876 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 88.5 Cg_exo -46.87 -39.47 24.48 Favored 'Trans proline' 0 CA--C 1.539 0.739 0 C-N-CA 123.895 3.064 . . . . 0.0 115.437 -179.968 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 12.7 t-80 -70.71 -17.78 62.82 Favored 'General case' 0 N--CA 1.472 0.666 0 N-CA-C 115.08 1.511 . . . . 0.0 115.08 179.774 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.545 HD13 HD21 ' A' ' 16' ' ' LEU . 76.3 mt -113.32 -16.36 12.51 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 124.597 1.159 . . . . 0.0 113.009 178.143 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 53.6 mtpt -54.72 -34.73 62.82 Favored 'General case' 0 N--CA 1.478 0.964 0 CA-C-N 119.742 1.156 . . . . 0.0 111.533 174.365 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 23.0 m -63.75 -43.72 95.62 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 123.461 0.705 . . . . 0.0 111.329 175.805 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 91.1 mm-40 -67.22 -45.7 76.03 Favored 'General case' 0 N--CA 1.469 0.514 0 O-C-N 121.458 -0.776 . . . . 0.0 111.002 177.598 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 81.8 mt -61.82 -49.86 74.59 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 124.376 1.07 . . . . 0.0 112.285 178.467 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.35 -35.84 82.2 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-N 119.541 1.064 . . . . 0.0 112.735 -179.598 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 59.4 mt -62.58 -44.29 99.24 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.785 0 CA-C-N 118.759 0.709 . . . . 0.0 109.851 174.582 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 13.3 t-20 -63.98 -39.8 94.94 Favored 'General case' 0 CA--C 1.546 0.814 0 O-C-N 121.677 -0.639 . . . . 0.0 110.5 175.78 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.532 1.115 0 C-N-CA 124.858 1.218 . . . . 0.0 112.259 176.564 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.475 0.808 0 N-CA-C 112.923 0.712 . . . . 0.0 112.923 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 83.9 mt -85.13 -13.89 48.75 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 126.816 2.046 . . . . 0.0 114.017 -178.714 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 11.1 m -77.97 79.17 4.44 Favored 'General case' 0 N--CA 1.475 0.821 0 CA-C-O 122.442 1.115 . . . . 0.0 110.398 -178.538 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -75.64 140.78 42.76 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 128.492 2.717 . . . . 0.0 111.363 -177.612 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 14.5 mt-10 -74.47 151.49 39.56 Favored 'General case' 0 N--CA 1.472 0.664 0 O-C-N 120.49 -1.381 . . . . 0.0 112.179 177.917 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 13.9 m -83.46 155.77 3.76 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.765 0 C-N-CA 122.848 0.459 . . . . 0.0 110.605 175.372 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 40.5 t -75.0 130.12 38.82 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-O 121.646 0.736 . . . . 0.0 110.648 177.096 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 3.5 mpt_? -67.59 -28.68 67.97 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 124.355 1.062 . . . . 0.0 113.207 -177.32 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -82.26 -33.06 29.34 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 118.262 0.483 . . . . 0.0 110.831 178.436 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 72.9 t80 -64.96 -35.92 82.72 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 123.702 0.801 . . . . 0.0 109.657 172.938 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 60.2 mm-40 -65.01 -18.6 65.44 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 124.132 0.973 . . . . 0.0 112.591 173.786 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 47.9 mtp180 -106.67 3.26 26.59 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 126.481 1.912 . . . . 0.0 112.494 178.523 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 62.61 34.04 88.38 Favored Glycine 0 CA--C 1.537 1.417 0 C-N-CA 125.197 1.379 . . . . 0.0 113.606 -178.077 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 5.3 t -138.12 16.09 2.82 Favored 'General case' 0 N--CA 1.478 0.937 0 N-CA-C 115.464 1.653 . . . . 0.0 115.464 -174.854 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 7.5 t -64.71 168.79 5.69 Favored 'General case' 0 CA--C 1.558 1.277 0 CA-C-N 119.275 0.943 . . . . 0.0 111.441 175.647 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 50.7 m -128.95 7.2 5.54 Favored 'General case' 0 N--CA 1.48 1.046 0 N-CA-C 115.562 1.69 . . . . 0.0 115.562 -175.289 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 87.9 mtt180 -137.07 145.68 51.4 Favored Pre-proline 0 N--CA 1.474 0.748 0 C-N-CA 125.527 1.531 . . . . 0.0 111.921 -178.874 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 74.6 Cg_endo -69.26 167.66 23.13 Favored 'Trans proline' 0 CA--C 1.544 1.005 0 C-N-CA 122.231 1.954 . . . . 0.0 110.141 172.49 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -54.38 -31.19 54.24 Favored 'General case' 0 N--CA 1.48 1.038 0 O-C-N 121.079 -1.013 . . . . 0.0 112.492 177.543 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 23.5 p -71.33 -6.94 43.73 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 126.318 1.847 . . . . 0.0 114.982 177.206 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 29.4 mt-10 -132.56 -21.44 2.24 Favored 'General case' 0 N--CA 1.476 0.836 0 N-CA-C 116.342 1.979 . . . . 0.0 116.342 -176.27 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 3.7 t -72.19 169.87 15.23 Favored 'General case' 0 CA--C 1.552 1.037 0 CA-C-N 119.935 1.243 . . . . 0.0 114.214 -177.977 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 56.0 mtmt -88.26 -10.66 48.91 Favored 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 126.518 1.927 . . . . 0.0 114.081 -178.516 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 66.7 m-85 -139.33 171.63 13.99 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 127.301 2.24 . . . . 0.0 109.389 177.02 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -82.38 150.86 26.91 Favored 'General case' 0 CA--C 1.546 0.809 0 N-CA-C 114.644 1.349 . . . . 0.0 114.644 -175.894 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 57.4 m170 -122.88 88.28 50.52 Favored Pre-proline 0 CA--C 1.552 1.028 0 C-N-CA 126.017 1.727 . . . . 0.0 110.577 179.073 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 26.5 Cg_endo -61.79 148.06 93.92 Favored 'Trans proline' 0 C--N 1.352 0.731 0 C-N-CA 123.148 2.565 . . . . 0.0 114.569 -178.315 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 59.7 p -82.48 -178.92 7.24 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 124.405 1.082 . . . . 0.0 111.908 175.055 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 31.2 mmmt -61.43 -17.36 53.98 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 125.445 1.498 . . . . 0.0 113.352 173.383 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 50.5 m -109.2 -17.94 13.73 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 125.016 1.326 . . . . 0.0 114.535 -178.686 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 83.5 m -69.27 154.14 42.52 Favored 'General case' 0 CA--C 1.543 0.676 0 CA-C-N 119.704 1.138 . . . . 0.0 112.682 177.833 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 39.0 mt-30 -110.13 141.21 43.33 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 124.483 1.113 . . . . 0.0 111.466 178.807 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -133.38 148.34 30.97 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.558 0 C-N-CA 125.054 1.342 . . . . 0.0 112.632 -177.48 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -146.01 140.79 27.09 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 125.934 1.694 . . . . 0.0 110.524 177.015 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 7.3 t-20 46.51 30.7 1.14 Allowed 'General case' 0 CA--C 1.553 1.069 0 C-N-CA 126.083 1.753 . . . . 0.0 115.245 179.207 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 82.09 22.81 58.54 Favored Glycine 0 CA--C 1.537 1.425 0 O-C-N 121.044 -1.035 . . . . 0.0 114.19 -178.253 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 53.2 mtt85 -138.13 160.64 38.87 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 125.249 1.42 . . . . 0.0 112.088 -178.446 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 4.4 m -136.78 138.59 46.01 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.514 0 C-N-CA 127.733 2.413 . . . . 0.0 109.886 -176.99 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 20.6 mt -88.48 129.77 39.09 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.558 0 O-C-N 121.306 -0.871 . . . . 0.0 109.63 -179.033 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -75.39 147.2 40.21 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 123.84 0.856 . . . . 0.0 111.067 178.054 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 11.8 t -69.23 98.79 1.07 Allowed 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 124.489 1.115 . . . . 0.0 112.538 -177.094 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 30.8 p90 -60.91 -38.18 84.82 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.104 175.645 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 70.1 m-20 -62.14 -36.65 82.44 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 123.571 0.748 . . . . 0.0 111.695 177.098 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 29.6 t -66.67 -42.12 87.07 Favored 'General case' 0 CA--C 1.539 0.558 0 CA-C-N 119.613 1.097 . . . . 0.0 111.146 176.461 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 31.8 mt -67.75 -39.89 84.17 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 123.82 0.848 . . . . 0.0 112.836 176.573 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 58' ' ' LYS . . . . . 0.444 ' HE2' ' HA ' ' A' ' 58' ' ' LYS . 10.0 mmpt? -80.82 -7.55 59.45 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 125.034 1.334 . . . . 0.0 114.161 -179.397 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 78.26 39.45 22.86 Favored Glycine 0 CA--C 1.536 1.366 0 C-N-CA 124.428 1.013 . . . . 0.0 113.837 179.021 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 34.7 ttm105 -120.73 -27.42 5.07 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 126.805 2.042 . . . . 0.0 113.755 -177.17 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 7.2 t . . . . . 0 CA--C 1.544 0.741 0 CA-C-N 118.991 0.814 . . . . 0.0 112.229 -178.293 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 4.2 t . . . . . 0 CA--C 1.545 0.771 0 CA-C-O 121.271 0.557 . . . . 0.0 111.159 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 32.5 mtmt -117.55 2.7 12.4 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 125.723 1.609 . . . . 0.0 113.533 -177.304 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 88.4 m-85 -123.45 151.74 42.37 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 125.95 1.7 . . . . 0.0 110.461 -176.987 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -75.08 115.42 14.69 Favored 'General case' 0 N--CA 1.467 0.396 0 O-C-N 121.595 -0.69 . . . . 0.0 112.017 -176.331 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 14.4 m170 -70.53 114.0 22.77 Favored Pre-proline 0 CA--C 1.547 0.857 0 N-CA-C 108.199 -1.038 . . . . 0.0 108.199 175.161 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 66.4 Cg_exo -46.96 109.53 0.22 Allowed 'Trans proline' 0 CA--C 1.544 1.01 0 C-N-CA 125.074 3.849 . . . . 0.0 117.143 -174.168 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_endo -77.59 151.59 28.89 Favored 'Trans proline' 0 CA--C 1.544 1.013 0 C-N-CA 122.815 2.343 . . . . 0.0 111.35 176.462 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_exo -47.26 -40.67 27.94 Favored 'Trans proline' 0 CA--C 1.539 0.769 0 C-N-CA 123.916 3.077 . . . . 0.0 115.496 179.059 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 8.3 m-70 -70.64 -15.79 62.76 Favored 'General case' 0 N--CA 1.476 0.866 0 N-CA-C 114.87 1.433 . . . . 0.0 114.87 178.98 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 85.7 mt -116.42 -15.21 10.94 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 124.116 0.966 . . . . 0.0 113.562 178.956 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 54.9 mtpt -55.73 -32.32 63.26 Favored 'General case' 0 N--CA 1.475 0.808 0 CA-C-N 119.736 1.153 . . . . 0.0 110.527 172.944 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 21.5 m -62.82 -45.45 92.57 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 124.206 1.002 . . . . 0.0 111.227 174.811 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 77.6 mt-30 -64.94 -46.54 81.17 Favored 'General case' 0 CA--C 1.54 0.57 0 O-C-N 121.39 -0.819 . . . . 0.0 110.518 176.636 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 85.1 mt -61.92 -39.8 93.3 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 124.33 1.052 . . . . 0.0 112.711 178.164 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 20.1 mm-40 -55.71 -53.64 54.13 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 124.89 1.276 . . . . 0.0 110.428 174.975 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 62.3 mt -67.68 -38.63 80.71 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.428 0 C-N-CA 125.711 1.605 . . . . 0.0 111.074 -175.97 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 54.7 m-20 -62.32 -43.46 98.76 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 123.157 0.583 . . . . 0.0 110.394 172.65 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.527 0.832 0 C-N-CA 124.209 0.909 . . . . 0.0 111.81 178.558 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.476 0.875 0 N-CA-C 114.687 1.366 . . . . 0.0 114.687 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 67.8 mt -86.09 -10.32 55.12 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 126.72 2.008 . . . . 0.0 114.091 -177.463 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 3.6 m -75.76 76.24 2.72 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 124.752 1.221 . . . . 0.0 110.922 -178.698 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.433 HD21 HD13 ' A' ' 75' ' ' LEU . 13.7 tp -75.43 140.76 43.1 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 127.684 2.394 . . . . 0.0 111.51 -177.099 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 47.1 mp0 -67.53 150.88 48.26 Favored 'General case' 0 CA--C 1.543 0.683 0 O-C-N 120.569 -1.332 . . . . 0.0 111.977 178.396 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 21.2 m -87.08 149.58 4.06 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.075 0 C-N-CA 122.915 0.486 . . . . 0.0 111.054 174.588 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' CYS . . . . . 0.434 ' SG ' ' NZ ' ' A' ' 35' ' ' LYS . 46.9 t -70.89 134.72 47.5 Favored 'General case' 0 CA--C 1.538 0.493 0 O-C-N 121.621 -0.675 . . . . 0.0 110.782 177.035 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 3.7 mpt_? -71.75 -33.39 68.62 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 125.521 1.528 . . . . 0.0 112.721 -178.09 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 34.9 mt-10 -73.91 -38.0 64.46 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 123.731 0.812 . . . . 0.0 110.498 178.539 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 76.8 t80 -63.15 -28.7 70.24 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 124.804 1.242 . . . . 0.0 111.922 177.237 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 53.4 mm-40 -64.04 -19.97 65.59 Favored 'General case' 0 N--CA 1.477 0.9 0 N-CA-C 112.982 0.734 . . . . 0.0 112.982 175.978 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 6.8 mpt_? -110.8 9.36 22.59 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 125.987 1.715 . . . . 0.0 111.865 177.732 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 58.47 35.05 77.92 Favored Glycine 0 CA--C 1.533 1.186 0 C-N-CA 125.065 1.317 . . . . 0.0 114.094 -179.831 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 6.4 t -129.24 8.81 5.58 Favored 'General case' 0 N--CA 1.478 0.959 0 N-CA-C 114.51 1.3 . . . . 0.0 114.51 -175.76 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 12.4 t -60.34 136.66 58.11 Favored 'General case' 0 CA--C 1.55 0.962 0 C-N-CA 123.555 0.742 . . . . 0.0 111.305 177.61 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 33.1 m -80.6 -1.96 44.36 Favored 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 115.984 1.846 . . . . 0.0 115.984 -176.302 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 23.1 mtm-85 -134.21 151.71 76.94 Favored Pre-proline 0 N--CA 1.479 0.991 0 C-N-CA 124.971 1.308 . . . . 0.0 113.277 -174.702 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 89.7 Cg_endo -71.22 167.7 25.45 Favored 'Trans proline' 0 CA--C 1.544 0.983 0 C-N-CA 122.553 2.169 . . . . 0.0 109.924 172.306 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -53.16 -28.52 26.69 Favored 'General case' 0 N--CA 1.475 0.808 0 N-CA-C 114.518 1.303 . . . . 0.0 114.518 178.776 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 12.4 p -75.99 -14.81 60.23 Favored 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 115.024 1.49 . . . . 0.0 115.024 179.057 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -121.42 -18.39 7.31 Favored 'General case' 0 N--CA 1.476 0.843 0 N-CA-C 116.711 2.115 . . . . 0.0 116.711 -173.122 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 2.9 t -72.81 172.23 11.2 Favored 'General case' 0 CA--C 1.55 0.966 0 N-CA-C 116.349 1.981 . . . . 0.0 116.349 -176.763 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.434 ' NZ ' ' SG ' ' A' ' 19' ' ' CYS . 7.0 ptpp? -75.2 -22.69 57.82 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 129.543 3.137 . . . . 0.0 115.274 -178.347 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 11.5 m-85 -144.08 176.36 9.36 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 126.678 1.991 . . . . 0.0 110.268 -176.632 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -77.26 147.57 36.23 Favored 'General case' 0 CA--C 1.548 0.894 0 O-C-N 121.137 -0.977 . . . . 0.0 113.428 -176.577 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 55.0 m170 -120.68 87.36 41.85 Favored Pre-proline 0 CA--C 1.552 1.037 0 C-N-CA 125.843 1.657 . . . . 0.0 110.623 179.854 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_endo -61.57 146.57 96.8 Favored 'Trans proline' 0 CA--C 1.539 0.768 0 C-N-CA 123.552 2.835 . . . . 0.0 115.014 -177.683 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 53.6 p -84.64 -174.7 5.42 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 125.148 1.379 . . . . 0.0 112.266 175.714 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -60.75 -22.12 63.71 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 125.712 1.605 . . . . 0.0 113.67 174.355 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 66.7 p -109.16 -19.75 13.23 Favored 'General case' 0 N--CA 1.478 0.94 0 N-CA-C 114.413 1.264 . . . . 0.0 114.413 179.444 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 98.4 m -60.51 129.87 43.77 Favored 'General case' 0 CA--C 1.542 0.667 0 CA-C-N 119.723 1.147 . . . . 0.0 112.54 179.296 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 48.6 tt0 -83.46 133.76 34.89 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 124.815 1.246 . . . . 0.0 110.395 178.904 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 21.5 t -116.9 141.94 32.9 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.929 0 C-N-CA 125.525 1.53 . . . . 0.0 109.939 -177.719 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 74.5 mm-40 -142.63 125.67 16.29 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 125.239 1.416 . . . . 0.0 111.303 -179.175 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 63.6 t30 42.17 38.16 1.06 Allowed 'General case' 0 CA--C 1.555 1.152 0 N-CA-C 116.708 2.114 . . . . 0.0 116.708 175.718 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 88.62 14.9 60.74 Favored Glycine 0 CA--C 1.536 1.398 0 O-C-N 120.869 -1.144 . . . . 0.0 115.082 -179.656 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 48.3 mtt-85 -139.82 168.48 19.73 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 126.341 1.857 . . . . 0.0 112.099 -178.988 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 3.5 m -139.85 138.17 38.6 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.539 0 C-N-CA 126.947 2.099 . . . . 0.0 109.491 179.636 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 70.8 mt -86.21 135.66 24.57 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.783 0 O-C-N 120.992 -1.068 . . . . 0.0 109.451 179.955 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -80.75 150.08 29.4 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 123.66 0.784 . . . . 0.0 112.454 178.687 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 7.5 t -70.09 94.16 0.86 Allowed 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 126.183 1.793 . . . . 0.0 110.135 -179.479 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 29.5 p90 -56.41 -37.66 70.48 Favored 'General case' 0 N--CA 1.471 0.587 0 O-C-N 121.069 -1.019 . . . . 0.0 112.118 -179.738 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 -60.45 -29.16 68.85 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 123.452 0.701 . . . . 0.0 112.276 177.623 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 47.8 p -71.14 -37.87 72.27 Favored 'General case' 0 N--CA 1.471 0.58 0 O-C-N 121.079 -1.013 . . . . 0.0 111.757 177.035 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 69.8 mt -74.16 -42.82 59.32 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.416 1.086 . . . . 0.0 111.876 176.74 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 31.2 mmmt -74.13 -11.96 60.45 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 124.766 1.227 . . . . 0.0 113.795 179.836 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 80.48 41.22 11.65 Favored Glycine 0 CA--C 1.536 1.355 0 C-N-CA 124.449 1.023 . . . . 0.0 114.052 178.462 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 48.4 ttp180 -127.06 -18.65 4.55 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 126.264 1.826 . . . . 0.0 114.834 -176.694 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 8.4 t . . . . . 0 CA--C 1.548 0.87 0 CA-C-N 119.286 0.948 . . . . 0.0 112.538 -179.818 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 3.8 m . . . . . 0 CA--C 1.54 0.583 0 N-CA-C 113.495 0.924 . . . . 0.0 113.495 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 22.6 mtmt -78.29 6.94 7.19 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 123.152 0.581 . . . . 0.0 111.918 173.485 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 58.0 m-85 -127.55 150.85 49.51 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 126.698 1.999 . . . . 0.0 111.214 -174.149 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -79.17 126.89 31.33 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 124.048 0.939 . . . . 0.0 113.285 -175.445 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 38.1 m170 -75.5 115.49 46.15 Favored Pre-proline 0 CA--C 1.548 0.872 0 N-CA-C 106.717 -1.586 . . . . 0.0 106.717 170.496 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 81.7 Cg_exo -53.2 122.52 11.31 Favored 'Trans proline' 0 CA--C 1.543 0.955 0 C-N-CA 123.659 2.906 . . . . 0.0 115.146 -175.552 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_endo -77.91 155.03 30.2 Favored 'Trans proline' 0 CA--C 1.542 0.908 0 C-N-CA 122.226 1.951 . . . . 0.0 111.119 177.5 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 80.4 Cg_exo -45.32 -37.12 13.68 Favored 'Trans proline' 0 CA--C 1.538 0.724 0 C-N-CA 124.306 3.337 . . . . 0.0 115.848 179.214 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 76.4 m80 -78.66 -13.21 59.94 Favored 'General case' 0 N--CA 1.474 0.729 0 N-CA-C 115.336 1.606 . . . . 0.0 115.336 -179.898 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.433 HD13 HD21 ' A' ' 16' ' ' LEU . 50.8 mt -118.7 -9.64 10.16 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.617 1.167 . . . . 0.0 113.252 177.732 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 56.3 mtpt -55.84 -39.2 71.08 Favored 'General case' 0 N--CA 1.481 1.096 0 CA-C-N 120.293 1.406 . . . . 0.0 110.098 171.209 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 20.4 m -62.63 -41.44 99.02 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 124.423 1.089 . . . . 0.0 111.463 175.026 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 47.2 tp60 -66.2 -42.34 88.94 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 124.311 1.044 . . . . 0.0 110.929 178.185 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 27.6 mt -67.74 -42.3 82.07 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-O 118.516 -0.754 . . . . 0.0 112.597 178.054 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 3.1 pt-20 -64.01 -36.83 85.28 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-N 119.869 1.213 . . . . 0.0 111.056 175.665 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 64.2 mt -63.06 -42.91 98.43 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.721 0 CA-C-N 118.97 0.805 . . . . 0.0 109.812 175.332 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 60.0 m-20 -60.97 -48.14 83.2 Favored 'General case' 0 CA--C 1.545 0.783 0 CA-C-N 118.495 0.589 . . . . 0.0 110.28 175.724 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.471 0.991 0 C-N-CA 124.955 1.265 . . . . 0.0 112.51 179.076 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.544 0.738 0 N-CA-C 112.992 0.738 . . . . 0.0 112.992 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 71.3 mt -98.08 -18.3 18.61 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 126.536 1.934 . . . . 0.0 114.659 -177.119 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 6.5 m -77.19 77.76 3.73 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 124.508 1.123 . . . . 0.0 110.68 -178.01 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -75.7 143.43 42.13 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 129.022 2.929 . . . . 0.0 111.843 -177.758 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 52.3 mt-10 -71.08 151.29 44.67 Favored 'General case' 0 N--CA 1.472 0.651 0 O-C-N 120.695 -1.253 . . . . 0.0 112.386 177.212 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 15.7 m -84.11 155.79 3.66 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.03 0 C-N-CA 123.277 0.631 . . . . 0.0 111.286 174.04 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 52.8 t -75.59 133.34 40.95 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-O 121.852 0.834 . . . . 0.0 111.199 176.924 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 3.1 mpt_? -69.59 -26.62 64.54 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 124.716 1.207 . . . . 0.0 112.91 -178.876 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -82.79 -36.54 25.53 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 122.966 0.506 . . . . 0.0 109.906 177.353 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 61.3 t80 -65.27 -34.41 78.27 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 124.245 1.018 . . . . 0.0 110.344 175.161 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 12.0 mm100 -63.11 -14.2 45.62 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 124.527 1.131 . . . . 0.0 112.86 173.791 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 81.9 mtt85 -119.16 10.17 11.99 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 127.091 2.156 . . . . 0.0 112.083 -179.845 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 57.34 35.14 70.01 Favored Glycine 0 CA--C 1.534 1.26 0 C-N-CA 125.528 1.537 . . . . 0.0 114.304 -179.637 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 4.8 t -134.65 6.08 3.45 Favored 'General case' 0 N--CA 1.477 0.91 0 N-CA-C 115.205 1.557 . . . . 0.0 115.205 -174.604 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 17.6 t -58.82 128.65 38.28 Favored 'General case' 0 CA--C 1.547 0.835 0 O-C-N 120.938 -1.101 . . . . 0.0 111.037 177.374 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 78.5 p -83.92 6.55 21.31 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 125.616 1.567 . . . . 0.0 114.346 -178.371 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 61.6 mtm-85 -131.35 145.22 56.7 Favored Pre-proline 0 N--CA 1.471 0.618 0 C-N-CA 125.421 1.488 . . . . 0.0 113.979 -172.991 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 98.1 Cg_endo -70.29 166.19 29.08 Favored 'Trans proline' 0 CA--C 1.544 1.001 0 C-N-CA 122.225 1.95 . . . . 0.0 109.816 171.074 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -54.28 -29.23 46.44 Favored 'General case' 0 N--CA 1.476 0.843 0 O-C-N 121.142 -0.973 . . . . 0.0 113.423 176.692 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 30.6 p -73.82 -13.22 60.9 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 125.873 1.669 . . . . 0.0 115.092 178.9 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 29.9 mm-40 -115.94 -29.85 6.23 Favored 'General case' 0 N--CA 1.478 0.926 0 N-CA-C 115.182 1.549 . . . . 0.0 115.182 -177.073 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 4.1 t -65.12 166.5 9.48 Favored 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 115.499 1.666 . . . . 0.0 115.499 -173.883 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.36 -13.03 47.67 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 127.391 2.277 . . . . 0.0 112.524 -179.324 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 57.8 m-85 -137.67 175.97 9.12 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 126.383 1.873 . . . . 0.0 110.237 -179.296 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -83.55 150.89 25.67 Favored 'General case' 0 CA--C 1.544 0.726 0 N-CA-C 113.725 1.009 . . . . 0.0 113.725 -177.487 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 66.0 m170 -122.19 85.85 46.99 Favored Pre-proline 0 CA--C 1.55 0.975 0 C-N-CA 126.116 1.766 . . . . 0.0 111.001 -179.624 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_endo -63.09 144.93 93.52 Favored 'Trans proline' 0 C--N 1.351 0.709 0 C-N-CA 123.402 2.735 . . . . 0.0 114.694 -177.841 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 59.9 p -82.83 -175.76 5.96 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 124.608 1.163 . . . . 0.0 111.906 174.909 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 75.2 mmtt -61.1 -19.91 62.02 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 125.497 1.519 . . . . 0.0 113.481 173.524 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 68.6 p -109.17 -18.22 13.67 Favored 'General case' 0 N--CA 1.477 0.884 0 N-CA-C 114.863 1.431 . . . . 0.0 114.863 -179.594 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 91.2 m -62.74 139.66 58.69 Favored 'General case' 0 CA--C 1.543 0.694 0 CA-C-N 119.576 1.08 . . . . 0.0 113.723 -179.61 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 47.2 tp60 -80.76 130.03 34.85 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 125.422 1.489 . . . . 0.0 110.371 178.235 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 9.9 t -126.52 137.2 58.53 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.022 0 C-N-CA 125.324 1.45 . . . . 0.0 110.509 -178.012 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -147.07 130.89 17.04 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 125.293 1.437 . . . . 0.0 111.745 178.512 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 62.2 t30 40.12 38.85 0.55 Allowed 'General case' 0 CA--C 1.553 1.065 0 C-N-CA 127.211 2.204 . . . . 0.0 116.758 176.802 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 90.12 11.54 62.96 Favored Glycine 0 CA--C 1.537 1.42 0 O-C-N 121.016 -1.053 . . . . 0.0 115.299 179.41 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 44.7 mtm180 -135.91 164.36 28.13 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 125.622 1.569 . . . . 0.0 112.038 179.78 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 8.2 m -139.29 149.19 23.09 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.573 0 C-N-CA 127.581 2.352 . . . . 0.0 109.413 -179.628 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 40.2 mt -97.54 129.42 47.69 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.913 0 O-C-N 121.018 -1.051 . . . . 0.0 110.651 -177.527 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -74.58 145.76 43.1 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 124.125 0.97 . . . . 0.0 111.406 177.206 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 13.2 t -69.47 99.61 1.27 Allowed 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 124.828 1.251 . . . . 0.0 113.175 -176.683 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 41.3 p90 -61.89 -38.92 90.15 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 115.157 -0.929 . . . . 0.0 110.29 175.299 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 65.9 m-20 -60.79 -41.3 95.3 Favored 'General case' 0 CA--C 1.54 0.577 0 O-C-N 121.787 -0.571 . . . . 0.0 110.836 176.78 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 43.8 t -65.09 -41.76 94.72 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-N 119.548 1.067 . . . . 0.0 111.347 177.269 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 31.1 mt -65.41 -41.9 93.13 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 124.009 0.923 . . . . 0.0 112.923 176.492 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 31.4 mmmt -78.33 -12.59 60.01 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 124.948 1.299 . . . . 0.0 113.753 179.325 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 84.03 39.27 9.45 Favored Glycine 0 CA--C 1.536 1.395 0 C-N-CA 124.639 1.114 . . . . 0.0 114.078 179.281 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 50.4 tpt85 -123.09 -23.3 4.97 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 126.44 1.896 . . . . 0.0 114.879 -177.075 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 6.5 t . . . . . 0 CA--C 1.543 0.709 0 CA-C-N 119.437 1.017 . . . . 0.0 112.895 -176.829 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 8.0 t . . . . . 0 CA--C 1.546 0.801 0 CA-C-O 121.482 0.658 . . . . 0.0 112.219 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 26.1 mtmt -90.12 4.08 51.46 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 124.42 1.088 . . . . 0.0 113.365 -179.297 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 85.3 m-85 -120.91 148.85 43.5 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 122.052 0.93 . . . . 0.0 112.375 -174.409 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -73.01 114.27 10.97 Favored 'General case' 0 N--CA 1.464 0.271 0 C-N-CA 123.896 0.878 . . . . 0.0 111.566 -176.879 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 13.2 m170 -71.37 114.61 29.34 Favored Pre-proline 0 CA--C 1.548 0.87 0 N-CA-C 107.382 -1.34 . . . . 0.0 107.382 174.557 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 65.9 Cg_exo -48.74 116.45 2.14 Favored 'Trans proline' 0 CA--C 1.542 0.921 0 C-N-CA 124.611 3.54 . . . . 0.0 116.975 -174.096 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -75.99 149.36 32.71 Favored 'Trans proline' 0 CA--C 1.545 1.044 0 C-N-CA 122.265 1.977 . . . . 0.0 110.518 174.937 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_exo -46.16 -41.04 21.79 Favored 'Trans proline' 0 CA--C 1.537 0.674 0 C-N-CA 124.068 3.179 . . . . 0.0 115.685 -179.789 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 13.8 t-80 -69.38 -17.28 63.66 Favored 'General case' 0 N--CA 1.474 0.765 0 N-CA-C 114.984 1.476 . . . . 0.0 114.984 179.761 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 93.2 mt -112.85 -16.95 12.63 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 124.367 1.067 . . . . 0.0 113.029 178.197 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 54.7 mtpt -54.56 -37.43 65.45 Favored 'General case' 0 N--CA 1.478 0.973 0 CA-C-N 119.791 1.178 . . . . 0.0 111.623 174.798 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 21.9 m -62.24 -41.76 98.72 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 123.731 0.812 . . . . 0.0 111.495 176.469 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 16.5 mm100 -69.67 -45.33 68.6 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 123.734 0.814 . . . . 0.0 110.898 178.324 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 89.4 mt -62.69 -46.2 89.25 Favored 'General case' 0 N--CA 1.466 0.345 0 C-N-CA 124.077 0.951 . . . . 0.0 112.423 178.738 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -64.91 -36.94 85.98 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-N 119.651 1.114 . . . . 0.0 112.28 178.97 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 63.7 mt -65.21 -45.43 93.82 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.707 0 CA-C-N 118.803 0.729 . . . . 0.0 110.064 176.176 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 24.5 m-80 -64.01 -38.82 92.48 Favored 'General case' 0 CA--C 1.54 0.587 0 O-C-N 121.627 -0.67 . . . . 0.0 111.456 176.645 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.907 0 C-N-CA 123.948 0.785 . . . . 0.0 111.959 177.977 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 1.8 p90 . . . . . 0 N--CA 1.474 0.73 0 N-CA-C 114.468 1.284 . . . . 0.0 114.468 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 88.4 mt -95.84 -18.19 20.56 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 125.688 1.595 . . . . 0.0 114.766 -175.849 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 2.5 m -75.44 77.35 2.49 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 124.454 1.102 . . . . 0.0 111.898 -178.604 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -75.86 144.63 41.1 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 127.178 2.191 . . . . 0.0 111.534 -179.822 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 11.5 mt-10 -73.57 151.11 41.03 Favored 'General case' 0 N--CA 1.472 0.668 0 O-C-N 120.563 -1.336 . . . . 0.0 111.402 176.014 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 12.3 m -82.82 145.88 7.85 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.789 0 N-CA-C 108.543 -0.91 . . . . 0.0 108.543 173.237 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 42.0 t -60.21 127.52 32.25 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-O 121.687 0.756 . . . . 0.0 111.213 179.643 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.439 ' H ' ' HD2' ' A' ' 20' ' ' ARG . 3.6 mpt_? -60.06 -31.69 70.23 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 124.976 1.311 . . . . 0.0 112.94 -176.585 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 28.9 mm-40 -81.44 -34.86 31.23 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 123.343 0.657 . . . . 0.0 110.777 177.782 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 51.3 t80 -63.99 -24.92 67.9 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 124.364 1.066 . . . . 0.0 111.383 173.942 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 80.7 mt-30 -58.86 -23.9 61.45 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 123.533 0.733 . . . . 0.0 112.919 176.003 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -117.24 13.06 14.56 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 125.508 1.523 . . . . 0.0 111.943 176.895 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 62.06 37.5 94.55 Favored Glycine 0 CA--C 1.533 1.204 0 C-N-CA 125.014 1.293 . . . . 0.0 113.986 -178.937 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 7.2 t -127.24 18.46 7.03 Favored 'General case' 0 N--CA 1.479 1.001 0 N-CA-C 114.688 1.366 . . . . 0.0 114.688 -176.28 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 14.5 t -67.32 172.04 5.26 Favored 'General case' 0 CA--C 1.558 1.279 0 O-C-N 121.572 -0.705 . . . . 0.0 110.319 172.733 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 90.4 p -132.26 8.48 4.33 Favored 'General case' 0 N--CA 1.477 0.897 0 N-CA-C 115.088 1.514 . . . . 0.0 115.088 -176.001 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 62.3 mtm-85 -133.23 146.84 62.64 Favored Pre-proline 0 N--CA 1.471 0.62 0 C-N-CA 125.557 1.543 . . . . 0.0 112.424 -178.098 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 77.6 Cg_endo -69.28 166.74 25.96 Favored 'Trans proline' 0 CA--C 1.543 0.963 0 C-N-CA 121.95 1.767 . . . . 0.0 109.61 171.352 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -53.9 -30.98 48.49 Favored 'General case' 0 N--CA 1.477 0.879 0 O-C-N 121.034 -1.041 . . . . 0.0 112.91 176.781 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 40.5 p -72.94 -6.52 45.79 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 125.93 1.692 . . . . 0.0 115.015 178.637 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 18.5 mt-10 -128.08 -24.17 3.2 Favored 'General case' 0 N--CA 1.477 0.907 0 N-CA-C 115.333 1.605 . . . . 0.0 115.333 -177.773 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 3.1 t -70.18 166.28 20.3 Favored 'General case' 0 CA--C 1.546 0.791 0 N-CA-C 114.979 1.474 . . . . 0.0 114.979 -176.556 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 13.2 mmmm -83.37 -11.42 57.64 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 127.057 2.143 . . . . 0.0 113.1 179.557 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 77.0 m-85 -140.43 173.79 11.16 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 126.417 1.887 . . . . 0.0 110.763 -178.125 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -80.17 152.94 28.93 Favored 'General case' 0 CA--C 1.545 0.778 0 O-C-N 121.224 -0.923 . . . . 0.0 113.224 -178.642 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 61.3 m170 -127.04 90.16 50.13 Favored Pre-proline 0 CA--C 1.552 1.039 0 C-N-CA 125.718 1.607 . . . . 0.0 110.307 179.398 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 33.9 Cg_endo -63.19 165.76 16.31 Favored 'Trans proline' 0 CA--C 1.541 0.85 0 C-N-CA 123.685 2.923 . . . . 0.0 114.903 -178.223 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 85.7 p -128.1 -174.22 3.15 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 126.385 1.874 . . . . 0.0 112.687 178.928 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 61.9 pttt -38.53 -37.51 0.32 Allowed 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 128.823 2.849 . . . . 0.0 117.902 -178.216 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 33.1 p -109.19 -16.4 14.09 Favored 'General case' 0 N--CA 1.476 0.842 0 N-CA-C 115.028 1.492 . . . . 0.0 115.028 -177.898 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 80.4 m -61.21 128.3 35.73 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 124.319 1.048 . . . . 0.0 113.33 -177.764 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 44.6 tt0 -81.71 128.96 34.53 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 125.329 1.452 . . . . 0.0 110.008 178.105 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 17.6 t -122.42 134.07 66.74 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.918 0 C-N-CA 125.489 1.515 . . . . 0.0 109.663 -178.226 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -142.92 130.83 21.64 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 125.142 1.377 . . . . 0.0 110.703 -179.576 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 46.1 36.14 2.95 Favored 'General case' 0 CA--C 1.555 1.148 0 C-N-CA 126.177 1.791 . . . . 0.0 115.169 179.47 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 80.54 19.41 68.62 Favored Glycine 0 CA--C 1.537 1.429 0 O-C-N 120.969 -1.082 . . . . 0.0 114.66 -179.592 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 45.3 mtt180 -137.14 161.25 36.66 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 125.901 1.68 . . . . 0.0 111.179 -179.292 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 3.0 m -138.17 137.75 43.96 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.512 0 C-N-CA 127.143 2.177 . . . . 0.0 109.647 -176.877 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 75.8 mt -87.67 131.04 36.37 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.743 0 O-C-N 121.083 -1.011 . . . . 0.0 109.294 179.273 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -73.84 149.27 41.71 Favored 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 123.91 0.884 . . . . 0.0 111.926 177.694 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 8.0 t -67.38 95.64 0.46 Allowed 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 125.19 1.396 . . . . 0.0 111.681 -177.909 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 22.2 p90 -58.16 -36.63 73.3 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 123.673 0.789 . . . . 0.0 111.176 177.817 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 73.1 m-20 -61.02 -34.89 75.55 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 123.099 0.56 . . . . 0.0 111.863 177.137 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 25.3 p -68.51 -41.61 79.74 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-N 119.019 0.827 . . . . 0.0 111.666 177.4 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 38.5 mt -71.5 -40.24 70.32 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 125.183 1.393 . . . . 0.0 113.187 178.165 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 58' ' ' LYS . . . . . 0.428 ' HE2' ' HA ' ' A' ' 58' ' ' LYS . 11.3 mmpt? -83.46 -10.23 58.5 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 124.794 1.238 . . . . 0.0 114.122 -179.21 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 82.02 39.19 11.88 Favored Glycine 0 CA--C 1.536 1.396 0 C-N-CA 124.319 0.961 . . . . 0.0 114.725 177.773 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 6.9 tpm_? -124.41 -9.78 7.47 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 126.186 1.794 . . . . 0.0 113.863 -178.272 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 CA--C 1.544 0.712 0 CA-C-N 119.22 0.918 . . . . 0.0 112.544 -177.349 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 38.9 m . . . . . 0 CA--C 1.54 0.592 0 N-CA-C 113.696 0.998 . . . . 0.0 113.696 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 24.6 mtmt -88.81 7.79 32.29 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 123.817 0.847 . . . . 0.0 111.682 173.375 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 63.7 m-85 -127.14 148.72 50.16 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 125.818 1.647 . . . . 0.0 111.641 -172.488 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -74.17 117.19 15.69 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 124.168 0.987 . . . . 0.0 113.06 -175.951 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 6.3 m170 -65.21 129.96 94.62 Favored Pre-proline 0 CA--C 1.547 0.835 0 N-CA-C 106.612 -1.625 . . . . 0.0 106.612 170.776 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 83.3 Cg_endo -72.11 120.6 6.91 Favored 'Trans proline' 0 CA--C 1.545 1.057 0 C-N-CA 122.562 2.175 . . . . 0.0 113.142 -172.338 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -75.66 150.85 35.92 Favored 'Trans proline' 0 CA--C 1.541 0.87 0 C-N-CA 122.884 2.39 . . . . 0.0 111.063 178.021 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 84.9 Cg_exo -47.23 -39.01 26.64 Favored 'Trans proline' 0 CA--C 1.537 0.668 0 C-N-CA 123.863 3.042 . . . . 0.0 115.257 179.592 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 7.5 t-80 -69.36 -17.72 63.72 Favored 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 115.057 1.503 . . . . 0.0 115.057 179.452 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 93.4 mt -114.55 -15.61 11.99 Favored 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 124.854 1.262 . . . . 0.0 112.953 178.224 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 57.0 mtpt -54.89 -35.4 64.07 Favored 'General case' 0 N--CA 1.477 0.876 0 CA-C-N 119.736 1.153 . . . . 0.0 111.149 173.591 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 15.3 m -63.3 -41.23 98.94 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 123.902 0.881 . . . . 0.0 111.699 175.917 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 91.0 mm-40 -70.4 -44.44 67.98 Favored 'General case' 0 N--CA 1.468 0.452 0 O-C-N 121.268 -0.895 . . . . 0.0 111.05 177.281 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 95.5 mt -62.5 -40.48 96.86 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 123.748 0.819 . . . . 0.0 111.529 177.629 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 8.2 mm-40 -52.02 -56.12 16.28 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 124.884 1.274 . . . . 0.0 110.639 174.331 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 72.9 mt -68.79 -45.66 80.62 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.25 0 C-N-CA 125.798 1.639 . . . . 0.0 111.977 -173.781 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 38.5 m-80 -64.25 -34.64 78.57 Favored 'General case' 0 CA--C 1.542 0.645 0 CA-C-N 119.069 0.85 . . . . 0.0 111.501 175.878 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.886 0 C-N-CA 123.684 0.659 . . . . 0.0 111.663 176.738 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.542 0.662 0 N-CA-C 113.376 0.88 . . . . 0.0 113.376 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 94.7 mt -91.93 -17.52 25.06 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 126.061 1.744 . . . . 0.0 114.762 -177.32 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 17.1 m -78.49 74.7 5.02 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 124.567 1.147 . . . . 0.0 111.534 -177.717 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.5 HD21 HD13 ' A' ' 75' ' ' LEU . 10.4 tp -75.8 147.63 39.05 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 127.399 2.28 . . . . 0.0 112.039 -178.647 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 9.5 mt-10 -73.46 150.84 41.35 Favored 'General case' 0 N--CA 1.473 0.684 0 O-C-N 120.54 -1.35 . . . . 0.0 113.095 179.351 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 17.9 m -82.67 153.25 3.93 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.768 0 C-N-CA 122.833 0.453 . . . . 0.0 111.212 175.201 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 48.2 t -74.29 135.43 42.6 Favored 'General case' 0 CA--C 1.539 0.526 0 N-CA-C 109.766 -0.457 . . . . 0.0 109.766 174.911 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 5.3 mpt_? -71.99 -41.21 67.93 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 125.203 1.401 . . . . 0.0 112.856 -177.087 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 17.1 mm-40 -72.69 -33.72 66.7 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 124.414 1.086 . . . . 0.0 111.773 179.969 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 83.5 t80 -62.18 -26.62 68.44 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 124.093 0.957 . . . . 0.0 111.759 175.29 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 77.4 mm-40 -60.61 -20.92 61.96 Favored 'General case' 0 N--CA 1.478 0.926 0 N-CA-C 113.637 0.977 . . . . 0.0 113.637 176.79 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -117.06 13.72 14.85 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 125.693 1.597 . . . . 0.0 112.106 177.083 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 59.14 36.8 90.2 Favored Glycine 0 CA--C 1.533 1.203 0 C-N-CA 125.092 1.329 . . . . 0.0 114.145 -179.78 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 7.2 t -127.54 13.18 7.0 Favored 'General case' 0 N--CA 1.479 1.01 0 N-CA-C 114.48 1.289 . . . . 0.0 114.48 -175.941 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 27.9 t -62.96 137.6 58.31 Favored 'General case' 0 CA--C 1.551 1.004 0 O-C-N 121.435 -0.79 . . . . 0.0 111.749 177.283 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 32.7 m -77.46 -2.99 38.14 Favored 'General case' 0 N--CA 1.475 0.814 0 N-CA-C 115.604 1.705 . . . . 0.0 115.604 -177.501 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 87.3 mtt180 -135.25 148.23 65.49 Favored Pre-proline 0 N--CA 1.475 0.797 0 C-N-CA 125.687 1.595 . . . . 0.0 112.561 -176.825 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -68.96 166.09 27.77 Favored 'Trans proline' 0 CA--C 1.543 0.959 0 C-N-CA 122.241 1.961 . . . . 0.0 110.132 173.348 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 7.4 p-10 -53.51 -28.66 32.34 Favored 'General case' 0 N--CA 1.475 0.792 0 N-CA-C 114.18 1.178 . . . . 0.0 114.18 178.817 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 12.6 p -77.94 -8.91 58.76 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 125.809 1.644 . . . . 0.0 115.02 178.452 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 39.5 mm-40 -124.9 -19.97 5.1 Favored 'General case' 0 N--CA 1.477 0.895 0 N-CA-C 116.315 1.968 . . . . 0.0 116.315 -172.908 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 4.7 t -69.73 170.13 11.53 Favored 'General case' 0 CA--C 1.551 1.011 0 N-CA-C 114.988 1.477 . . . . 0.0 114.988 -177.05 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -89.15 -6.99 56.56 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 127.877 2.471 . . . . 0.0 113.785 -179.762 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 56.2 m-85 -140.41 169.73 17.12 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 126.23 1.812 . . . . 0.0 110.507 178.328 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -78.61 145.93 34.43 Favored 'General case' 0 CA--C 1.548 0.866 0 O-C-N 121.12 -0.987 . . . . 0.0 113.3 -176.753 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 21.4 m170 -120.38 89.23 43.56 Favored Pre-proline 0 CA--C 1.555 1.141 0 C-N-CA 126.047 1.739 . . . . 0.0 110.535 -178.386 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -67.2 173.24 8.84 Favored 'Trans proline' 0 CA--C 1.542 0.924 0 C-N-CA 123.789 2.993 . . . . 0.0 114.943 -178.651 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 73.8 p -129.28 -178.9 4.85 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 126.089 1.756 . . . . 0.0 111.234 175.212 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 29.9 mtpp -49.89 -31.73 12.86 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 126.42 1.888 . . . . 0.0 115.203 -179.884 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 17.5 m -92.76 -25.63 18.09 Favored 'General case' 0 N--CA 1.477 0.913 0 N-CA-C 114.324 1.231 . . . . 0.0 114.324 -178.619 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 59.2 m -63.16 143.06 58.12 Favored 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 114.615 1.339 . . . . 0.0 114.615 -176.793 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 22.2 mt-30 -85.04 132.33 34.34 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 124.944 1.298 . . . . 0.0 110.844 176.689 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 12.8 t -129.11 135.28 62.36 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.731 0 C-N-CA 124.919 1.288 . . . . 0.0 110.677 -178.454 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -146.31 131.88 18.79 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 125.057 1.343 . . . . 0.0 111.234 178.218 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 63.0 t30 41.98 37.71 0.89 Allowed 'General case' 0 CA--C 1.553 1.076 0 C-N-CA 126.835 2.054 . . . . 0.0 116.379 177.405 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 85.78 16.17 64.1 Favored Glycine 0 CA--C 1.536 1.386 0 O-C-N 120.944 -1.098 . . . . 0.0 114.987 -179.751 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 66.5 mtt180 -136.02 161.15 36.47 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 125.6 1.56 . . . . 0.0 111.388 -179.633 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 3.1 m -139.21 144.24 29.64 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.62 0 C-N-CA 127.433 2.293 . . . . 0.0 109.562 -176.965 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 8.7 mt -94.81 126.72 47.18 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.764 0 O-C-N 121.385 -0.822 . . . . 0.0 110.811 -176.746 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -71.15 147.53 48.27 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 124.311 1.045 . . . . 0.0 112.032 178.186 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 23.7 t -70.27 99.87 1.61 Allowed 'General case' 0 C--O 1.24 0.563 0 C-N-CA 125.06 1.344 . . . . 0.0 112.301 -177.894 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 41.0 p90 -61.68 -38.18 86.84 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 115.413 -0.812 . . . . 0.0 110.316 175.531 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 62.2 m-20 -60.72 -44.33 96.77 Favored 'General case' 0 CA--C 1.539 0.545 0 O-C-N 121.856 -0.527 . . . . 0.0 110.444 176.402 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 37.7 t -64.48 -42.91 95.59 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 119.761 1.164 . . . . 0.0 111.447 177.51 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 30.7 mt -62.13 -40.46 96.0 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 124.179 0.992 . . . . 0.0 113.049 176.625 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 31.2 mmmt -83.19 -9.46 59.15 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 124.99 1.316 . . . . 0.0 113.856 179.266 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 81.82 38.36 14.04 Favored Glycine 0 CA--C 1.536 1.402 0 C-N-CA 124.642 1.115 . . . . 0.0 114.269 179.281 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 19.7 tpp180 -120.46 -22.4 6.47 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 126.568 1.947 . . . . 0.0 114.67 -176.893 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 5.4 t . . . . . 0 CA--C 1.546 0.789 0 CA-C-N 119.277 0.944 . . . . 0.0 113.372 -177.391 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 7.0 t . . . . . 0 CA--C 1.544 0.734 0 CA-C-O 121.691 0.758 . . . . 0.0 112.276 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 32.2 mtmt -84.8 8.15 18.26 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 124.742 1.217 . . . . 0.0 114.137 -176.971 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 89.0 m-85 -128.61 157.74 40.43 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 125.696 1.598 . . . . 0.0 111.488 -177.066 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -79.5 114.02 18.11 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 124.122 0.969 . . . . 0.0 112.289 -177.015 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 10.4 m170 -68.62 119.17 66.97 Favored Pre-proline 0 CA--C 1.545 0.764 0 N-CA-C 105.7 -1.963 . . . . 0.0 105.7 170.966 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -71.46 128.86 14.99 Favored 'Trans proline' 0 CA--C 1.542 0.906 0 C-N-CA 121.865 1.71 . . . . 0.0 114.556 -169.906 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 97.6 Cg_endo -78.69 155.22 27.3 Favored 'Trans proline' 0 CA--C 1.543 0.929 0 C-N-CA 123.403 2.735 . . . . 0.0 112.116 178.751 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 82.9 Cg_exo -45.97 -39.81 19.91 Favored 'Trans proline' 0 CA--C 1.54 0.782 0 C-N-CA 124.454 3.436 . . . . 0.0 115.976 179.385 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 18.3 m-70 -71.48 -15.71 62.33 Favored 'General case' 0 N--CA 1.477 0.89 0 N-CA-C 114.965 1.468 . . . . 0.0 114.965 179.356 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.5 HD13 HD21 ' A' ' 16' ' ' LEU . 78.6 mt -115.36 -18.06 11.13 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 124.468 1.107 . . . . 0.0 113.109 -179.776 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 59.2 mtpt -54.56 -38.23 66.41 Favored 'General case' 0 N--CA 1.476 0.849 0 CA-C-N 119.661 1.119 . . . . 0.0 111.328 173.872 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 25.0 m -62.58 -42.66 99.69 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 124.115 0.966 . . . . 0.0 111.673 176.235 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 89.4 mm-40 -67.25 -44.58 79.05 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 123.739 0.815 . . . . 0.0 110.807 178.323 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 93.2 mt -62.24 -46.54 88.41 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 123.992 0.917 . . . . 0.0 112.341 178.417 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -65.14 -30.48 71.41 Favored 'General case' 0 N--CA 1.476 0.838 0 CA-C-N 120.044 1.293 . . . . 0.0 113.191 178.863 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 64.1 mt -71.73 -43.49 70.04 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.757 0 O-C-N 121.367 -0.833 . . . . 0.0 109.583 175.744 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 22.8 m-80 -64.96 -33.72 76.7 Favored 'General case' 0 CA--C 1.542 0.654 0 O-C-N 121.683 -0.636 . . . . 0.0 111.289 174.826 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.848 0 C-N-CA 124.518 1.056 . . . . 0.0 111.414 177.193 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 74.9 mtm . . . . . 0 CA--C 1.538 0.49 0 N-CA-C 113.67 0.989 . . . . 0.0 113.67 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -49.48 -22.73 1.29 Allowed 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 127.397 2.279 . . . . 0.0 116.449 -178.582 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 31.2 m -133.76 19.67 1.32 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.875 0 C-N-CA 125.841 1.656 . . . . 0.0 112.635 -178.547 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 72.7 p -149.42 -22.25 0.28 Allowed 'General case' 0 N--CA 1.477 0.883 0 N-CA-C 116.527 2.047 . . . . 0.0 116.527 -177.572 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 19.2 t -139.39 -32.15 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.236 0 CA-C-N 119.816 1.189 . . . . 0.0 113.255 -178.865 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 22.9 p -129.81 107.26 16.86 Favored Pre-proline 0 N--CA 1.478 0.949 0 C-N-CA 124.714 1.206 . . . . 0.0 111.939 -178.367 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 83.0 Cg_endo -74.36 -13.28 23.0 Favored 'Trans proline' 0 CA--C 1.539 0.762 0 C-N-CA 123.144 2.562 . . . . 0.0 114.592 -178.659 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 18.1 tt -75.41 41.67 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.554 1.128 0 C-N-CA 127.453 2.301 . . . . 0.0 112.428 178.152 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 19.0 ptt-85 -62.21 -16.32 52.51 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 126.341 1.856 . . . . 0.0 115.732 -178.905 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 1.4 p30 -150.98 172.76 15.19 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 124.965 1.306 . . . . 0.0 112.681 178.13 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 29.6 p -135.49 30.79 3.17 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 126.588 1.955 . . . . 0.0 111.613 -178.798 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 8.7 ptpp? -47.37 -32.58 5.03 Favored 'General case' 0 N--CA 1.482 1.162 0 N-CA-C 116.208 1.929 . . . . 0.0 116.208 -175.4 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -94.27 -20.72 19.54 Favored 'General case' 0 CA--C 1.541 0.624 0 N-CA-C 113.936 1.087 . . . . 0.0 113.936 -178.876 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 81.8 mt -95.06 -22.25 18.03 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 125.894 1.677 . . . . 0.0 114.344 -177.174 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 4.6 m -73.53 74.67 1.46 Allowed 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 125.035 1.334 . . . . 0.0 111.206 -179.238 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.545 HD21 HD13 ' A' ' 75' ' ' LEU . 8.5 tp -75.65 142.66 42.53 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 127.234 2.213 . . . . 0.0 111.64 -177.62 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 12.8 mt-10 -72.17 152.15 42.46 Favored 'General case' 0 N--CA 1.47 0.548 0 O-C-N 120.684 -1.26 . . . . 0.0 112.796 179.613 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 14.9 m -84.01 153.44 3.72 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.811 0 C-N-CA 122.737 0.415 . . . . 0.0 110.483 175.093 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 34.9 t -73.48 134.01 43.79 Favored 'General case' 0 CA--C 1.539 0.528 0 N-CA-C 109.724 -0.472 . . . . 0.0 109.724 175.77 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 5.7 mpt_? -68.99 -43.18 75.39 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 124.898 1.279 . . . . 0.0 112.675 -176.958 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 12.8 mm-40 -70.41 -34.49 72.58 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 124.461 1.105 . . . . 0.0 111.947 -179.549 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 78.3 t80 -61.92 -27.0 68.51 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 124.145 0.978 . . . . 0.0 111.753 175.553 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 71.7 mm-40 -61.86 -21.5 64.72 Favored 'General case' 0 N--CA 1.478 0.93 0 N-CA-C 113.734 1.013 . . . . 0.0 113.734 177.185 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -118.62 13.66 13.41 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 125.521 1.528 . . . . 0.0 112.054 177.375 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 59.83 37.11 92.03 Favored Glycine 0 CA--C 1.533 1.165 0 C-N-CA 124.821 1.2 . . . . 0.0 113.933 -179.207 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 6.1 t -124.93 16.26 8.57 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 124.563 1.145 . . . . 0.0 113.66 -176.446 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 12.4 t -66.0 169.96 6.15 Favored 'General case' 0 CA--C 1.558 1.26 0 C-N-CA 124.245 1.018 . . . . 0.0 111.048 173.978 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 94.5 p -128.82 4.01 5.42 Favored 'General case' 0 N--CA 1.477 0.918 0 N-CA-C 115.673 1.731 . . . . 0.0 115.673 -175.646 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 53.1 mtt-85 -133.39 147.29 64.26 Favored Pre-proline 0 N--CA 1.474 0.744 0 C-N-CA 126.12 1.768 . . . . 0.0 111.027 179.403 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 93.5 Cg_endo -72.64 167.73 26.35 Favored 'Trans proline' 0 CA--C 1.541 0.836 0 C-N-CA 122.251 1.968 . . . . 0.0 109.929 175.42 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -53.91 -30.12 44.89 Favored 'General case' 0 N--CA 1.474 0.766 0 O-C-N 121.32 -0.863 . . . . 0.0 112.936 176.329 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 28.1 p -73.95 -10.21 59.41 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 125.536 1.534 . . . . 0.0 115.059 178.427 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -135.25 -13.4 2.08 Favored 'General case' 0 N--CA 1.478 0.952 0 N-CA-C 116.818 2.155 . . . . 0.0 116.818 -176.132 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 5.1 t -70.62 162.3 29.18 Favored 'General case' 0 CA--C 1.552 1.024 0 CA-C-N 120.553 1.524 . . . . 0.0 113.709 -178.969 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -77.01 -12.19 59.9 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 126.78 2.032 . . . . 0.0 114.106 -179.814 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 62.0 m-85 -137.92 172.87 12.3 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 126.191 1.797 . . . . 0.0 110.571 179.287 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -80.67 149.94 29.58 Favored 'General case' 0 CA--C 1.549 0.915 0 O-C-N 121.147 -0.97 . . . . 0.0 113.097 -177.311 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 65.3 m170 -124.81 89.9 51.78 Favored Pre-proline 0 CA--C 1.552 1.021 0 C-N-CA 125.828 1.651 . . . . 0.0 111.243 -179.097 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 31.1 Cg_endo -62.08 143.05 94.38 Favored 'Trans proline' 0 CA--C 1.542 0.907 0 C-N-CA 123.11 2.54 . . . . 0.0 112.729 179.542 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 45.8 p -80.13 -84.94 0.09 Allowed 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 124.799 1.24 . . . . 0.0 113.678 -178.732 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 35.7 mtmm -144.49 -55.87 0.35 Allowed 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 126.979 2.112 . . . . 0.0 111.579 -179.054 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 35.3 m -76.27 -17.95 59.22 Favored 'General case' 0 N--CA 1.477 0.914 0 N-CA-C 113.234 0.828 . . . . 0.0 113.234 178.184 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 73.9 m -57.34 124.19 18.02 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 124.801 1.24 . . . . 0.0 112.341 179.942 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 56.8 tt0 -87.67 134.85 33.58 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 124.869 1.267 . . . . 0.0 110.566 179.169 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 1.6 m -124.3 148.32 28.57 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.599 0 C-N-CA 125.315 1.446 . . . . 0.0 110.937 179.85 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 70.9 mm-40 -141.32 133.57 28.02 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 125.302 1.441 . . . . 0.0 110.152 179.312 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 63.1 t30 44.23 35.8 1.36 Allowed 'General case' 0 CA--C 1.555 1.144 0 N-CA-C 116.002 1.853 . . . . 0.0 116.002 177.963 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 83.9 20.14 60.06 Favored Glycine 0 CA--C 1.538 1.512 0 O-C-N 120.914 -1.116 . . . . 0.0 114.823 -179.246 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 43.1 mtt180 -139.34 163.46 32.43 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 125.703 1.601 . . . . 0.0 111.843 -178.69 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 2.9 m -137.29 135.13 47.27 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.692 0 C-N-CA 126.942 2.097 . . . . 0.0 110.276 -177.719 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 78.4 mt -83.9 125.85 40.18 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.546 0 O-C-N 121.541 -0.724 . . . . 0.0 109.855 -179.202 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -70.72 143.66 51.21 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 123.8 0.84 . . . . 0.0 110.447 176.358 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 17.2 t -65.08 98.86 0.32 Allowed 'General case' 0 C--O 1.239 0.536 0 C-N-CA 124.494 1.117 . . . . 0.0 113.091 -176.921 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 33.4 p90 -62.37 -37.36 85.42 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 115.188 -0.915 . . . . 0.0 109.971 175.391 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 70.7 m-20 -61.46 -43.61 98.56 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 118.522 0.601 . . . . 0.0 110.394 176.339 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 40.2 t -64.88 -43.32 93.3 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 119.773 1.169 . . . . 0.0 111.488 177.336 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 25.8 mt -64.64 -42.73 95.26 Favored 'General case' 0 CA--C 1.543 0.699 0 N-CA-C 113.555 0.946 . . . . 0.0 113.555 177.246 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 31.0 mmmt -80.59 -18.63 47.68 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 124.713 1.205 . . . . 0.0 113.836 -179.427 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 96.21 41.32 3.76 Favored Glycine 0 CA--C 1.537 1.454 0 C-N-CA 124.582 1.087 . . . . 0.0 114.943 177.911 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 50.5 tpt85 -126.75 -22.3 3.91 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 126.247 1.819 . . . . 0.0 115.213 -177.343 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 5.0 t -65.13 141.9 58.54 Favored 'General case' 0 CA--C 1.545 0.775 0 CA-C-N 119.997 1.271 . . . . 0.0 113.714 -175.737 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 80.4 p -152.65 8.83 0.45 Allowed 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 126.798 2.039 . . . . 0.0 113.177 -179.892 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 77.7 mtm-85 -69.93 162.99 26.98 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 126.2 1.8 . . . . 0.0 113.861 -178.641 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -119.39 -1.77 10.7 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 125.845 1.658 . . . . 0.0 112.312 176.181 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 16.3 m120 -143.35 36.75 1.35 Allowed 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 128.058 2.543 . . . . 0.0 109.973 179.305 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 9.1 t -52.54 126.54 19.86 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 125.217 1.407 . . . . 0.0 111.409 -178.442 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 23.6 mtmt -82.43 1.03 39.43 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 123.922 0.889 . . . . 0.0 113.242 -178.645 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 76.4 m-85 -120.37 150.01 41.43 Favored 'General case' 0 C--N 1.326 -0.429 0 C-N-CA 124.581 1.152 . . . . 0.0 111.611 -174.413 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -75.09 111.66 10.54 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 123.411 0.685 . . . . 0.0 111.99 -176.323 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 11.5 m170 -65.26 119.83 62.49 Favored Pre-proline 0 CA--C 1.545 0.787 0 N-CA-C 105.212 -2.144 . . . . 0.0 105.212 171.413 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -69.06 125.18 12.18 Favored 'Trans proline' 0 CA--C 1.543 0.94 0 C-N-CA 122.028 1.819 . . . . 0.0 114.528 -169.803 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 90.3 Cg_endo -78.02 154.87 29.7 Favored 'Trans proline' 0 CA--C 1.542 0.882 0 C-N-CA 123.403 2.735 . . . . 0.0 111.734 178.851 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 81.2 Cg_exo -47.47 -41.74 29.09 Favored 'Trans proline' 0 CA--C 1.538 0.723 0 C-N-CA 123.905 3.07 . . . . 0.0 115.176 179.287 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 6.4 t60 -65.35 -22.82 66.86 Favored 'General case' 0 N--CA 1.476 0.843 0 N-CA-C 114.437 1.273 . . . . 0.0 114.437 179.267 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.545 HD13 HD21 ' A' ' 16' ' ' LEU . 67.7 mt -111.11 -17.89 13.13 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 124.332 1.053 . . . . 0.0 113.027 -179.608 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 25.5 mtpp -55.96 -38.55 70.51 Favored 'General case' 0 N--CA 1.475 0.816 0 CA-C-N 120.144 1.338 . . . . 0.0 110.882 173.678 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 24.0 m -59.27 -43.3 92.51 Favored 'General case' 0 N--CA 1.474 0.734 0 CA-C-N 118.621 0.646 . . . . 0.0 110.933 176.62 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 17.4 mm100 -67.71 -47.88 68.1 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 123.537 0.735 . . . . 0.0 111.101 177.647 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 88.4 mt -60.76 -40.82 93.93 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 124.168 0.987 . . . . 0.0 112.618 178.462 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -55.34 -52.75 62.49 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 124.416 1.087 . . . . 0.0 110.6 175.226 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 73.3 mt -69.61 -37.94 75.45 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.436 0 C-N-CA 125.81 1.644 . . . . 0.0 111.386 -176.27 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 93.1 m-20 -63.82 -40.64 97.09 Favored 'General case' 0 CA--C 1.543 0.675 0 O-C-N 121.586 -0.696 . . . . 0.0 110.372 173.87 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -67.27 -48.68 57.28 Favored Glycine 0 CA--C 1.529 0.918 0 C-N-CA 124.139 0.876 . . . . 0.0 111.679 177.657 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 71.5 mtp180 -54.8 -31.56 59.16 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 124.709 1.204 . . . . 0.0 112.716 176.517 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 54.7 t30 -70.08 -9.18 54.59 Favored 'General case' 0 CA--C 1.552 1.045 0 N-CA-C 114.085 1.143 . . . . 0.0 114.085 176.891 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 11.1 t-20 -130.73 -34.73 1.5 Allowed 'General case' 0 CA--C 1.543 0.686 0 N-CA-C 114.628 1.344 . . . . 0.0 114.628 -179.331 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 8.2 mp -57.91 -22.15 47.06 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 124.534 1.134 . . . . 0.0 113.567 178.339 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 32.1 pt -66.17 -9.23 8.25 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 C-N-CA 126.481 1.912 . . . . 0.0 114.451 176.534 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 37.0 tt0 -141.17 133.29 27.87 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 124.546 1.139 . . . . 0.0 111.725 -179.422 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -154.27 152.67 30.57 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 125.395 1.478 . . . . 0.0 110.578 178.921 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 55.7 tptt -137.11 -22.34 1.18 Allowed 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 125.764 1.625 . . . . 0.0 113.754 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 34.0 t-20 . . . . . 0 CA--C 1.542 0.657 0 C-N-CA 124.985 1.314 . . . . 0.0 111.109 179.423 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.5 ptt? . . . . . 0 CA--C 1.544 0.748 0 N-CA-C 114.068 1.136 . . . . 0.0 114.068 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -151.37 166.64 30.38 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 125.921 1.689 . . . . 0.0 111.929 -179.996 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 35.8 m -128.75 -0.3 3.12 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.245 0 C-N-CA 125.194 1.398 . . . . 0.0 114.033 -179.475 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 11.8 t -155.82 163.48 39.76 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 125.718 1.607 . . . . 0.0 110.95 178.29 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 8.8 p -154.08 -23.52 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.48 1.047 0 C-N-CA 124.987 1.315 . . . . 0.0 113.926 -179.687 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 36.4 p -66.41 149.08 98.3 Favored Pre-proline 0 N--CA 1.476 0.831 0 N-CA-C 113.984 1.105 . . . . 0.0 113.984 -179.003 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 64.3 Cg_endo -75.94 -177.46 3.65 Favored 'Trans proline' 0 CA--C 1.546 1.114 0 C-N-CA 123.554 2.836 . . . . 0.0 110.774 174.314 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 9.6 tp -57.32 152.81 2.7 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.861 0 C-N-CA 124.387 1.075 . . . . 0.0 111.635 176.171 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 1.9 mpt_? -126.32 151.5 47.46 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 124.786 1.234 . . . . 0.0 112.386 -178.418 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -80.71 -7.62 59.4 Favored 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 124.813 1.245 . . . . 0.0 112.853 176.92 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 44.8 p -67.62 8.92 0.3 Allowed 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 127.774 2.43 . . . . 0.0 115.662 -179.155 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 38.1 ttpt -46.32 -42.7 15.07 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 125.695 1.598 . . . . 0.0 114.157 -179.175 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -77.22 -21.67 53.48 Favored 'General case' 0 N--CA 1.474 0.734 0 N-CA-C 113.865 1.061 . . . . 0.0 113.865 179.011 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 78.3 mt -95.53 -18.69 20.42 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 126.489 1.916 . . . . 0.0 114.199 -178.328 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 7.2 m -78.41 79.4 4.85 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 125.082 1.353 . . . . 0.0 110.762 -178.138 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -76.55 144.4 39.71 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 128.196 2.598 . . . . 0.0 111.075 -177.569 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 9.2 mt-10 -73.74 150.83 40.89 Favored 'General case' 0 N--CA 1.472 0.665 0 O-C-N 120.788 -1.195 . . . . 0.0 111.659 175.789 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 16.3 m -81.14 149.05 5.09 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.783 0 N-CA-C 109.404 -0.591 . . . . 0.0 109.404 173.568 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 42.4 t -63.9 126.86 29.02 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-O 121.98 0.895 . . . . 0.0 111.244 179.08 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 3.3 mpt_? -63.7 -26.02 68.47 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 124.743 1.217 . . . . 0.0 113.151 -177.317 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 13.9 mm-40 -82.8 -37.77 24.04 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-O 121.136 0.493 . . . . 0.0 109.785 177.017 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 61.2 t80 -62.67 -30.37 71.33 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 124.759 1.224 . . . . 0.0 111.076 174.677 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 79.5 mt-30 -59.48 -21.41 60.07 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.667 0.787 . . . . 0.0 112.869 175.088 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 3.5 mpt_? -118.33 14.47 13.82 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 126.171 1.788 . . . . 0.0 111.842 178.009 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 58.48 36.38 84.29 Favored Glycine 0 CA--C 1.534 1.251 0 C-N-CA 125.225 1.393 . . . . 0.0 114.194 -179.992 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 6.7 t -128.49 16.63 6.5 Favored 'General case' 0 N--CA 1.476 0.87 0 N-CA-C 114.727 1.38 . . . . 0.0 114.727 -175.85 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 10.2 t -68.06 172.05 6.12 Favored 'General case' 0 CA--C 1.559 1.289 0 O-C-N 121.542 -0.724 . . . . 0.0 110.487 173.104 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 51.1 m -133.98 11.88 3.95 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 125.332 1.453 . . . . 0.0 114.764 -176.114 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 70.2 mtm-85 -134.85 146.38 58.56 Favored Pre-proline 0 N--CA 1.476 0.843 0 C-N-CA 125.281 1.433 . . . . 0.0 112.625 -176.906 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -68.68 166.15 27.04 Favored 'Trans proline' 0 CA--C 1.542 0.885 0 C-N-CA 122.154 1.903 . . . . 0.0 109.96 172.457 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 -54.24 -27.75 36.8 Favored 'General case' 0 N--CA 1.474 0.764 0 N-CA-C 113.725 1.009 . . . . 0.0 113.725 177.762 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 11.7 p -76.82 -11.88 59.89 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 125.491 1.516 . . . . 0.0 114.953 178.588 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 51.2 mm-40 -119.59 -27.26 5.55 Favored 'General case' 0 N--CA 1.476 0.869 0 N-CA-C 116.063 1.875 . . . . 0.0 116.063 -174.468 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 3.3 t -67.93 163.77 21.34 Favored 'General case' 0 CA--C 1.548 0.872 0 N-CA-C 115.773 1.768 . . . . 0.0 115.773 -175.033 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.61 -11.94 59.99 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 127.881 2.472 . . . . 0.0 112.659 -179.989 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 75.6 m-85 -143.07 172.99 11.96 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 126.711 2.004 . . . . 0.0 110.138 179.957 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -79.32 152.56 30.41 Favored 'General case' 0 CA--C 1.547 0.848 0 N-CA-C 114.291 1.219 . . . . 0.0 114.291 -177.787 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 63.3 m170 -126.43 89.6 51.84 Favored Pre-proline 0 CA--C 1.551 0.99 0 C-N-CA 126.138 1.775 . . . . 0.0 109.637 178.21 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 33.6 Cg_endo -63.48 148.08 92.8 Favored 'Trans proline' 0 CA--C 1.539 0.775 0 C-N-CA 123.052 2.501 . . . . 0.0 114.648 -177.367 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 58.2 p -87.29 -173.47 4.41 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 125.445 1.498 . . . . 0.0 112.245 176.061 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 67.9 mttm -62.42 -19.38 63.41 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 125.704 1.602 . . . . 0.0 113.478 173.828 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 61.1 p -109.11 -24.04 11.36 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 125.062 1.345 . . . . 0.0 114.326 -179.965 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 82.6 m -60.98 129.13 39.85 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-N 119.329 0.968 . . . . 0.0 112.902 179.839 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 67.1 tp60 -81.41 135.1 35.64 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 124.171 0.988 . . . . 0.0 110.411 177.628 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 15.0 t -117.48 144.68 24.73 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.819 0 C-N-CA 125.693 1.597 . . . . 0.0 109.299 -179.823 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 50.3 mt-10 -146.16 124.43 12.26 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 125.698 1.599 . . . . 0.0 110.404 179.5 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 62.9 t30 43.64 36.94 1.35 Allowed 'General case' 0 CA--C 1.554 1.133 0 N-CA-C 116.357 1.984 . . . . 0.0 116.357 178.043 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 86.49 16.96 61.17 Favored Glycine 0 CA--C 1.537 1.457 0 O-C-N 120.929 -1.107 . . . . 0.0 114.875 -179.873 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 62.8 mtt180 -138.24 163.73 31.01 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 126.373 1.869 . . . . 0.0 110.807 -179.536 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 5.1 m -139.63 144.2 29.12 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.506 0 C-N-CA 126.994 2.118 . . . . 0.0 109.323 -177.918 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 60.4 mt -94.06 132.82 37.1 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.729 0 O-C-N 121.146 -0.971 . . . . 0.0 110.112 -177.925 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -74.43 148.99 40.64 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 124.156 0.982 . . . . 0.0 112.465 178.344 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 7.8 t -69.2 95.72 0.78 Allowed 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 125.025 1.33 . . . . 0.0 109.981 179.531 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 27.2 p90 -58.01 -36.32 72.51 Favored 'General case' 0 N--CA 1.467 0.385 0 C-N-CA 123.439 0.695 . . . . 0.0 111.417 179.373 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 74.5 m-20 -58.5 -36.23 73.46 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.439 0.696 . . . . 0.0 111.447 177.144 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 47.7 t -70.87 -38.22 73.09 Favored 'General case' 0 CA--C 1.54 0.583 0 O-C-N 121.149 -0.969 . . . . 0.0 111.642 178.251 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 50.0 mt -69.26 -42.66 75.29 Favored 'General case' 0 N--CA 1.474 0.732 0 O-C-N 121.316 -0.865 . . . . 0.0 112.352 175.205 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 31.3 mmmt -75.56 -9.94 59.02 Favored 'General case' 0 N--CA 1.478 0.925 0 C-N-CA 125.038 1.335 . . . . 0.0 113.844 -179.992 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 78.44 37.06 28.55 Favored Glycine 0 CA--C 1.536 1.346 0 C-N-CA 124.414 1.007 . . . . 0.0 113.82 179.519 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 51.1 ttp180 -119.86 -22.55 6.74 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 126.852 2.061 . . . . 0.0 114.256 -177.016 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 3.7 t -68.38 140.49 55.84 Favored 'General case' 0 CA--C 1.545 0.771 0 CA-C-O 122.245 1.021 . . . . 0.0 113.604 -177.639 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 82.0 p -150.1 9.21 0.66 Allowed 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 128.088 2.555 . . . . 0.0 111.526 177.131 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 27.8 ttm105 -76.57 164.66 25.71 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 128.732 2.813 . . . . 0.0 111.892 -178.833 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -133.04 10.63 4.21 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 124.736 1.215 . . . . 0.0 113.36 -179.632 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 37.4 p-10 -144.38 30.09 1.26 Allowed 'General case' 0 CA--C 1.549 0.906 0 C-N-CA 125.579 1.551 . . . . 0.0 113.483 -178.463 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 86.2 m -49.88 143.67 7.42 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 124.842 1.257 . . . . 0.0 113.684 -179.246 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 43.0 mtmt -93.42 9.15 37.67 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 124.698 1.199 . . . . 0.0 111.16 173.188 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 70.1 m-85 -129.91 149.27 51.71 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 126.797 2.039 . . . . 0.0 111.351 -173.602 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -74.74 117.1 16.19 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 124.312 1.045 . . . . 0.0 112.901 -176.046 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 1.8 m-70 -67.67 121.58 79.91 Favored Pre-proline 0 CA--C 1.544 0.726 0 CA-C-O 118.194 -0.908 . . . . 0.0 108.829 173.994 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 67.6 Cg_exo -45.68 107.7 0.12 Allowed 'Trans proline' 0 CA--C 1.543 0.969 0 C-N-CA 124.894 3.729 . . . . 0.0 115.392 -178.649 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 98.4 Cg_endo -76.34 155.25 36.79 Favored 'Trans proline' 0 CA--C 1.541 0.857 0 C-N-CA 121.515 1.476 . . . . 0.0 110.606 176.362 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_endo -56.19 -29.68 76.57 Favored 'Trans proline' 0 CA--C 1.54 0.816 0 C-N-CA 123.169 2.579 . . . . 0.0 114.839 -177.664 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 11.8 m-70 -80.15 -14.44 58.47 Favored 'General case' 0 N--CA 1.476 0.853 0 N-CA-C 114.598 1.333 . . . . 0.0 114.598 177.238 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 73.6 mt -116.18 -15.84 11.04 Favored 'General case' 0 N--CA 1.476 0.833 0 CA-C-N 119.394 0.997 . . . . 0.0 113.353 179.63 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 67.2 mttt -52.5 -37.43 57.37 Favored 'General case' 0 N--CA 1.476 0.873 0 CA-C-N 119.76 1.163 . . . . 0.0 111.186 173.273 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 19.4 m -63.37 -44.25 95.29 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 123.722 0.809 . . . . 0.0 111.21 176.431 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 18.5 mm100 -67.93 -42.93 80.28 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 124.067 0.947 . . . . 0.0 111.546 178.636 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 80.5 mt -61.47 -47.59 84.96 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 123.846 0.858 . . . . 0.0 110.996 177.284 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 3.8 pt-20 -64.54 -37.2 86.74 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 119.651 1.114 . . . . 0.0 112.232 177.615 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 60.7 mt -62.9 -46.66 95.78 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.691 0 CA-C-N 119.395 0.998 . . . . 0.0 110.051 177.216 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 16.1 t-20 -63.35 -41.01 98.83 Favored 'General case' 0 CA--C 1.545 0.767 0 CA-C-N 118.598 0.635 . . . . 0.0 111.091 177.585 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -62.7 -48.51 80.79 Favored Glycine 0 CA--C 1.534 1.258 0 O-C-N 121.421 -0.799 . . . . 0.0 111.924 176.942 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 61.0 mtp180 -58.69 -43.71 90.05 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 125.281 1.432 . . . . 0.0 111.069 176.352 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 57.2 t30 -61.54 -5.15 1.64 Allowed 'General case' 0 CA--C 1.552 1.052 0 C-N-CA 125.572 1.549 . . . . 0.0 114.15 175.65 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 62.2 m-80 -125.24 10.9 8.09 Favored 'General case' 0 CA--C 1.552 1.057 0 C-N-CA 126.517 1.927 . . . . 0.0 112.013 177.176 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 49.1 tp -122.56 -22.35 5.45 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 126.944 2.098 . . . . 0.0 112.315 179.069 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 3.1 pt -37.62 100.79 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.478 0.957 0 C-N-CA 129.032 2.933 . . . . 0.0 114.204 176.218 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 85.4 mt-30 -63.3 -16.03 59.09 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 124.888 1.275 . . . . 0.0 113.447 179.316 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 23.5 mp0 -56.81 -27.04 59.31 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 125.937 1.695 . . . . 0.0 112.652 177.5 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 59.6 mtpt -70.51 -19.84 62.88 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 124.825 1.25 . . . . 0.0 113.36 176.807 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 35.0 p30 . . . . . 0 CA--C 1.54 0.593 0 C-N-CA 125.849 1.66 . . . . 0.0 111.211 -179.815 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.1 ptp . . . . . 0 CA--C 1.545 0.751 0 N-CA-C 114.058 1.132 . . . . 0.0 114.058 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -148.72 166.1 29.4 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 125.768 1.627 . . . . 0.0 112.177 -179.872 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 29.9 m -140.34 165.87 20.42 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.027 0 C-N-CA 126.163 1.785 . . . . 0.0 111.467 179.669 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 63.2 m -138.92 160.45 39.72 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 125.273 1.429 . . . . 0.0 112.047 -179.445 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 40.3 t -64.08 145.1 14.05 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.976 0 C-N-CA 124.835 1.254 . . . . 0.0 110.896 178.841 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 11.8 p -62.18 154.38 70.51 Favored Pre-proline 0 N--CA 1.477 0.893 0 C-N-CA 125.274 1.43 . . . . 0.0 113.246 178.572 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 69.4 Cg_endo -68.43 159.76 52.04 Favored 'Trans proline' 0 CA--C 1.542 0.913 0 C-N-CA 123.103 2.536 . . . . 0.0 113.013 179.904 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 45.7 pt -135.51 22.71 0.98 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.143 0 C-N-CA 125.954 1.702 . . . . 0.0 112.712 -178.736 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 85.8 mmt-85 -135.68 34.34 2.93 Favored 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 126.35 1.86 . . . . 0.0 112.28 -177.645 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -52.64 -27.61 17.89 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 125.638 1.575 . . . . 0.0 114.15 -179.187 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 26.7 p -65.09 -3.72 4.02 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 125.482 1.513 . . . . 0.0 114.809 177.436 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 76.1 tttt -43.76 -46.51 7.68 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 126.838 2.055 . . . . 0.0 113.357 176.256 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -79.32 -20.43 47.93 Favored 'General case' 0 N--CA 1.474 0.771 0 N-CA-C 114.224 1.194 . . . . 0.0 114.224 -179.331 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 96.2 mt -91.3 -9.93 43.22 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 127.233 2.213 . . . . 0.0 114.954 -176.542 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 7.5 m -78.28 79.18 4.73 Favored 'General case' 0 N--CA 1.475 0.818 0 CA-C-O 122.336 1.065 . . . . 0.0 110.705 -179.175 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.407 HD21 HD13 ' A' ' 75' ' ' LEU . 12.4 tp -75.79 142.0 42.4 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 128.81 2.844 . . . . 0.0 112.023 -177.6 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -70.29 150.17 46.64 Favored 'General case' 0 N--CA 1.475 0.786 0 O-C-N 120.46 -1.4 . . . . 0.0 112.137 177.083 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 27.2 m -84.86 151.97 3.72 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.88 0 N-CA-C 109.676 -0.49 . . . . 0.0 109.676 172.104 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 51.3 t -67.54 125.78 27.25 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-O 121.804 0.812 . . . . 0.0 111.434 178.209 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 3.0 mpt_? -63.91 -26.21 68.49 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 124.763 1.225 . . . . 0.0 112.954 -178.158 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 11.1 mm-40 -81.79 -38.4 25.64 Favored 'General case' 0 CA--C 1.538 0.492 0 N-CA-C 109.662 -0.496 . . . . 0.0 109.662 176.877 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 59.7 t80 -63.84 -33.41 75.62 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 124.782 1.233 . . . . 0.0 110.969 175.093 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 84.7 mt-30 -59.31 -24.07 62.99 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 123.701 0.801 . . . . 0.0 112.396 174.277 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 72.9 mtt85 -114.95 12.49 16.81 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 126.453 1.901 . . . . 0.0 112.582 -175.582 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 58.19 34.95 75.51 Favored Glycine 0 CA--C 1.534 1.231 0 C-N-CA 125.256 1.407 . . . . 0.0 113.927 -179.828 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 6.7 t -131.89 14.67 4.8 Favored 'General case' 0 N--CA 1.474 0.762 0 N-CA-C 114.942 1.46 . . . . 0.0 114.942 -175.169 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 8.8 t -67.69 172.54 5.12 Favored 'General case' 0 CA--C 1.557 1.214 0 O-C-N 121.366 -0.834 . . . . 0.0 110.689 173.822 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 89.9 p -140.48 10.69 2.29 Favored 'General case' 0 N--CA 1.477 0.905 0 N-CA-C 115.349 1.611 . . . . 0.0 115.349 -176.309 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 59.0 mtm-85 -131.72 147.08 64.58 Favored Pre-proline 0 N--CA 1.474 0.731 0 C-N-CA 125.522 1.529 . . . . 0.0 112.405 -178.074 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -68.52 165.96 27.39 Favored 'Trans proline' 0 CA--C 1.542 0.889 0 C-N-CA 121.943 1.762 . . . . 0.0 109.633 171.82 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 7.1 p-10 -53.31 -31.8 45.8 Favored 'General case' 0 N--CA 1.473 0.724 0 O-C-N 121.268 -0.895 . . . . 0.0 113.244 177.826 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 22.7 p -72.76 -9.36 58.56 Favored 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 115.136 1.532 . . . . 0.0 115.136 178.468 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 19.8 mt-10 -122.47 -25.41 4.77 Favored 'General case' 0 N--CA 1.477 0.882 0 N-CA-C 115.9 1.815 . . . . 0.0 115.9 -176.421 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 3.0 t -69.68 164.02 24.37 Favored 'General case' 0 CA--C 1.547 0.829 0 N-CA-C 115.195 1.554 . . . . 0.0 115.195 -176.614 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -79.51 -11.14 59.9 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 127.186 2.194 . . . . 0.0 113.764 -179.495 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 65.9 m-85 -141.67 175.55 9.61 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 126.393 1.877 . . . . 0.0 110.673 -179.446 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -79.58 149.97 31.21 Favored 'General case' 0 CA--C 1.547 0.85 0 O-C-N 120.986 -1.071 . . . . 0.0 113.253 -178.078 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 65.2 m170 -123.88 91.99 49.0 Favored Pre-proline 0 CA--C 1.55 0.962 0 C-N-CA 125.785 1.634 . . . . 0.0 110.412 178.859 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_endo -63.0 162.3 26.41 Favored 'Trans proline' 0 CA--C 1.54 0.81 0 C-N-CA 123.356 2.704 . . . . 0.0 114.155 -179.224 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 84.6 p -131.6 -172.26 2.81 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 125.858 1.663 . . . . 0.0 112.531 178.84 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 60.4 pttt -27.14 -48.84 0.04 OUTLIER 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 129.345 3.058 . . . . 0.0 118.425 -175.997 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 5.5 p -109.66 -12.11 14.68 Favored 'General case' 0 N--CA 1.475 0.806 0 N-CA-C 115.697 1.74 . . . . 0.0 115.697 -176.286 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 66.7 m -57.9 128.63 38.04 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 124.546 1.138 . . . . 0.0 113.977 -176.835 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 44.4 tt0 -81.0 125.72 30.5 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 125.575 1.55 . . . . 0.0 110.215 178.333 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 23.2 t -119.67 133.43 66.47 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.976 0 C-N-CA 125.861 1.665 . . . . 0.0 109.608 -178.222 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -144.74 131.39 19.99 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 124.859 1.264 . . . . 0.0 111.504 -179.205 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 62.6 t30 41.41 38.01 0.76 Allowed 'General case' 0 CA--C 1.552 1.043 0 C-N-CA 127.277 2.231 . . . . 0.0 116.714 177.475 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 88.25 15.41 60.63 Favored Glycine 0 CA--C 1.535 1.324 0 O-C-N 120.979 -1.076 . . . . 0.0 114.975 179.536 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 31.6 mtt180 -139.43 168.3 20.13 Favored 'General case' 0 N--CA 1.467 0.4 0 C-N-CA 126.209 1.804 . . . . 0.0 112.185 -179.355 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 2.2 m -141.31 140.31 31.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 C-N-CA 127.737 2.415 . . . . 0.0 108.79 -178.914 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 47.2 mt -89.23 126.19 42.23 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.608 0 O-C-N 121.098 -1.001 . . . . 0.0 109.727 -179.336 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -71.66 146.83 48.02 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 124.071 0.948 . . . . 0.0 111.436 177.303 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 14.7 t -69.1 99.1 1.06 Allowed 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 124.752 1.221 . . . . 0.0 113.03 -177.072 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 28.1 p90 -61.18 -37.73 83.97 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 115.263 -0.88 . . . . 0.0 109.939 174.746 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 75.3 m-20 -62.25 -43.54 98.6 Favored 'General case' 0 CA--C 1.538 0.501 0 O-C-N 121.776 -0.578 . . . . 0.0 110.665 177.293 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 46.6 t -63.83 -44.14 94.13 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 119.633 1.106 . . . . 0.0 111.3 177.313 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 43.7 mt -62.8 -42.24 99.63 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 124.082 0.953 . . . . 0.0 113.294 176.85 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 31.4 mmmt -80.61 -12.65 59.48 Favored 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 124.904 1.281 . . . . 0.0 113.839 179.876 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 85.99 38.42 8.61 Favored Glycine 0 CA--C 1.538 1.485 0 C-N-CA 124.6 1.095 . . . . 0.0 114.274 179.225 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 49.2 ttp180 -122.07 -20.39 6.29 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 126.721 2.008 . . . . 0.0 114.808 -176.825 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 5.6 t -70.14 145.51 51.5 Favored 'General case' 0 CA--C 1.546 0.808 0 CA-C-N 119.393 0.997 . . . . 0.0 113.187 -178.187 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 85.9 p -155.65 8.53 0.26 Allowed 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 126.849 2.06 . . . . 0.0 113.106 179.24 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 67.3 mtm-85 -69.99 161.69 29.54 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 126.434 1.893 . . . . 0.0 113.797 -178.184 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -120.75 0.84 10.45 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 125.757 1.623 . . . . 0.0 112.263 175.834 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 23.1 m120 -142.41 34.93 1.48 Allowed 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 128.628 2.771 . . . . 0.0 109.692 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 8.9 t -56.98 130.51 46.35 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 126.052 1.741 . . . . 0.0 111.396 -178.39 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 17.1 mtmt -83.94 0.26 48.59 Favored 'General case' 0 N--CA 1.476 0.838 0 N-CA-C 113.715 1.006 . . . . 0.0 113.715 -178.843 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 72.2 m-85 -120.96 152.07 38.96 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 122.216 1.008 . . . . 0.0 112.231 -173.21 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -75.61 113.37 12.97 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 123.547 0.739 . . . . 0.0 111.766 -176.656 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 15.4 m170 -68.09 116.4 38.58 Favored Pre-proline 0 CA--C 1.546 0.823 0 N-CA-C 105.126 -2.176 . . . . 0.0 105.126 171.256 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 66.3 Cg_endo -70.16 132.14 22.09 Favored 'Trans proline' 0 CA--C 1.543 0.932 0 C-N-CA 121.917 1.744 . . . . 0.0 114.393 -169.86 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_endo -76.05 159.05 37.85 Favored 'Trans proline' 0 CA--C 1.542 0.879 0 C-N-CA 123.902 3.068 . . . . 0.0 111.863 178.543 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 21.1 Cg_endo -55.57 -32.78 84.39 Favored 'Trans proline' 0 CA--C 1.538 0.719 0 C-N-CA 123.484 2.789 . . . . 0.0 114.715 -178.155 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 56.0 m80 -76.84 -13.41 60.01 Favored 'General case' 0 N--CA 1.474 0.773 0 N-CA-C 114.659 1.355 . . . . 0.0 114.659 177.779 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.407 HD13 HD21 ' A' ' 16' ' ' LEU . 91.2 mt -115.86 -18.13 10.83 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 124.551 1.14 . . . . 0.0 113.535 179.344 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 58.3 mtpt -53.8 -37.21 63.28 Favored 'General case' 0 N--CA 1.48 1.072 0 CA-C-N 119.992 1.269 . . . . 0.0 111.233 172.907 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 19.6 m -64.16 -42.13 96.87 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 124.628 1.171 . . . . 0.0 111.709 176.007 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 90.6 mm-40 -67.21 -42.91 83.32 Favored 'General case' 0 N--CA 1.466 0.356 0 C-N-CA 123.517 0.727 . . . . 0.0 110.421 178.531 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 66.7 mt -63.2 -45.66 90.7 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-O 118.391 -0.814 . . . . 0.0 112.183 176.927 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 7.2 pt-20 -63.99 -35.64 81.37 Favored 'General case' 0 N--CA 1.474 0.766 0 CA-C-N 120.476 1.489 . . . . 0.0 111.878 177.196 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 69.1 mt -63.13 -44.54 99.48 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.679 0 CA-C-N 119.049 0.841 . . . . 0.0 109.77 175.185 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 86.4 m-20 -61.12 -42.74 99.08 Favored 'General case' 0 CA--C 1.545 0.774 0 O-C-N 121.707 -0.621 . . . . 0.0 110.728 175.665 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -63.37 -46.95 91.56 Favored Glycine 0 CA--C 1.531 1.053 0 C-N-CA 124.881 1.229 . . . . 0.0 112.403 178.873 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 85.6 mtt-85 -57.61 -40.05 78.28 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 124.589 1.156 . . . . 0.0 111.171 175.856 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 34.1 m-80 -71.71 -2.99 19.34 Favored 'General case' 0 CA--C 1.551 1.003 0 C-N-CA 124.854 1.262 . . . . 0.0 114.165 176.069 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 40.0 t30 -117.51 -35.42 3.99 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 124.945 1.298 . . . . 0.0 112.529 178.228 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 32.1 tp -55.57 -32.31 62.92 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 125.693 1.597 . . . . 0.0 112.611 177.735 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 29.9 pt -62.44 -15.05 14.02 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.722 0 C-N-CA 126.885 2.074 . . . . 0.0 114.434 177.099 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 51.0 tp60 -56.32 -26.62 52.91 Favored 'General case' 0 N--CA 1.473 0.722 0 CA-C-N 119.372 0.987 . . . . 0.0 112.644 178.232 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 40.7 mt-30 -61.38 -15.29 34.99 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 125.391 1.477 . . . . 0.0 113.78 175.933 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 29.7 mtpp -125.66 20.44 7.85 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 126.667 1.987 . . . . 0.0 112.704 -178.73 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 8.1 p30 . . . . . 0 CA--C 1.547 0.841 0 C-N-CA 124.786 1.234 . . . . 0.0 113.767 -179.98 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 13.9 tpt . . . . . 0 CA--C 1.543 0.7 0 N-CA-C 112.786 0.661 . . . . 0.0 112.786 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -55.45 -24.03 28.62 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 125.619 1.568 . . . . 0.0 114.396 179.79 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 26.9 m -61.22 -14.25 9.9 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.972 0 C-N-CA 125.484 1.514 . . . . 0.0 113.904 176.716 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 28.4 m -67.38 -9.33 40.38 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 125.43 1.492 . . . . 0.0 114.531 178.862 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 9.7 p -146.06 157.78 11.95 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.849 0 C-N-CA 125.499 1.52 . . . . 0.0 111.336 -179.582 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 13.2 p -66.56 151.42 96.36 Favored Pre-proline 0 N--CA 1.476 0.848 0 C-N-CA 124.618 1.167 . . . . 0.0 112.398 178.271 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -71.29 154.91 61.23 Favored 'Trans proline' 0 CA--C 1.541 0.846 0 C-N-CA 123.033 2.488 . . . . 0.0 112.939 -179.846 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 18.7 tt -151.35 -22.05 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.479 0.986 0 C-N-CA 124.873 1.269 . . . . 0.0 113.983 178.752 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 12.3 ttp180 -52.67 -27.59 18.01 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 124.912 1.285 . . . . 0.0 114.229 -179.072 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 10.3 p-10 -65.43 -18.7 65.52 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 126.085 1.754 . . . . 0.0 114.746 176.464 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 56.0 p -133.85 -9.81 2.72 Favored 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 124.676 1.19 . . . . 0.0 114.003 176.426 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 75.5 tttt -48.12 -46.52 34.21 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 125.732 1.613 . . . . 0.0 112.066 175.828 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -73.22 -23.15 60.34 Favored 'General case' 0 CA--C 1.544 0.727 0 N-CA-C 114.08 1.141 . . . . 0.0 114.08 -179.966 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 96.2 mt -91.19 -10.11 42.91 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 127.24 2.216 . . . . 0.0 114.78 -177.141 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 9.7 m -78.45 79.22 4.89 Favored 'General case' 0 N--CA 1.477 0.888 0 CA-C-N 119.728 1.149 . . . . 0.0 110.879 -178.805 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.548 HD21 HD13 ' A' ' 75' ' ' LEU . 10.0 tp -75.71 143.26 42.19 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 128.567 2.747 . . . . 0.0 111.875 -177.728 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 10.1 mt-10 -74.91 151.83 38.9 Favored 'General case' 0 N--CA 1.47 0.559 0 O-C-N 120.5 -1.375 . . . . 0.0 112.888 178.409 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 14.8 m -85.36 154.92 3.49 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.943 0 C-N-CA 123.255 0.622 . . . . 0.0 111.659 175.497 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 47.8 t -74.83 138.59 42.66 Favored 'General case' 0 CA--C 1.538 0.519 0 O-C-N 121.704 -0.622 . . . . 0.0 110.883 176.439 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.27 -39.57 74.85 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 124.811 1.244 . . . . 0.0 113.229 -178.422 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 13.5 mm-40 -73.97 -32.9 63.65 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 123.551 0.74 . . . . 0.0 111.351 179.268 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 67.3 t80 -62.75 -27.57 69.37 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 123.89 0.876 . . . . 0.0 111.471 175.844 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 57.9 mm-40 -65.28 -20.01 66.22 Favored 'General case' 0 N--CA 1.476 0.862 0 N-CA-C 112.815 0.672 . . . . 0.0 112.815 175.359 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 7.3 mpt_? -108.71 8.48 26.88 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 126.315 1.846 . . . . 0.0 111.607 176.894 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 58.64 36.12 84.22 Favored Glycine 0 CA--C 1.533 1.179 0 C-N-CA 125.421 1.486 . . . . 0.0 114.127 -179.677 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 4.8 t -130.96 7.81 4.73 Favored 'General case' 0 N--CA 1.477 0.917 0 N-CA-C 114.892 1.442 . . . . 0.0 114.892 -174.944 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 27.8 t -60.2 132.86 55.25 Favored 'General case' 0 CA--C 1.55 0.959 0 O-C-N 120.902 -1.124 . . . . 0.0 110.615 175.972 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 77.9 p -82.66 3.98 26.76 Favored 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 115.457 1.651 . . . . 0.0 115.457 -176.67 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 67.4 mtm-85 -130.23 146.2 60.58 Favored Pre-proline 0 N--CA 1.475 0.805 0 C-N-CA 125.252 1.421 . . . . 0.0 113.311 -176.216 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 95.2 Cg_endo -70.35 167.76 24.3 Favored 'Trans proline' 0 CA--C 1.543 0.958 0 C-N-CA 122.385 2.056 . . . . 0.0 110.021 171.706 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 -54.22 -29.12 45.28 Favored 'General case' 0 N--CA 1.475 0.81 0 N-CA-C 113.538 0.94 . . . . 0.0 113.538 177.158 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 16.2 p -75.52 -8.35 56.51 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 125.59 1.556 . . . . 0.0 114.981 178.642 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 19.3 mt-10 -124.78 -25.53 3.93 Favored 'General case' 0 N--CA 1.478 0.931 0 N-CA-C 116.092 1.886 . . . . 0.0 116.092 -176.012 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 4.3 t -68.92 163.14 25.11 Favored 'General case' 0 CA--C 1.548 0.895 0 N-CA-C 115.215 1.561 . . . . 0.0 115.215 -176.631 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -79.59 -9.99 59.72 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 127.286 2.234 . . . . 0.0 113.236 179.627 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 65.6 m-85 -140.54 174.0 10.95 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 126.411 1.885 . . . . 0.0 110.523 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -81.99 150.78 27.47 Favored 'General case' 0 CA--C 1.546 0.804 0 O-C-N 121.129 -0.982 . . . . 0.0 113.464 -177.742 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 66.5 m170 -123.82 86.52 53.24 Favored Pre-proline 0 CA--C 1.551 0.982 0 C-N-CA 126.043 1.737 . . . . 0.0 110.739 -179.587 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 29.5 Cg_endo -62.18 146.44 95.99 Favored 'Trans proline' 0 CA--C 1.54 0.811 0 C-N-CA 123.6 2.867 . . . . 0.0 114.923 -177.444 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 51.6 p -84.98 -176.05 6.04 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 124.867 1.267 . . . . 0.0 112.386 175.604 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 75.0 mmtt -60.67 -19.51 58.58 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 125.819 1.648 . . . . 0.0 113.553 173.558 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 43.0 m -109.06 -20.58 12.97 Favored 'General case' 0 N--CA 1.478 0.933 0 N-CA-C 114.216 1.191 . . . . 0.0 114.216 179.372 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 87.2 m -61.5 138.46 58.28 Favored 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 113.915 1.08 . . . . 0.0 113.915 -178.638 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 47.8 tt0 -83.57 127.66 33.91 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 125.832 1.653 . . . . 0.0 110.308 178.594 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 15.0 t -123.11 133.49 68.93 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.958 0 C-N-CA 125.666 1.587 . . . . 0.0 109.908 -177.852 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -144.24 129.29 18.57 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 125.114 1.366 . . . . 0.0 111.255 -179.136 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 61.9 t30 43.42 36.54 1.14 Allowed 'General case' 0 CA--C 1.552 1.051 0 C-N-CA 126.82 2.048 . . . . 0.0 116.462 177.94 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 87.41 14.24 64.17 Favored Glycine 0 CA--C 1.536 1.347 0 O-C-N 120.993 -1.067 . . . . 0.0 114.947 179.845 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 71.4 mtt180 -136.86 164.25 28.74 Favored 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 125.823 1.649 . . . . 0.0 111.087 -179.929 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 4.1 m -139.34 142.74 32.64 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.564 0 C-N-CA 127.13 2.172 . . . . 0.0 109.085 -177.926 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 29.1 mt -90.94 127.84 43.12 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.647 0 O-C-N 121.09 -1.006 . . . . 0.0 109.995 -178.51 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -73.38 147.46 44.29 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 123.962 0.905 . . . . 0.0 111.229 177.642 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 15.1 t -70.58 97.06 1.26 Allowed 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 125.655 1.582 . . . . 0.0 113.267 -175.82 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 28.1 p90 -59.66 -37.53 79.01 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 123.428 0.691 . . . . 0.0 110.407 175.179 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 69.7 m-20 -61.43 -36.82 81.42 Favored 'General case' 0 CA--C 1.54 0.574 0 O-C-N 121.645 -0.659 . . . . 0.0 111.632 177.273 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 46.7 p -67.19 -38.53 85.52 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-N 119.733 1.151 . . . . 0.0 111.976 177.304 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 42.1 mt -71.73 -42.97 66.64 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 124.51 1.124 . . . . 0.0 112.261 177.444 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 31.1 mmmt -76.12 -15.6 60.05 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 124.69 1.196 . . . . 0.0 113.7 179.573 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 87.76 42.41 6.07 Favored Glycine 0 CA--C 1.537 1.416 0 C-N-CA 124.519 1.057 . . . . 0.0 114.502 178.085 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 19.4 tpp180 -127.19 -23.43 3.57 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 125.865 1.666 . . . . 0.0 115.241 -176.922 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 8.2 t -62.67 128.96 38.39 Favored 'General case' 0 CA--C 1.546 0.8 0 CA-C-N 119.444 1.02 . . . . 0.0 113.142 -176.542 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 38.3 m -142.62 11.77 1.88 Allowed 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 126.743 2.017 . . . . 0.0 112.507 -179.773 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 77.4 mtm-85 -73.96 164.71 26.27 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 126.196 1.798 . . . . 0.0 114.047 -177.611 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -121.02 -1.59 9.82 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 125.961 1.704 . . . . 0.0 112.285 176.357 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 14.1 m120 -143.05 36.31 1.38 Allowed 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 128.127 2.571 . . . . 0.0 109.976 179.268 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 9.4 t -53.51 128.34 28.54 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 124.848 1.259 . . . . 0.0 111.436 -178.502 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 6.8 mtmp? -84.78 3.78 36.03 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 124.077 0.951 . . . . 0.0 113.457 -177.982 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 67.5 m-85 -124.76 152.79 43.37 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 124.207 1.003 . . . . 0.0 112.353 -173.881 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -79.65 116.4 19.83 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 123.712 0.805 . . . . 0.0 112.249 -175.788 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 32.7 m170 -68.99 114.42 23.1 Favored Pre-proline 0 CA--C 1.548 0.902 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 174.649 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 67.8 Cg_exo -47.23 112.99 0.6 Allowed 'Trans proline' 0 CA--C 1.541 0.861 0 C-N-CA 125.011 3.807 . . . . 0.0 116.267 -175.926 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 96.0 Cg_endo -76.0 157.01 38.7 Favored 'Trans proline' 0 CA--C 1.541 0.873 0 C-N-CA 121.74 1.627 . . . . 0.0 110.889 176.406 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_endo -57.41 -31.2 90.55 Favored 'Trans proline' 0 CA--C 1.539 0.734 0 C-N-CA 123.155 2.57 . . . . 0.0 114.839 -176.669 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 61.6 m80 -80.68 -10.84 59.7 Favored 'General case' 0 N--CA 1.475 0.803 0 N-CA-C 114.749 1.388 . . . . 0.0 114.749 178.169 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.548 HD13 HD21 ' A' ' 16' ' ' LEU . 77.3 mt -117.0 -16.96 10.47 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 124.214 1.005 . . . . 0.0 113.179 178.527 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 62.3 mttt -52.99 -35.47 59.29 Favored 'General case' 0 N--CA 1.475 0.825 0 CA-C-N 119.502 1.047 . . . . 0.0 111.58 173.249 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 24.5 m -63.64 -46.05 87.45 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 124.206 1.002 . . . . 0.0 111.295 175.969 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 92.4 mm-40 -65.57 -44.51 86.51 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 123.637 0.775 . . . . 0.0 110.659 177.661 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 87.9 mt -60.75 -46.52 90.13 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 123.833 0.853 . . . . 0.0 111.974 177.305 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -65.91 -35.42 80.58 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-N 119.934 1.243 . . . . 0.0 112.098 177.52 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 64.9 mt -62.6 -43.56 98.6 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.786 0 CA-C-N 119.258 0.935 . . . . 0.0 109.647 175.337 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 83.8 m-20 -61.77 -44.12 97.51 Favored 'General case' 0 CA--C 1.542 0.668 0 O-C-N 121.778 -0.576 . . . . 0.0 110.482 175.307 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -61.93 -49.52 74.75 Favored Glycine 0 CA--C 1.528 0.856 0 C-N-CA 124.701 1.143 . . . . 0.0 112.559 179.354 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 87.7 mtt-85 -55.64 -29.0 58.49 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 125.078 1.351 . . . . 0.0 113.469 177.972 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 42.9 m-80 -86.9 -0.52 56.65 Favored 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 125.136 1.374 . . . . 0.0 113.959 178.142 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 57.6 m-80 -130.7 -31.97 1.72 Allowed 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 124.752 1.221 . . . . 0.0 113.995 -179.078 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 85.6 mt -77.51 49.34 0.72 Allowed 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 127.347 2.259 . . . . 0.0 112.539 179.676 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 1.5 pp -133.27 157.69 42.77 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.68 0 C-N-CA 125.617 1.567 . . . . 0.0 113.116 -177.574 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 4.9 tp-100 -70.02 142.5 52.75 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.03 0.932 . . . . 0.0 110.56 178.437 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 73.3 mm-40 -84.72 147.08 27.08 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 124.1 0.96 . . . . 0.0 111.533 -179.869 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 14.2 ptmm? -153.59 170.47 20.73 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 125.364 1.466 . . . . 0.0 112.768 -179.009 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 48.4 t-20 . . . . . 0 CA--C 1.545 0.772 0 C-N-CA 124.648 1.179 . . . . 0.0 111.359 175.61 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.541 0.623 0 N-CA-C 113.968 1.099 . . . . 0.0 113.968 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -77.74 46.5 0.56 Allowed 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 126.773 2.029 . . . . 0.0 112.599 179.344 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 8.6 p -146.33 165.57 8.53 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.7 0 C-N-CA 126.446 1.898 . . . . 0.0 110.99 -176.794 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 46.2 m -66.26 137.21 56.79 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 124.695 1.198 . . . . 0.0 111.314 177.174 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 46.2 t -141.58 151.97 19.31 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.964 0 C-N-CA 126.09 1.756 . . . . 0.0 108.855 179.399 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 13.8 p -58.47 152.37 44.92 Favored Pre-proline 0 N--CA 1.477 0.916 0 C-N-CA 124.256 1.023 . . . . 0.0 112.557 178.082 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 70.9 Cg_exo -49.44 142.1 23.9 Favored 'Trans proline' 0 C--N 1.353 0.771 0 C-N-CA 123.872 3.048 . . . . 0.0 114.749 -179.955 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 30.2 pt -61.64 149.55 8.7 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.727 0 C-N-CA 124.431 1.092 . . . . 0.0 112.289 178.609 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 76.2 ttt-85 -59.33 -47.63 84.69 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 124.902 1.281 . . . . 0.0 114.259 -177.312 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 45.2 t0 -163.23 165.01 24.82 Favored 'General case' 0 CA--C 1.549 0.918 0 C-N-CA 124.662 1.185 . . . . 0.0 112.218 -177.958 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 21.3 p -132.63 -5.16 3.26 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 127.487 2.315 . . . . 0.0 112.52 175.432 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 7.1 ttpm? -51.04 -42.76 60.69 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 124.641 1.176 . . . . 0.0 112.618 177.767 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -66.61 -29.95 70.12 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 124.304 1.042 . . . . 0.0 113.372 177.936 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 91.2 mt -88.2 -12.22 44.48 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 127.202 2.201 . . . . 0.0 113.886 -179.119 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 12.9 m -79.59 79.37 6.07 Favored 'General case' 0 N--CA 1.474 0.732 0 CA-C-O 122.487 1.137 . . . . 0.0 110.218 -178.377 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.483 HD21 HD13 ' A' ' 75' ' ' LEU . 11.9 tp -75.61 143.81 42.1 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 128.512 2.725 . . . . 0.0 111.548 -177.357 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 62.5 mt-10 -74.03 150.57 40.57 Favored 'General case' 0 CA--C 1.541 0.614 0 O-C-N 120.765 -1.21 . . . . 0.0 112.362 178.622 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 13.7 m -86.33 153.24 3.44 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.232 0 C-N-CA 123.539 0.736 . . . . 0.0 111.149 174.59 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 41.5 t -72.29 130.15 40.1 Favored 'General case' 0 CA--C 1.543 0.695 0 O-C-N 121.129 -0.982 . . . . 0.0 112.081 178.76 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.2 -28.94 69.73 Favored 'General case' 0 N--CA 1.479 0.992 0 O-C-N 121.287 -0.883 . . . . 0.0 113.09 179.821 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -77.03 -41.4 42.77 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 123.726 0.811 . . . . 0.0 110.142 178.884 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 65.0 t80 -63.54 -34.4 77.72 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 124.331 1.052 . . . . 0.0 111.517 175.907 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 13.6 mm100 -62.65 -14.51 44.33 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 124.03 0.932 . . . . 0.0 113.161 175.081 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 11.8 mtp-105 -121.41 12.67 10.9 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 127.428 2.291 . . . . 0.0 112.197 179.27 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 57.2 35.73 71.8 Favored Glycine 0 CA--C 1.534 1.261 0 C-N-CA 125.259 1.409 . . . . 0.0 114.0 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 7.4 t -131.73 15.6 4.84 Favored 'General case' 0 N--CA 1.476 0.842 0 N-CA-C 114.898 1.444 . . . . 0.0 114.898 -174.958 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 5.9 t -67.83 172.53 5.29 Favored 'General case' 0 CA--C 1.556 1.182 0 CA-C-N 119.137 0.88 . . . . 0.0 111.432 175.295 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 94.3 p -134.79 6.1 3.41 Favored 'General case' 0 N--CA 1.476 0.85 0 N-CA-C 115.55 1.685 . . . . 0.0 115.55 -175.782 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 81.5 mtt180 -133.1 143.34 48.04 Favored Pre-proline 0 N--CA 1.472 0.64 0 C-N-CA 125.53 1.532 . . . . 0.0 111.91 -179.39 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -68.17 165.72 27.54 Favored 'Trans proline' 0 CA--C 1.542 0.913 0 C-N-CA 122.144 1.896 . . . . 0.0 109.919 173.155 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -51.89 -32.7 33.59 Favored 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 113.765 1.024 . . . . 0.0 113.765 178.486 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 17.6 p -71.05 -14.08 62.2 Favored 'General case' 0 N--CA 1.473 0.725 0 C-N-CA 125.906 1.682 . . . . 0.0 115.021 178.481 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 74.3 mm-40 -123.78 -22.85 4.82 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 125.692 1.597 . . . . 0.0 115.23 -174.268 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 4.6 t -65.14 168.18 7.08 Favored 'General case' 0 CA--C 1.548 0.898 0 N-CA-C 115.937 1.829 . . . . 0.0 115.937 -175.527 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -80.41 -18.98 47.27 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 128.075 2.55 . . . . 0.0 113.102 -179.755 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 67.5 m-85 -145.2 178.37 8.12 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 126.625 1.97 . . . . 0.0 110.598 -178.061 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -79.37 151.13 31.15 Favored 'General case' 0 CA--C 1.547 0.864 0 O-C-N 120.812 -1.18 . . . . 0.0 113.404 -178.071 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 59.5 m170 -125.41 87.73 55.24 Favored Pre-proline 0 CA--C 1.549 0.932 0 C-N-CA 126.128 1.771 . . . . 0.0 110.355 179.576 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -64.32 147.32 90.9 Favored 'Trans proline' 0 C--N 1.352 0.754 0 C-N-CA 123.237 2.625 . . . . 0.0 114.379 -177.885 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 60.2 p -84.59 -176.31 6.18 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 124.685 1.194 . . . . 0.0 111.79 174.735 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 47.1 mmtm -61.04 -18.75 59.52 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 125.259 1.424 . . . . 0.0 113.253 173.084 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 42.1 m -109.17 -20.6 12.93 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 125.133 1.373 . . . . 0.0 114.563 -178.9 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 97.0 m -65.45 132.93 50.19 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-N 119.357 0.981 . . . . 0.0 112.659 179.862 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 33.9 mt-30 -77.24 138.43 39.41 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 123.271 0.628 . . . . 0.0 111.011 176.766 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 11.8 t -127.87 147.08 32.58 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.897 0 C-N-CA 125.666 1.586 . . . . 0.0 110.986 -176.895 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 4.3 pt-20 -149.02 117.48 6.51 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 125.188 1.395 . . . . 0.0 114.062 -179.349 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 75.0 m-20 40.66 30.46 0.09 Allowed 'General case' 0 CA--C 1.553 1.073 0 C-N-CA 127.536 2.334 . . . . 0.0 116.986 174.987 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 109.17 5.5 30.41 Favored Glycine 0 CA--C 1.536 1.371 0 C-N-CA 124.656 1.122 . . . . 0.0 114.932 -178.995 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 34.3 mtt180 -133.87 165.41 25.07 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 119.236 1.518 . . . . 0.0 112.508 179.04 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 3.8 m -140.42 145.79 25.39 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.534 0 C-N-CA 127.992 2.517 . . . . 0.0 109.107 -179.417 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 17.8 mt -94.13 131.44 41.01 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 O-C-N 121.003 -1.061 . . . . 0.0 110.201 -178.485 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -77.65 148.21 35.16 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 124.095 0.958 . . . . 0.0 111.659 178.632 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 21.5 t -70.63 98.94 1.58 Allowed 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 124.9 1.28 . . . . 0.0 112.582 -177.409 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 29.5 p90 -60.78 -38.34 84.95 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 123.652 0.781 . . . . 0.0 110.512 175.789 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 60.9 m-20 -59.59 -38.44 81.25 Favored 'General case' 0 CA--C 1.543 0.703 0 O-C-N 121.719 -0.613 . . . . 0.0 110.436 176.66 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 24.7 p -65.49 -41.71 92.98 Favored 'General case' 0 N--CA 1.472 0.632 0 CA-C-N 119.929 1.241 . . . . 0.0 112.164 177.832 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 33.6 mt -68.71 -41.25 79.34 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 124.756 1.222 . . . . 0.0 112.638 177.913 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 14.2 mmmm -77.53 -8.78 58.34 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 124.586 1.155 . . . . 0.0 113.437 178.743 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 78.71 41.12 16.02 Favored Glycine 0 CA--C 1.536 1.369 0 C-N-CA 124.733 1.158 . . . . 0.0 113.632 179.265 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 65.1 ttt-85 -123.64 -22.9 4.86 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 126.85 2.06 . . . . 0.0 114.873 -175.571 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 5.6 t -69.22 145.88 52.81 Favored 'General case' 0 CA--C 1.545 0.768 0 CA-C-N 119.24 0.927 . . . . 0.0 112.973 -178.0 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 78.4 p -154.98 9.54 0.32 Allowed 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 126.704 2.001 . . . . 0.0 112.904 178.94 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 68.2 mtm-85 -70.14 160.8 31.41 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 126.181 1.792 . . . . 0.0 113.263 -178.569 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -121.25 3.15 10.36 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 125.623 1.569 . . . . 0.0 112.459 177.125 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 27.2 m120 -142.71 27.66 1.65 Allowed 'General case' 0 CA--C 1.552 1.048 0 C-N-CA 127.751 2.42 . . . . 0.0 110.56 -179.218 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 4.5 t -50.17 128.83 20.09 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 126.502 1.921 . . . . 0.0 112.525 -176.189 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 32.3 mtmt -84.17 3.11 36.51 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 125.182 1.393 . . . . 0.0 113.868 -177.98 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 87.9 m-85 -125.46 152.87 44.34 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 124.944 1.298 . . . . 0.0 111.935 -175.298 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -76.38 117.42 18.03 Favored 'General case' 0 N--CA 1.465 0.307 0 C-N-CA 123.708 0.803 . . . . 0.0 112.213 -176.471 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 12.9 m170 -72.31 115.7 41.68 Favored Pre-proline 0 CA--C 1.547 0.859 0 N-CA-C 107.962 -1.125 . . . . 0.0 107.962 174.215 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_exo -48.87 115.22 1.56 Allowed 'Trans proline' 0 CA--C 1.542 0.905 0 C-N-CA 124.802 3.668 . . . . 0.0 115.696 -176.104 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 92.2 Cg_endo -78.88 153.65 25.77 Favored 'Trans proline' 0 CA--C 1.544 1.02 0 C-N-CA 121.887 1.725 . . . . 0.0 111.283 177.6 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 86.6 Cg_exo -47.16 -36.99 22.78 Favored 'Trans proline' 0 CA--C 1.537 0.664 0 C-N-CA 124.189 3.26 . . . . 0.0 115.704 179.682 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 69.8 m80 -79.63 -10.35 59.78 Favored 'General case' 0 N--CA 1.473 0.704 0 N-CA-C 115.588 1.699 . . . . 0.0 115.588 -179.643 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.483 HD13 HD21 ' A' ' 16' ' ' LEU . 79.9 mt -119.42 -14.55 9.16 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 124.512 1.125 . . . . 0.0 113.287 177.721 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 23.8 mtpp -54.45 -34.8 62.16 Favored 'General case' 0 N--CA 1.477 0.915 0 CA-C-N 119.451 1.023 . . . . 0.0 111.409 173.363 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 21.7 m -62.92 -45.71 91.2 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 123.877 0.871 . . . . 0.0 111.202 176.068 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 92.6 mm-40 -66.03 -44.99 83.05 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 123.604 0.761 . . . . 0.0 110.954 177.665 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 76.5 mt -60.72 -45.24 94.99 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 123.742 0.817 . . . . 0.0 112.212 177.809 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -66.85 -36.5 82.47 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-N 119.578 1.081 . . . . 0.0 111.886 177.343 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 63.9 mt -62.06 -42.05 93.49 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.754 0 CA-C-N 119.117 0.871 . . . . 0.0 109.797 175.384 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 86.4 m-20 -61.74 -47.12 86.64 Favored 'General case' 0 CA--C 1.543 0.704 0 O-C-N 121.861 -0.525 . . . . 0.0 110.395 175.32 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -60.43 -47.48 90.92 Favored Glycine 0 CA--C 1.531 1.058 0 C-N-CA 124.595 1.093 . . . . 0.0 113.105 179.355 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 88.9 mtt-85 -58.18 -21.32 46.92 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 125.32 1.448 . . . . 0.0 113.402 176.66 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 60.3 m-80 -106.28 9.81 31.9 Favored 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 125.991 1.717 . . . . 0.0 112.915 178.591 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 38.9 t30 -132.75 -25.09 1.9 Allowed 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 125.087 1.355 . . . . 0.0 114.213 -179.99 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 53.5 tp -61.47 -30.17 70.43 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 125.975 1.71 . . . . 0.0 113.551 -179.986 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 88' ' ' ILE . . . . . 0.492 HD13 ' H ' ' A' ' 88' ' ' ILE . 0.2 OUTLIER -72.47 173.3 0.89 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.686 0 C-N-CA 125.983 1.713 . . . . 0.0 112.753 178.064 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 5.6 tp-100 -63.02 156.26 25.23 Favored 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 125.29 1.436 . . . . 0.0 111.303 176.532 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 5.2 tp-100 -52.81 138.38 29.56 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 124.42 1.088 . . . . 0.0 112.462 179.642 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 62.0 mttp -69.71 -8.55 48.8 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 126.218 1.807 . . . . 0.0 115.843 -176.379 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 49.2 t-20 . . . . . 0 CA--C 1.542 0.672 0 C-N-CA 125.566 1.547 . . . . 0.0 111.497 179.806 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 13.8 tpt . . . . . 0 CA--C 1.545 0.766 0 N-CA-C 112.583 0.586 . . . . 0.0 112.583 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -137.9 11.82 2.88 Favored 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 125.912 1.685 . . . . 0.0 113.47 -179.875 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 35.9 m -131.32 9.8 1.85 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.23 0 C-N-CA 125.931 1.692 . . . . 0.0 113.473 -178.227 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 8.0 t -152.4 179.34 8.64 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 125.961 1.705 . . . . 0.0 111.272 179.862 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 14.7 p -143.52 143.43 24.4 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.798 0 C-N-CA 125.605 1.562 . . . . 0.0 111.234 179.672 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 26.6 p -71.1 142.38 87.4 Favored Pre-proline 0 N--CA 1.476 0.873 0 C-N-CA 124.655 1.182 . . . . 0.0 112.926 -179.19 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_endo -74.76 151.25 40.53 Favored 'Trans proline' 0 CA--C 1.541 0.866 0 C-N-CA 123.017 2.478 . . . . 0.0 111.533 177.217 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 9.1 tp -158.0 156.54 4.03 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.817 0 C-N-CA 125.298 1.439 . . . . 0.0 110.24 178.434 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 51.1 tpt85 -143.3 -29.64 0.52 Allowed 'General case' 0 N--CA 1.481 1.093 0 N-CA-C 114.621 1.341 . . . . 0.0 114.621 179.338 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 45.5 t0 -64.28 154.31 35.53 Favored 'General case' 0 CA--C 1.549 0.916 0 CA-C-N 119.389 0.995 . . . . 0.0 112.16 179.01 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 30.5 p -129.79 -1.11 4.8 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 126.864 2.065 . . . . 0.0 113.18 -179.521 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 7.4 ttpm? -49.33 -41.06 37.51 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 125.179 1.392 . . . . 0.0 113.945 179.04 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -75.48 -22.63 57.07 Favored 'General case' 0 N--CA 1.475 0.79 0 N-CA-C 114.113 1.153 . . . . 0.0 114.113 178.684 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 90.7 mt -91.72 -12.02 35.18 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 127.22 2.208 . . . . 0.0 114.423 -177.822 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 9.6 m -79.03 74.2 5.56 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 124.678 1.191 . . . . 0.0 110.898 -177.792 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.533 HD21 HD13 ' A' ' 75' ' ' LEU . 9.8 tp -75.7 143.73 41.96 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 126.845 2.058 . . . . 0.0 111.853 -178.047 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 8.2 mt-10 -69.54 150.29 47.28 Favored 'General case' 0 N--CA 1.472 0.67 0 O-C-N 120.766 -1.209 . . . . 0.0 112.308 178.735 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 21.3 m -82.15 148.85 5.01 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 N-CA-C 109.303 -0.628 . . . . 0.0 109.303 173.545 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 49.6 t -66.01 130.92 44.91 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-O 121.757 0.789 . . . . 0.0 111.01 178.124 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 2.8 mpt_? -69.41 -33.75 73.47 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 125.667 1.587 . . . . 0.0 112.192 -177.725 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 14.8 mm-40 -77.9 -34.5 51.42 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 123.676 0.79 . . . . 0.0 110.998 178.36 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 74.6 t80 -62.59 -27.51 69.24 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 124.452 1.101 . . . . 0.0 111.365 175.222 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 54.4 mm-40 -65.03 -19.5 66.03 Favored 'General case' 0 N--CA 1.475 0.825 0 N-CA-C 112.806 0.669 . . . . 0.0 112.806 175.337 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 6.9 mpt_? -111.75 10.2 20.9 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 126.477 1.911 . . . . 0.0 111.56 177.012 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 58.32 36.31 82.83 Favored Glycine 0 CA--C 1.533 1.213 0 C-N-CA 125.463 1.506 . . . . 0.0 114.287 -179.957 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 6.2 t -130.84 11.9 5.2 Favored 'General case' 0 N--CA 1.478 0.963 0 N-CA-C 115.117 1.525 . . . . 0.0 115.117 -175.388 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 36.8 t -61.45 139.11 58.27 Favored 'General case' 0 CA--C 1.551 1.017 0 O-C-N 121.318 -0.864 . . . . 0.0 110.988 176.165 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 78.2 p -89.23 0.67 56.59 Favored 'General case' 0 N--CA 1.472 0.631 0 N-CA-C 115.686 1.735 . . . . 0.0 115.686 -176.755 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 68.0 mtt180 -132.65 145.35 56.79 Favored Pre-proline 0 N--CA 1.475 0.803 0 C-N-CA 125.19 1.396 . . . . 0.0 113.042 -177.131 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -68.94 166.14 27.58 Favored 'Trans proline' 0 CA--C 1.543 0.965 0 C-N-CA 122.39 2.06 . . . . 0.0 110.125 172.878 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -52.23 -32.1 35.21 Favored 'General case' 0 N--CA 1.477 0.89 0 N-CA-C 113.868 1.062 . . . . 0.0 113.868 178.022 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 22.4 p -72.14 -13.71 61.63 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 125.585 1.554 . . . . 0.0 114.941 178.553 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 70.8 mm-40 -125.35 -22.25 4.38 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 125.574 1.55 . . . . 0.0 115.182 -174.623 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' CYS . . . . . 0.42 ' SG ' ' NZ ' ' A' ' 35' ' ' LYS . 14.3 t -60.03 162.75 5.35 Favored 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 115.37 1.618 . . . . 0.0 115.37 -176.509 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.42 ' NZ ' ' SG ' ' A' ' 34' ' ' CYS . 0.0 OUTLIER -80.42 -13.65 58.95 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 126.748 2.019 . . . . 0.0 112.821 177.959 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 70.3 m-85 -141.61 175.92 9.31 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 126.657 1.983 . . . . 0.0 111.151 -178.76 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -81.57 151.3 27.77 Favored 'General case' 0 CA--C 1.551 1.008 0 O-C-N 120.753 -1.217 . . . . 0.0 113.599 -178.283 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 56.0 m170 -124.67 91.28 49.7 Favored Pre-proline 0 CA--C 1.551 1.001 0 C-N-CA 126.006 1.722 . . . . 0.0 111.168 179.419 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo -66.49 167.05 19.81 Favored 'Trans proline' 0 CA--C 1.542 0.922 0 C-N-CA 123.678 2.919 . . . . 0.0 114.395 -179.237 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 59.7 p -125.04 -174.28 3.01 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 126.116 1.766 . . . . 0.0 111.954 177.401 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 30.9 mmmt -49.48 -26.58 3.49 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 127.31 2.244 . . . . 0.0 116.323 -179.378 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 21.1 m -109.05 -19.07 13.51 Favored 'General case' 0 N--CA 1.481 1.082 0 N-CA-C 114.506 1.299 . . . . 0.0 114.506 -179.389 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 58.3 m -63.49 135.43 56.88 Favored 'General case' 0 CA--C 1.543 0.7 0 CA-C-N 119.359 0.981 . . . . 0.0 113.137 -178.734 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 40.4 tt0 -85.29 127.6 34.38 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 125.519 1.527 . . . . 0.0 110.044 178.716 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 20.1 t -120.45 133.6 66.64 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 C-N-CA 125.523 1.529 . . . . 0.0 109.51 -178.162 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 -143.19 130.44 20.89 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 125.016 1.326 . . . . 0.0 110.864 -179.118 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 45.59 36.65 2.68 Favored 'General case' 0 CA--C 1.555 1.147 0 C-N-CA 126.451 1.9 . . . . 0.0 115.366 178.936 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 81.18 19.94 65.88 Favored Glycine 0 CA--C 1.536 1.387 0 O-C-N 120.956 -1.09 . . . . 0.0 114.579 -179.856 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 63.4 mtt180 -138.69 163.25 32.61 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 125.995 1.718 . . . . 0.0 110.938 -179.16 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 3.3 m -138.17 140.07 40.94 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.501 0 C-N-CA 126.613 1.965 . . . . 0.0 109.381 -177.91 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 54.7 mt -90.32 130.63 39.25 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.662 0 O-C-N 121.544 -0.723 . . . . 0.0 109.528 -178.952 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -74.99 150.56 38.94 Favored 'General case' 0 CA--C 1.551 0.982 0 C-N-CA 123.782 0.833 . . . . 0.0 112.556 178.642 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 2.5 t -68.35 91.51 0.39 Allowed 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 125.614 1.566 . . . . 0.0 110.85 -178.375 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 25.2 p90 -56.48 -36.94 69.69 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 124.167 0.987 . . . . 0.0 111.498 178.996 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 72.7 m-20 -61.82 -33.7 74.6 Favored 'General case' 0 CA--C 1.54 0.592 0 O-C-N 121.878 -0.514 . . . . 0.0 111.597 177.43 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 30.4 t -70.39 -41.21 73.32 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-N 119.678 1.126 . . . . 0.0 110.769 177.254 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 42.0 mt -66.74 -41.11 88.38 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.01 0.924 . . . . 0.0 112.912 176.075 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 32.1 mmmt -81.32 -7.53 59.59 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 125.114 1.365 . . . . 0.0 114.203 -179.302 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 77.61 39.95 23.98 Favored Glycine 0 CA--C 1.537 1.431 0 C-N-CA 124.505 1.05 . . . . 0.0 114.12 178.889 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 50.4 ttp180 -125.98 -16.54 5.57 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 126.758 2.023 . . . . 0.0 114.79 -176.546 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 4.7 t -62.29 133.48 55.19 Favored 'General case' 0 CA--C 1.544 0.713 0 CA-C-N 119.448 1.022 . . . . 0.0 113.322 -176.233 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 88.2 p -145.0 6.34 1.16 Allowed 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 127.138 2.175 . . . . 0.0 112.47 179.423 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.464 ' NH1' ' SG ' ' A' ' 66' ' ' CYS . 21.8 mtm105 -70.85 168.31 17.09 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 126.813 2.045 . . . . 0.0 113.248 179.434 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -136.66 14.84 3.15 Favored 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 127.019 2.128 . . . . 0.0 111.022 176.179 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 33.9 p-10 -144.67 19.68 1.67 Allowed 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 127.839 2.456 . . . . 0.0 113.522 -174.785 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' CYS . . . . . 0.464 ' SG ' ' NH1' ' A' ' 63' ' ' ARG . 63.2 m -41.51 115.56 0.65 Allowed 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 125.056 1.342 . . . . 0.0 114.506 -175.443 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 19.1 mtmt -80.66 4.0 20.17 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-N 114.916 -1.038 . . . . 0.0 111.459 173.991 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 65.5 m-85 -125.61 144.94 50.36 Favored 'General case' 0 N--CA 1.447 -0.605 0 C-N-CA 126.416 1.886 . . . . 0.0 110.21 -174.24 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -72.81 117.56 14.66 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 123.817 0.847 . . . . 0.0 112.252 -176.017 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 3.8 m-70 -65.4 123.97 85.82 Favored Pre-proline 0 CA--C 1.546 0.801 0 N-CA-C 105.865 -1.902 . . . . 0.0 105.865 170.328 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -70.02 122.87 9.46 Favored 'Trans proline' 0 CA--C 1.544 0.992 0 C-N-CA 121.946 1.764 . . . . 0.0 113.938 -170.932 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 94.5 Cg_endo -77.82 153.29 29.41 Favored 'Trans proline' 0 CA--C 1.543 0.962 0 C-N-CA 123.264 2.643 . . . . 0.0 112.015 179.261 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 80.6 Cg_exo -45.69 -42.9 19.09 Favored 'Trans proline' 0 CA--C 1.538 0.72 0 C-N-CA 124.319 3.346 . . . . 0.0 115.844 179.883 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 17.4 t-80 -70.77 -15.22 62.66 Favored 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 114.938 1.458 . . . . 0.0 114.938 -179.786 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.533 HD13 HD21 ' A' ' 16' ' ' LEU . 81.1 mt -112.55 -18.17 12.46 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 124.562 1.145 . . . . 0.0 112.975 178.622 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 57.4 mtpt -54.09 -35.76 62.45 Favored 'General case' 0 N--CA 1.478 0.941 0 CA-C-N 119.83 1.195 . . . . 0.0 111.593 174.852 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 22.4 m -62.83 -45.63 91.72 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 124.081 0.952 . . . . 0.0 111.374 175.691 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 76.2 mt-30 -64.21 -46.93 81.71 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 123.634 0.774 . . . . 0.0 110.711 177.449 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 92.4 mt -61.42 -45.8 92.77 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 124.205 1.002 . . . . 0.0 112.549 179.244 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 7.5 pt-20 -66.03 -37.01 84.79 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-N 119.91 1.232 . . . . 0.0 111.98 177.972 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 61.9 mt -61.59 -40.74 87.65 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 CA-C-N 119.215 0.916 . . . . 0.0 110.131 176.304 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 79.5 m-20 -67.59 -47.03 70.87 Favored 'General case' 0 CA--C 1.546 0.819 0 O-C-N 121.918 -0.489 . . . . 0.0 110.803 175.477 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -61.49 -40.16 98.3 Favored Glycine 0 CA--C 1.529 0.954 0 C-N-CA 125.114 1.34 . . . . 0.0 113.62 -179.278 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 82.0 mtt-85 -56.74 -16.73 6.98 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 125.239 1.416 . . . . 0.0 113.919 175.997 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 12.0 t-20 -115.57 9.41 15.36 Favored 'General case' 0 CA--C 1.555 1.147 0 C-N-CA 125.965 1.706 . . . . 0.0 112.522 178.771 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -134.77 -24.52 1.5 Allowed 'General case' 0 CA--C 1.549 0.93 0 C-N-CA 125.31 1.444 . . . . 0.0 114.383 -176.641 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 42.4 mt -61.93 -11.53 13.65 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 125.263 1.425 . . . . 0.0 114.205 179.348 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 1.7 pp -68.29 18.23 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.553 1.077 0 C-N-CA 128.099 2.56 . . . . 0.0 114.785 176.804 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 33.7 tt0 -49.33 134.13 18.91 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 126.706 2.002 . . . . 0.0 112.583 179.735 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 52.6 tt0 -148.66 149.66 31.87 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 125.1 1.36 . . . . 0.0 111.016 179.78 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 65.0 pttt -64.2 163.62 12.39 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 125.0 1.32 . . . . 0.0 113.423 178.624 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 44.2 t30 . . . . . 0 CA--C 1.545 0.756 0 C-N-CA 124.799 1.24 . . . . 0.0 112.502 178.228 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 64.7 mtt . . . . . 0 CA--C 1.544 0.715 0 N-CA-C 113.256 0.836 . . . . 0.0 113.256 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -138.23 12.19 2.82 Favored 'General case' 0 CA--C 1.551 1.01 0 C-N-CA 126.002 1.721 . . . . 0.0 113.406 -179.441 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 35.1 m -73.21 -7.95 10.7 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.167 0 C-N-CA 125.375 1.47 . . . . 0.0 114.652 -179.561 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 17.2 m -58.65 155.0 13.32 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 125.663 1.585 . . . . 0.0 113.759 -179.885 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 30.2 m -138.04 164.8 27.06 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.005 0 C-N-CA 125.526 1.53 . . . . 0.0 112.175 179.741 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 2.7 p -63.37 153.45 82.26 Favored Pre-proline 0 N--CA 1.477 0.909 0 C-N-CA 125.655 1.582 . . . . 0.0 113.539 179.25 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 62.2 Cg_endo -76.15 25.82 0.42 Allowed 'Trans proline' 0 CA--C 1.546 1.092 0 C-N-CA 125.187 3.925 . . . . 0.0 115.771 -178.167 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 44.6 pt -50.37 -28.5 5.29 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.048 0 C-N-CA 125.862 1.665 . . . . 0.0 115.393 -178.459 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 60.2 ttt85 -71.59 -31.5 67.01 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 124.297 1.039 . . . . 0.0 112.35 176.982 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -87.47 -35.37 18.28 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 124.689 1.196 . . . . 0.0 112.681 179.78 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 28.3 p -67.84 -3.11 8.57 Favored 'General case' 0 N--CA 1.481 1.12 0 N-CA-C 113.965 1.098 . . . . 0.0 113.965 177.02 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 36.2 ttpt -38.24 -45.89 1.02 Allowed 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 127.481 2.312 . . . . 0.0 114.302 178.2 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -80.34 -19.03 47.44 Favored 'General case' 0 CA--C 1.543 0.696 0 N-CA-C 114.743 1.386 . . . . 0.0 114.743 -178.402 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 83.5 mt -93.12 -18.52 22.49 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 126.362 1.865 . . . . 0.0 114.555 -176.605 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 2.6 m -73.71 75.3 1.56 Allowed 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 124.645 1.178 . . . . 0.0 111.863 -178.847 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -75.65 146.07 40.56 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 128.391 2.676 . . . . 0.0 111.094 -178.456 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 12.0 mt-10 -76.04 153.0 36.76 Favored 'General case' 0 N--CA 1.472 0.667 0 O-C-N 120.215 -1.553 . . . . 0.0 112.835 178.386 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 10.8 m -84.4 154.43 3.63 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.73 0 C-N-CA 122.748 0.419 . . . . 0.0 110.279 173.904 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 48.8 t -71.41 139.18 49.63 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-O 121.23 0.538 . . . . 0.0 110.361 176.609 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 3.8 mpt_? -68.59 -38.39 80.61 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 125.306 1.443 . . . . 0.0 112.452 -177.635 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 17.0 mm-40 -74.63 -33.78 62.64 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 123.918 0.887 . . . . 0.0 110.927 178.489 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 51.1 t80 -64.71 -22.78 67.06 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 123.801 0.841 . . . . 0.0 112.065 175.315 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 76.9 mt-30 -59.12 -22.58 61.09 Favored 'General case' 0 N--CA 1.477 0.882 0 O-C-N 121.568 -0.707 . . . . 0.0 112.872 175.526 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -116.62 14.26 15.41 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 125.741 1.616 . . . . 0.0 111.91 177.24 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 58.36 37.75 88.48 Favored Glycine 0 CA--C 1.534 1.227 0 C-N-CA 125.333 1.444 . . . . 0.0 114.228 -179.61 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 5.5 t -127.73 9.61 6.47 Favored 'General case' 0 N--CA 1.479 1.023 0 N-CA-C 114.632 1.345 . . . . 0.0 114.632 -175.279 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 34.6 t -62.7 134.61 56.57 Favored 'General case' 0 CA--C 1.55 0.947 0 O-C-N 120.927 -1.108 . . . . 0.0 111.021 175.729 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 27.8 m -79.37 2.79 20.34 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 125.69 1.596 . . . . 0.0 115.293 -177.358 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 71.2 mtm-85 -132.62 146.93 63.53 Favored Pre-proline 0 N--CA 1.474 0.775 0 C-N-CA 125.033 1.333 . . . . 0.0 113.733 -174.876 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 95.0 Cg_endo -71.01 166.87 27.75 Favored 'Trans proline' 0 CA--C 1.545 1.047 0 C-N-CA 122.337 2.024 . . . . 0.0 109.792 170.738 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -53.9 -32.4 53.22 Favored 'General case' 0 N--CA 1.477 0.924 0 O-C-N 121.157 -0.965 . . . . 0.0 112.79 177.681 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 26.9 p -71.16 -8.28 52.46 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 125.876 1.671 . . . . 0.0 115.147 178.158 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 20.5 mt-10 -125.14 -25.81 3.77 Favored 'General case' 0 N--CA 1.476 0.854 0 N-CA-C 115.439 1.644 . . . . 0.0 115.439 -177.587 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 4.2 t -70.16 164.23 24.65 Favored 'General case' 0 CA--C 1.548 0.878 0 N-CA-C 115.154 1.539 . . . . 0.0 115.154 -177.01 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 75.0 mmtt -81.31 -10.55 59.55 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 127.272 2.229 . . . . 0.0 113.25 179.949 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 73.7 m-85 -139.15 175.66 9.36 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 126.878 2.071 . . . . 0.0 110.196 179.497 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -86.11 150.13 24.64 Favored 'General case' 0 CA--C 1.546 0.805 0 O-C-N 121.213 -0.93 . . . . 0.0 113.458 -177.655 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 61.5 m170 -122.17 90.62 49.02 Favored Pre-proline 0 CA--C 1.554 1.128 0 C-N-CA 125.573 1.549 . . . . 0.0 111.056 179.222 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 30.8 Cg_endo -62.36 161.35 27.64 Favored 'Trans proline' 0 C--N 1.355 0.878 0 C-N-CA 123.62 2.88 . . . . 0.0 114.878 -178.874 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 52.5 p -113.44 -174.21 2.42 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 125.655 1.582 . . . . 0.0 112.265 177.439 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 58.0 mtmt -52.55 -25.4 10.36 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 126.873 2.069 . . . . 0.0 115.512 178.981 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 42.7 m -109.07 -19.83 13.23 Favored 'General case' 0 N--CA 1.478 0.968 0 N-CA-C 114.827 1.418 . . . . 0.0 114.827 -179.07 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 63.8 m -62.82 133.72 55.16 Favored 'General case' 0 CA--C 1.541 0.611 0 CA-C-N 119.471 1.032 . . . . 0.0 113.419 -179.107 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 35.5 mt-30 -81.92 139.14 34.81 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 123.41 0.684 . . . . 0.0 110.888 175.769 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 12.0 t -131.49 138.71 52.44 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.794 0 C-N-CA 125.413 1.485 . . . . 0.0 110.59 -177.275 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -145.69 132.75 20.33 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 125.093 1.357 . . . . 0.0 111.128 177.879 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 63.1 t30 42.78 37.14 0.97 Allowed 'General case' 0 CA--C 1.552 1.021 0 C-N-CA 126.684 1.994 . . . . 0.0 116.105 177.89 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 84.25 17.18 65.23 Favored Glycine 0 CA--C 1.536 1.402 0 O-C-N 120.998 -1.064 . . . . 0.0 114.848 -179.62 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 64.1 mtt180 -136.48 160.28 39.24 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 125.617 1.567 . . . . 0.0 111.736 -179.546 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 3.2 m -138.79 139.31 41.02 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.491 0 C-N-CA 127.63 2.372 . . . . 0.0 110.392 -176.459 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 59.1 mt -87.19 129.08 39.23 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.78 0 O-C-N 121.118 -0.988 . . . . 0.0 109.716 -179.788 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -75.13 149.87 38.92 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 124.185 0.994 . . . . 0.0 111.74 178.14 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 18.8 t -68.93 99.87 1.12 Allowed 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 124.682 1.193 . . . . 0.0 113.061 -177.045 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 33.2 p90 -61.83 -38.0 86.55 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 115.071 -0.968 . . . . 0.0 110.229 175.064 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 70.0 m-20 -62.22 -44.28 96.93 Favored 'General case' 0 CA--C 1.537 0.452 0 O-C-N 121.755 -0.591 . . . . 0.0 110.612 176.962 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 41.6 t -63.94 -41.79 97.51 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-N 119.631 1.105 . . . . 0.0 111.509 177.516 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 31.3 mt -63.57 -40.53 97.21 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 123.774 0.83 . . . . 0.0 112.875 176.286 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 32.2 mmmt -82.87 -9.07 59.49 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 124.878 1.271 . . . . 0.0 113.845 179.589 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 80.84 38.18 17.01 Favored Glycine 0 CA--C 1.537 1.463 0 C-N-CA 124.722 1.154 . . . . 0.0 114.103 179.571 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 50.3 ttp180 -120.75 -19.47 7.35 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 126.631 1.972 . . . . 0.0 114.83 -176.525 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 4.8 t -69.23 148.67 49.51 Favored 'General case' 0 CA--C 1.546 0.796 0 CA-C-N 119.311 0.96 . . . . 0.0 113.562 -177.789 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 86.6 p -156.38 7.58 0.2 Allowed 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 126.777 2.031 . . . . 0.0 113.438 179.562 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 76.3 mtm-85 -68.93 161.25 29.2 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 126.01 1.724 . . . . 0.0 114.077 -178.076 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -117.81 -1.73 11.49 Favored 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 125.926 1.691 . . . . 0.0 112.081 176.016 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 14.8 m120 -142.92 39.19 1.47 Allowed 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 128.496 2.719 . . . . 0.0 109.49 179.161 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 7.9 t -54.11 126.49 22.96 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 124.777 1.231 . . . . 0.0 111.465 -177.968 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 25.7 mtmt -80.46 0.78 32.03 Favored 'General case' 0 N--CA 1.474 0.771 0 N-CA-C 114.007 1.114 . . . . 0.0 114.007 -177.532 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 80.8 m-85 -125.58 154.35 42.36 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 125.127 1.371 . . . . 0.0 111.394 -175.127 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -76.69 113.15 14.02 Favored 'General case' 0 CA--C 1.533 0.312 0 O-C-N 121.654 -0.654 . . . . 0.0 112.265 -176.258 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 8.3 m170 -64.49 127.08 91.9 Favored Pre-proline 0 CA--C 1.545 0.768 0 N-CA-C 106.892 -1.521 . . . . 0.0 106.892 172.48 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 89.7 Cg_endo -72.97 120.73 6.79 Favored 'Trans proline' 0 CA--C 1.546 1.075 0 C-N-CA 122.401 2.067 . . . . 0.0 114.06 -170.757 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 94.3 Cg_endo -77.05 153.41 32.31 Favored 'Trans proline' 0 CA--C 1.544 1.001 0 C-N-CA 123.206 2.604 . . . . 0.0 111.973 178.297 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_exo -46.27 -41.45 22.28 Favored 'Trans proline' 0 CA--C 1.538 0.706 0 C-N-CA 124.156 3.237 . . . . 0.0 115.753 179.449 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 57.3 m80 -72.4 -13.7 61.52 Favored 'General case' 0 N--CA 1.475 0.805 0 N-CA-C 115.181 1.548 . . . . 0.0 115.181 179.605 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 92.1 mt -114.13 -17.21 11.96 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 124.426 1.091 . . . . 0.0 112.949 177.565 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 56.0 mtpt -54.89 -38.91 68.16 Favored 'General case' 0 N--CA 1.478 0.944 0 CA-C-N 119.931 1.241 . . . . 0.0 111.85 174.944 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 4.7 m -63.02 -38.51 91.48 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 123.728 0.811 . . . . 0.0 111.777 176.753 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 92.5 mm-40 -69.95 -49.57 50.49 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 123.175 0.59 . . . . 0.0 109.721 177.638 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 95.4 mt -58.47 -47.04 85.37 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 124.134 0.974 . . . . 0.0 113.056 178.767 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -62.97 -32.25 73.54 Favored 'General case' 0 N--CA 1.475 0.811 0 CA-C-N 119.932 1.242 . . . . 0.0 112.444 178.759 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 57.0 mt -74.73 -42.58 47.63 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.584 0 C-N-CA 123.858 0.863 . . . . 0.0 110.269 175.783 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 26.5 m120 -60.64 -36.17 78.01 Favored 'General case' 0 CA--C 1.543 0.692 0 CA-C-N 119.406 1.003 . . . . 0.0 110.423 174.75 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -57.17 -26.98 57.0 Favored Glycine 0 CA--C 1.535 1.295 0 C-N-CA 125.18 1.371 . . . . 0.0 113.643 176.56 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -60.31 -27.13 67.06 Favored 'General case' 0 N--CA 1.479 0.985 0 CA-C-N 118.633 1.216 . . . . 0.0 112.124 175.774 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 8.8 t-20 -80.17 -1.7 41.52 Favored 'General case' 0 CA--C 1.554 1.108 0 C-N-CA 125.419 1.488 . . . . 0.0 113.022 175.789 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 39.8 t30 -130.85 8.37 4.83 Favored 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 126.157 1.783 . . . . 0.0 112.679 179.978 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 15.3 tp -75.88 37.77 0.15 Allowed 'General case' 0 CA--C 1.552 1.055 0 C-N-CA 126.353 1.861 . . . . 0.0 113.406 -178.86 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 43.3 pt -77.58 -2.84 4.95 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.944 0 C-N-CA 126.069 1.748 . . . . 0.0 113.928 -179.779 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 87.7 mt-30 -138.27 165.24 27.22 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 126.591 1.956 . . . . 0.0 110.983 178.694 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 8.5 pt20 -55.06 142.21 31.31 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 124.977 1.311 . . . . 0.0 113.954 -179.542 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.21 -2.84 26.54 Favored 'General case' 0 N--CA 1.483 1.188 0 N-CA-C 115.3 1.593 . . . . 0.0 115.3 179.122 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 59.1 t-20 . . . . . 0 CA--C 1.545 0.763 0 C-N-CA 127.996 2.519 . . . . 0.0 114.677 -179.183 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.6 mmt . . . . . 0 CA--C 1.545 0.751 0 N-CA-C 113.433 0.901 . . . . 0.0 113.433 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -151.32 170.95 18.27 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 126.175 1.79 . . . . 0.0 111.81 179.843 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 48.1 t -136.0 136.42 49.71 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.928 0 C-N-CA 125.46 1.504 . . . . 0.0 109.725 179.29 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 9.5 t -154.96 -174.45 4.99 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 125.736 1.614 . . . . 0.0 110.774 179.718 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 6.5 p -71.44 23.75 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.482 1.155 0 C-N-CA 127.715 2.406 . . . . 0.0 114.685 -179.83 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 27.3 p -59.91 154.67 47.34 Favored Pre-proline 0 N--CA 1.479 1.006 0 C-N-CA 126.275 1.83 . . . . 0.0 113.225 178.723 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 47.0 Cg_endo -63.47 140.18 74.55 Favored 'Trans proline' 0 CA--C 1.54 0.796 0 C-N-CA 122.715 2.276 . . . . 0.0 112.243 179.321 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 8.9 tp -156.07 166.72 0.93 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.829 0 C-N-CA 126.451 1.9 . . . . 0.0 110.131 -179.111 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 11.7 tpt85 -58.68 146.29 36.96 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 124.242 1.017 . . . . 0.0 111.434 178.136 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -51.31 -71.55 0.06 Allowed 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 126.553 1.941 . . . . 0.0 115.697 -174.636 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 73.8 p -147.77 4.28 0.75 Allowed 'General case' 0 N--CA 1.486 1.341 0 N-CA-C 115.535 1.68 . . . . 0.0 115.535 -174.196 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 49.8 tttm -45.08 -29.36 0.87 Allowed 'General case' 0 N--CA 1.484 1.226 0 N-CA-C 117.405 2.372 . . . . 0.0 117.405 -174.85 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 2.5 p90 -112.39 1.07 15.84 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 124.89 1.276 . . . . 0.0 114.308 -179.337 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 94.8 mt -105.03 -10.13 17.4 Favored 'General case' 0 CA--C 1.539 0.522 0 N-CA-C 116.269 1.952 . . . . 0.0 116.269 -172.263 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 4.0 m -75.01 79.7 2.2 Favored 'General case' 0 N--CA 1.479 1.015 0 CA-C-N 120.474 1.488 . . . . 0.0 112.208 -179.044 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -75.68 144.59 41.53 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 127.066 2.146 . . . . 0.0 112.41 -177.908 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 10.3 mt-10 -74.89 150.96 38.99 Favored 'General case' 0 N--CA 1.474 0.771 0 O-C-N 120.688 -1.258 . . . . 0.0 111.916 176.577 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 15.9 m -82.06 150.89 4.3 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.795 0 N-CA-C 109.816 -0.439 . . . . 0.0 109.816 174.362 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 53.5 t -63.82 130.7 45.23 Favored 'General case' 0 C--O 1.237 0.43 0 CA-C-O 122.552 1.168 . . . . 0.0 111.349 177.671 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 3.3 mpt_? -68.45 -25.3 64.93 Favored 'General case' 0 N--CA 1.465 0.296 0 C-N-CA 124.716 1.207 . . . . 0.0 112.244 -178.582 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -84.21 -37.61 21.6 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 123.125 0.57 . . . . 0.0 110.017 177.303 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 63.5 t80 -62.0 -31.24 71.6 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 124.823 1.249 . . . . 0.0 110.884 174.982 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 12.4 mm100 -62.98 -15.81 57.44 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 123.928 0.891 . . . . 0.0 113.294 175.264 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 6.2 mpt_? -120.32 13.4 11.91 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 126.605 1.962 . . . . 0.0 111.464 177.058 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 57.96 35.82 77.84 Favored Glycine 0 CA--C 1.533 1.197 0 C-N-CA 125.396 1.474 . . . . 0.0 114.375 179.888 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 6.4 t -131.13 11.04 5.0 Favored 'General case' 0 N--CA 1.477 0.91 0 N-CA-C 115.128 1.529 . . . . 0.0 115.128 -175.527 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 44.3 t -60.7 136.57 58.11 Favored 'General case' 0 CA--C 1.548 0.891 0 CA-C-N 119.091 0.86 . . . . 0.0 110.523 176.078 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 80.2 p -93.01 6.37 48.15 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 125.541 1.537 . . . . 0.0 114.394 -178.235 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 57.2 mtm-85 -129.64 151.49 78.14 Favored Pre-proline 0 N--CA 1.474 0.76 0 C-N-CA 125.253 1.421 . . . . 0.0 113.795 -173.946 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 95.1 Cg_endo -74.59 163.88 35.01 Favored 'Trans proline' 0 CA--C 1.542 0.88 0 C-N-CA 122.429 2.086 . . . . 0.0 109.419 172.338 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 -54.62 -28.11 44.29 Favored 'General case' 0 N--CA 1.475 0.821 0 N-CA-C 113.407 0.891 . . . . 0.0 113.407 176.477 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 22.1 p -73.85 -17.43 61.06 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 125.57 1.548 . . . . 0.0 115.126 178.948 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -115.65 -31.08 5.96 Favored 'General case' 0 N--CA 1.478 0.939 0 N-CA-C 114.295 1.22 . . . . 0.0 114.295 -179.277 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 4.7 t -56.77 147.11 23.91 Favored 'General case' 0 CA--C 1.545 0.756 0 CA-C-O 122.735 1.255 . . . . 0.0 113.887 -175.63 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 39.6 mmtm -81.88 4.83 20.92 Favored 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 126.475 1.91 . . . . 0.0 113.145 -177.706 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 75.6 m-85 -143.76 170.18 16.35 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 128.633 2.773 . . . . 0.0 108.631 175.913 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -84.24 153.53 23.55 Favored 'General case' 0 CA--C 1.547 0.863 0 N-CA-C 114.526 1.306 . . . . 0.0 114.526 -177.048 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 65.0 m170 -124.58 90.66 50.61 Favored Pre-proline 0 CA--C 1.55 0.943 0 C-N-CA 126.203 1.801 . . . . 0.0 110.361 178.048 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 34.7 Cg_endo -64.0 148.53 91.56 Favored 'Trans proline' 0 CA--C 1.539 0.754 0 C-N-CA 123.31 2.674 . . . . 0.0 114.483 -177.535 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 52.9 p -86.72 -175.88 5.58 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 125.114 1.366 . . . . 0.0 112.228 175.847 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 58.0 mtmt -60.72 -20.04 60.2 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 125.556 1.542 . . . . 0.0 113.472 173.645 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 49.1 m -109.11 -20.81 12.87 Favored 'General case' 0 N--CA 1.477 0.897 0 N-CA-C 114.436 1.273 . . . . 0.0 114.436 -179.594 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 84.5 m -63.94 134.87 55.89 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 119.498 1.044 . . . . 0.0 113.193 179.878 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 35.7 mt-30 -81.45 142.1 33.27 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 123.181 0.592 . . . . 0.0 111.253 176.669 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 11.8 t -132.34 138.16 52.87 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.865 0 C-N-CA 125.404 1.481 . . . . 0.0 110.573 -177.748 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -146.21 132.66 19.68 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 125.298 1.439 . . . . 0.0 111.391 178.194 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 62.5 t30 41.26 37.94 0.7 Allowed 'General case' 0 CA--C 1.553 1.073 0 C-N-CA 126.99 2.116 . . . . 0.0 116.578 177.16 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 87.77 13.73 64.32 Favored Glycine 0 CA--C 1.535 1.335 0 O-C-N 120.997 -1.064 . . . . 0.0 115.188 179.777 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 56.0 mtt180 -136.56 164.16 28.85 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 125.421 1.488 . . . . 0.0 111.432 179.39 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 5.2 m -134.34 176.81 8.0 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 C-N-CA 129.127 2.971 . . . . 0.0 107.493 179.623 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 59.1 mt -126.71 130.07 71.57 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.833 0 CA-C-N 119.78 1.173 . . . . 0.0 108.786 179.589 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -73.04 147.62 44.89 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 123.758 0.823 . . . . 0.0 111.931 177.873 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 13.9 t -69.75 99.37 1.34 Allowed 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 125.067 1.347 . . . . 0.0 113.35 -176.432 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 26.4 p90 -61.92 -37.94 86.56 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 115.191 -0.913 . . . . 0.0 110.013 174.34 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 70.3 m-20 -61.44 -43.09 99.47 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 123.099 0.559 . . . . 0.0 110.851 177.193 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 44.6 t -64.66 -43.23 94.26 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-N 119.506 1.048 . . . . 0.0 111.566 177.911 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 34.3 mt -65.39 -36.99 85.65 Favored 'General case' 0 CA--C 1.542 0.665 0 N-CA-C 113.378 0.881 . . . . 0.0 113.378 177.124 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 29.7 mmmt -88.17 -5.62 58.32 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 125.197 1.399 . . . . 0.0 114.509 -178.32 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 81.02 39.84 12.48 Favored Glycine 0 CA--C 1.536 1.38 0 C-N-CA 124.506 1.05 . . . . 0.0 114.384 178.221 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 71.9 ttt-85 -123.64 -21.52 5.21 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 126.546 1.939 . . . . 0.0 114.695 -176.63 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 5.5 t -73.06 136.29 44.96 Favored 'General case' 0 CA--C 1.545 0.765 0 CA-C-N 119.431 1.014 . . . . 0.0 113.387 -177.396 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 58.3 m -145.38 11.79 1.32 Allowed 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 127.12 2.168 . . . . 0.0 112.066 178.343 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 81.3 mtm-85 -70.24 160.01 32.96 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 125.888 1.675 . . . . 0.0 114.265 -177.608 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -114.16 -9.35 12.91 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 127.843 2.457 . . . . 0.0 112.507 177.731 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 10.8 m120 -142.47 41.09 1.6 Allowed 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 128.155 2.582 . . . . 0.0 109.857 -179.614 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 9.0 t -53.07 129.07 29.7 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 124.774 1.23 . . . . 0.0 111.607 -178.367 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 31.8 mtmt -84.17 2.33 40.21 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 124.62 1.168 . . . . 0.0 113.63 -177.87 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 84.4 m-85 -125.08 154.36 41.5 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 125.384 1.473 . . . . 0.0 111.908 -175.521 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -78.07 114.72 17.22 Favored 'General case' 0 N--CA 1.465 0.318 0 C-N-CA 123.989 0.915 . . . . 0.0 112.155 -176.619 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 11.0 m170 -70.2 115.17 31.73 Favored Pre-proline 0 CA--C 1.546 0.8 0 N-CA-C 108.094 -1.076 . . . . 0.0 108.094 174.654 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 81.1 Cg_exo -48.89 114.07 1.12 Allowed 'Trans proline' 0 CA--C 1.543 0.928 0 C-N-CA 124.621 3.547 . . . . 0.0 116.794 -174.757 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_endo -77.02 155.78 33.9 Favored 'Trans proline' 0 CA--C 1.546 1.114 0 C-N-CA 122.658 2.238 . . . . 0.0 111.479 175.965 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 92.9 Cg_exo -43.58 -45.79 10.44 Favored 'Trans proline' 0 CA--C 1.539 0.73 0 C-N-CA 124.861 3.707 . . . . 0.0 116.531 -179.777 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -73.53 -12.61 60.83 Favored 'General case' 0 N--CA 1.478 0.971 0 N-CA-C 114.676 1.362 . . . . 0.0 114.676 -179.431 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 87.0 mt -112.64 -19.56 12.02 Favored 'General case' 0 N--CA 1.475 0.789 0 CA-C-N 119.458 1.026 . . . . 0.0 113.71 -179.717 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 54.3 mtpt -52.69 -39.66 62.17 Favored 'General case' 0 N--CA 1.48 1.035 0 CA-C-N 119.908 1.231 . . . . 0.0 111.426 174.252 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 24.7 m -63.19 -41.59 99.21 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 124.781 1.232 . . . . 0.0 111.92 176.926 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 16.9 mm100 -68.57 -44.39 74.54 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 123.56 0.744 . . . . 0.0 110.521 179.206 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 81.0 mt -62.31 -46.63 87.89 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 123.376 0.67 . . . . 0.0 112.235 177.769 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -64.21 -29.78 70.87 Favored 'General case' 0 N--CA 1.476 0.854 0 CA-C-N 120.361 1.437 . . . . 0.0 113.106 178.147 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 63.9 mt -71.15 -44.88 73.77 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.69 0 O-C-N 121.354 -0.841 . . . . 0.0 109.242 174.854 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 75.7 m-20 -62.15 -36.72 82.68 Favored 'General case' 0 CA--C 1.542 0.639 0 O-C-N 121.644 -0.66 . . . . 0.0 110.955 175.773 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -61.01 -49.28 80.36 Favored Glycine 0 CA--C 1.529 0.93 0 C-N-CA 124.513 1.054 . . . . 0.0 111.494 177.95 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 82.6 mtt85 -57.81 -43.02 85.42 Favored 'General case' 0 N--CA 1.481 1.078 0 CA-C-N 118.063 0.931 . . . . 0.0 111.559 175.334 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 55.9 t30 -64.5 -7.73 11.2 Favored 'General case' 0 CA--C 1.553 1.071 0 C-N-CA 124.959 1.304 . . . . 0.0 114.027 177.271 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 61.1 m-80 -125.28 12.46 8.2 Favored 'General case' 0 CA--C 1.551 1.003 0 C-N-CA 126.507 1.923 . . . . 0.0 112.38 178.771 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 18.7 tp -130.48 21.76 5.15 Favored 'General case' 0 CA--C 1.55 0.971 0 C-N-CA 126.714 2.005 . . . . 0.0 111.082 179.549 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 75.2 mt -57.32 123.98 10.06 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.535 0 C-N-CA 126.814 2.045 . . . . 0.0 109.71 179.719 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 3.6 tp-100 -110.74 2.83 18.66 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 125.091 1.356 . . . . 0.0 114.057 -175.728 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 89.9 mm-40 -60.72 -9.89 4.61 Favored 'General case' 0 N--CA 1.477 0.897 0 N-CA-C 115.963 1.838 . . . . 0.0 115.963 -178.895 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 65.6 pttt -121.8 11.96 10.5 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 125.777 1.631 . . . . 0.0 114.397 -179.637 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 45.7 t30 . . . . . 0 CA--C 1.545 0.767 0 C-N-CA 124.793 1.237 . . . . 0.0 112.855 179.552 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.0 mmt . . . . . 0 CA--C 1.54 0.592 0 N-CA-C 113.485 0.92 . . . . 0.0 113.485 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -55.7 -10.73 0.76 Allowed 'General case' 0 CA--C 1.552 1.046 0 N-CA-C 116.276 1.954 . . . . 0.0 116.276 -179.341 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 8.2 p -127.63 8.68 3.28 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.976 0 C-N-CA 126.372 1.869 . . . . 0.0 112.329 179.166 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 37.0 m -133.35 -20.05 2.13 Favored 'General case' 0 N--CA 1.479 0.977 0 N-CA-C 114.881 1.438 . . . . 0.0 114.881 -178.031 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 9.3 p -66.32 145.04 14.15 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.892 0 C-N-CA 124.364 1.066 . . . . 0.0 112.063 179.0 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 41.5 p -143.23 151.21 54.65 Favored Pre-proline 0 N--CA 1.478 0.968 0 C-N-CA 125.741 1.616 . . . . 0.0 110.866 178.986 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 70.6 Cg_endo -78.97 -12.7 14.52 Favored 'Trans proline' 0 CA--C 1.542 0.896 0 C-N-CA 123.358 2.705 . . . . 0.0 115.176 -177.554 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 43.8 pt -77.83 176.53 0.66 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 C-N-CA 125.713 1.605 . . . . 0.0 113.635 -177.797 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 41.3 ptt180 -55.56 155.91 5.13 Favored 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 125.387 1.475 . . . . 0.0 113.225 177.832 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -145.49 145.5 31.09 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 124.263 1.025 . . . . 0.0 112.807 -177.528 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 28.9 p -134.41 -5.81 2.59 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 125.19 1.396 . . . . 0.0 113.129 174.613 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 24.5 pttm -64.58 -31.91 73.34 Favored 'General case' 0 N--CA 1.477 0.884 0 CA-C-N 120.695 1.588 . . . . 0.0 111.932 175.56 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -64.92 -31.33 72.51 Favored 'General case' 0 N--CA 1.476 0.858 0 CA-C-N 118.651 0.66 . . . . 0.0 111.29 172.397 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 92.5 mt -89.76 -8.45 52.17 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 126.615 1.966 . . . . 0.0 114.268 -179.146 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 18.2 m -81.15 80.52 7.59 Favored 'General case' 0 N--CA 1.475 0.781 0 CA-C-O 122.13 0.966 . . . . 0.0 110.477 -178.625 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -75.77 145.21 40.95 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 128.613 2.765 . . . . 0.0 111.983 -178.232 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 52.8 mt-10 -72.33 150.99 43.02 Favored 'General case' 0 N--CA 1.47 0.564 0 O-C-N 120.487 -1.383 . . . . 0.0 112.615 176.899 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 16.8 m -86.69 156.49 3.3 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.971 0 C-N-CA 123.506 0.723 . . . . 0.0 111.418 174.359 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 49.1 t -77.66 129.69 35.88 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-O 121.607 0.718 . . . . 0.0 110.649 177.238 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 4.2 mpt_? -66.64 -28.99 68.92 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 124.418 1.087 . . . . 0.0 113.247 -177.462 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -78.13 -40.21 38.83 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 123.443 0.697 . . . . 0.0 109.518 177.79 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 64.3 t80 -63.24 -35.07 79.11 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 124.486 1.115 . . . . 0.0 111.298 175.957 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 13.8 mm100 -62.12 -15.31 44.65 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 124.227 1.011 . . . . 0.0 113.38 175.424 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 11.8 mtp-105 -120.76 12.67 11.41 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 127.233 2.213 . . . . 0.0 112.28 179.569 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 57.99 34.69 73.15 Favored Glycine 0 CA--C 1.536 1.354 0 C-N-CA 125.086 1.327 . . . . 0.0 113.9 -179.771 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 7.3 t -129.88 13.36 5.8 Favored 'General case' 0 N--CA 1.475 0.801 0 N-CA-C 114.906 1.447 . . . . 0.0 114.906 -175.196 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 6.5 t -69.53 171.7 8.45 Favored 'General case' 0 CA--C 1.556 1.182 0 O-C-N 121.413 -0.804 . . . . 0.0 110.542 173.823 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 50.7 m -135.45 13.57 3.49 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 125.059 1.344 . . . . 0.0 114.457 -176.796 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 51.0 mtt85 -135.45 145.97 55.81 Favored Pre-proline 0 N--CA 1.47 0.553 0 C-N-CA 125.301 1.44 . . . . 0.0 112.756 -176.349 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_endo -69.69 165.34 31.21 Favored 'Trans proline' 0 CA--C 1.545 1.06 0 C-N-CA 121.943 1.762 . . . . 0.0 109.744 171.323 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -54.6 -30.25 54.09 Favored 'General case' 0 N--CA 1.477 0.91 0 O-C-N 121.124 -0.985 . . . . 0.0 112.678 177.882 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 29.9 p -72.37 -8.43 54.93 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 126.268 1.827 . . . . 0.0 115.135 177.792 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 27.0 mm-40 -124.61 -24.86 4.1 Favored 'General case' 0 N--CA 1.476 0.868 0 N-CA-C 115.53 1.678 . . . . 0.0 115.53 -175.993 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 1.4 t -73.45 170.33 15.34 Favored 'General case' 0 CA--C 1.545 0.753 0 N-CA-C 115.361 1.615 . . . . 0.0 115.361 -175.921 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 13.0 mmmm -85.24 -13.16 50.74 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 126.807 2.043 . . . . 0.0 113.285 -179.377 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 56.7 m-85 -140.02 174.86 10.09 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 126.761 2.025 . . . . 0.0 109.598 179.001 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -83.65 151.04 25.51 Favored 'General case' 0 CA--C 1.545 0.784 0 N-CA-C 114.177 1.177 . . . . 0.0 114.177 -177.034 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 64.2 m170 -121.86 87.27 46.59 Favored Pre-proline 0 CA--C 1.553 1.068 0 C-N-CA 126.158 1.783 . . . . 0.0 110.888 179.572 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 39.5 Cg_endo -64.4 150.54 88.08 Favored 'Trans proline' 0 CA--C 1.54 0.808 0 C-N-CA 123.568 2.845 . . . . 0.0 114.912 -177.797 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 53.4 p -88.01 -174.93 4.9 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 124.945 1.298 . . . . 0.0 111.985 175.578 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 63.0 mttp -62.01 -18.67 61.28 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 125.523 1.529 . . . . 0.0 113.368 173.421 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 25.1 m -109.12 -22.4 12.14 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.917 1.287 . . . . 0.0 114.153 -179.079 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 89.6 m -63.58 138.35 58.47 Favored 'General case' 0 CA--C 1.542 0.651 0 CA-C-N 119.394 0.997 . . . . 0.0 113.175 179.586 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 16.3 mt-30 -80.66 136.2 36.17 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 124.663 1.185 . . . . 0.0 111.466 179.004 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 9.2 t -129.75 136.25 59.49 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.816 0 C-N-CA 124.958 1.303 . . . . 0.0 110.913 -178.084 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -146.99 131.8 18.01 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 125.286 1.435 . . . . 0.0 111.79 178.185 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 62.5 t30 39.46 39.3 0.47 Allowed 'General case' 0 CA--C 1.554 1.106 0 C-N-CA 127.28 2.232 . . . . 0.0 116.863 176.63 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 90.58 11.55 62.11 Favored Glycine 0 CA--C 1.536 1.374 0 O-C-N 121.101 -1.0 . . . . 0.0 115.393 179.465 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 42.1 mtm180 -136.17 164.9 26.98 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 125.53 1.532 . . . . 0.0 112.358 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 5.2 m -137.2 151.21 26.64 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.642 0 C-N-CA 128.12 2.568 . . . . 0.0 109.135 -179.93 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 17.2 mt -100.5 130.68 49.38 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.78 0 O-C-N 121.191 -0.943 . . . . 0.0 110.181 -178.306 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -78.31 149.79 33.41 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 123.946 0.898 . . . . 0.0 111.99 178.637 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 19.2 t -71.79 99.21 2.12 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 125.242 1.417 . . . . 0.0 113.039 -176.362 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 24.3 p90 -60.88 -36.83 80.21 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 123.574 0.75 . . . . 0.0 110.514 174.76 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 73.6 m-20 -61.3 -38.24 86.1 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 123.397 0.679 . . . . 0.0 111.199 177.338 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 31.2 p -64.72 -41.37 96.02 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 119.5 1.045 . . . . 0.0 112.216 178.058 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 38.5 mt -69.7 -40.74 76.13 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 124.575 1.15 . . . . 0.0 112.04 177.613 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 30.9 mmmt -76.31 -11.87 59.98 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 124.464 1.106 . . . . 0.0 113.71 178.482 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 78.5 35.75 31.96 Favored Glycine 0 CA--C 1.537 1.457 0 C-N-CA 124.563 1.078 . . . . 0.0 113.43 -179.508 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 50.8 ttp180 -116.66 -19.85 9.8 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 126.623 1.969 . . . . 0.0 114.378 -176.67 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 5.1 t -67.92 140.85 56.48 Favored 'General case' 0 CA--C 1.545 0.784 0 CA-C-N 119.078 0.854 . . . . 0.0 112.949 -177.879 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 87.6 p -152.4 8.92 0.47 Allowed 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 126.709 2.004 . . . . 0.0 113.056 179.715 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 87.3 mtm-85 -67.84 163.37 22.02 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 126.393 1.877 . . . . 0.0 114.65 -178.216 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -125.38 8.55 7.8 Favored 'General case' 0 CA--C 1.553 1.095 0 C-N-CA 126.916 2.086 . . . . 0.0 110.526 173.64 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 35.6 p-10 -142.76 22.73 1.95 Allowed 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 129.311 3.045 . . . . 0.0 112.15 -177.843 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 4.2 t -49.54 120.01 3.85 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 125.228 1.411 . . . . 0.0 112.518 -175.723 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 33.8 mtmt -84.88 6.97 22.61 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 125.556 1.542 . . . . 0.0 113.636 -177.399 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 84.8 m-85 -129.14 151.88 49.33 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 125.192 1.397 . . . . 0.0 112.258 -174.589 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -77.2 118.61 19.88 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 123.723 0.809 . . . . 0.0 112.096 -176.992 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 11.2 m170 -71.4 115.91 41.96 Favored Pre-proline 0 CA--C 1.548 0.876 0 N-CA-C 108.045 -1.094 . . . . 0.0 108.045 174.381 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_exo -47.3 112.18 0.5 Allowed 'Trans proline' 0 CA--C 1.543 0.969 0 C-N-CA 125.015 3.81 . . . . 0.0 115.507 -176.231 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -75.68 148.82 33.19 Favored 'Trans proline' 0 CA--C 1.542 0.887 0 C-N-CA 122.052 1.835 . . . . 0.0 110.366 176.866 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_exo -47.32 -37.64 25.1 Favored 'Trans proline' 0 CA--C 1.539 0.748 0 C-N-CA 123.723 2.949 . . . . 0.0 115.193 179.433 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 6.8 t-80 -72.04 -16.94 62.05 Favored 'General case' 0 N--CA 1.472 0.659 0 N-CA-C 115.177 1.547 . . . . 0.0 115.177 179.778 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 90.9 mt -115.22 -15.78 11.6 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 124.735 1.214 . . . . 0.0 112.898 177.791 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 52.9 mtpt -53.98 -34.36 59.58 Favored 'General case' 0 N--CA 1.475 0.78 0 CA-C-N 119.662 1.119 . . . . 0.0 111.384 174.37 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 27.5 m -61.82 -47.13 86.47 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-N 118.723 0.692 . . . . 0.0 111.462 175.381 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 93.3 mm-40 -66.23 -43.56 86.28 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 123.772 0.829 . . . . 0.0 111.316 178.04 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 76.3 mt -62.53 -45.49 92.75 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 123.896 0.879 . . . . 0.0 111.984 178.085 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 5.3 pt-20 -66.11 -36.48 83.27 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-N 119.459 1.027 . . . . 0.0 112.153 177.859 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 51.2 mt -61.11 -39.84 83.75 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 CA-C-N 119.509 1.05 . . . . 0.0 110.386 177.193 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 29.4 m-80 -70.76 -43.5 68.66 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 123.216 0.606 . . . . 0.0 111.4 175.436 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -66.14 -40.82 95.12 Favored Glycine 0 CA--C 1.533 1.179 0 C-N-CA 124.242 0.925 . . . . 0.0 113.71 -179.665 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 53.2 mtp180 -60.9 -17.18 49.22 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 125.742 1.617 . . . . 0.0 113.47 176.586 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 63.9 t30 -107.92 14.13 25.6 Favored 'General case' 0 CA--C 1.554 1.108 0 C-N-CA 125.881 1.672 . . . . 0.0 111.96 177.578 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 25.2 t-20 -136.63 -35.87 0.72 Allowed 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 125.811 1.644 . . . . 0.0 113.863 -176.15 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 87.5 mt -74.33 62.26 0.95 Allowed 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 127.029 2.132 . . . . 0.0 112.678 179.708 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 25.2 pt -135.82 144.41 33.62 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.62 0 C-N-CA 126.645 1.978 . . . . 0.0 110.681 -179.411 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -158.63 159.51 35.49 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 125.248 1.419 . . . . 0.0 112.029 -178.108 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 87.5 mt-30 -60.77 -24.74 65.99 Favored 'General case' 0 N--CA 1.478 0.955 0 N-CA-C 113.816 1.043 . . . . 0.0 113.816 179.222 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 75.2 mmtt -81.01 7.28 11.15 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 126.168 1.787 . . . . 0.0 113.732 178.329 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 49.6 t-20 . . . . . 0 CA--C 1.542 0.649 0 C-N-CA 125.879 1.671 . . . . 0.0 112.446 -176.056 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 95.5 mmm . . . . . 0 CA--C 1.542 0.67 0 N-CA-C 113.339 0.866 . . . . 0.0 113.339 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -57.56 -24.91 58.8 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 125.008 1.323 . . . . 0.0 114.217 -179.896 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 7.8 p -62.78 -22.86 31.32 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 C-N-CA 125.013 1.325 . . . . 0.0 113.632 178.339 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 50.1 m -71.34 -7.82 49.66 Favored 'General case' 0 N--CA 1.475 0.783 0 N-CA-C 116.12 1.896 . . . . 0.0 116.12 -178.073 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 35.0 m -64.34 156.49 5.42 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.156 0 CA-C-N 119.89 1.223 . . . . 0.0 113.12 179.406 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 7.4 p -68.72 150.73 97.56 Favored Pre-proline 0 N--CA 1.475 0.817 0 C-N-CA 124.178 0.991 . . . . 0.0 112.506 177.516 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 93.0 Cg_endo -74.79 166.14 29.94 Favored 'Trans proline' 0 CA--C 1.541 0.87 0 C-N-CA 123.301 2.667 . . . . 0.0 112.549 179.08 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 44.7 pt -107.77 10.15 9.17 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.121 0 C-N-CA 125.292 1.437 . . . . 0.0 113.02 178.828 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 33.9 ttm180 -60.87 -22.58 64.42 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 126.359 1.864 . . . . 0.0 113.93 179.236 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 55.5 t0 -73.52 68.34 1.15 Allowed 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 125.887 1.675 . . . . 0.0 112.594 178.76 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 22.3 p -64.49 0.37 1.08 Allowed 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 126.181 1.792 . . . . 0.0 115.138 -179.737 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 1.6 ttmp? -47.7 -42.71 25.66 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 125.704 1.601 . . . . 0.0 112.668 178.377 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -72.86 -27.88 62.18 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 124.359 1.064 . . . . 0.0 113.814 179.686 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 82.6 mt -91.77 -16.6 26.6 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 127.021 2.128 . . . . 0.0 114.994 -176.998 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 7.0 m -77.41 77.14 3.94 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 124.314 1.046 . . . . 0.0 111.543 -177.096 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.442 HD21 HD13 ' A' ' 75' ' ' LEU . 13.0 tp -75.62 143.76 42.11 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 128.757 2.823 . . . . 0.0 112.007 -178.375 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 10.1 mt-10 -73.32 150.5 41.85 Favored 'General case' 0 N--CA 1.474 0.743 0 O-C-N 120.448 -1.407 . . . . 0.0 112.886 178.788 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 16.0 m -84.48 154.66 3.62 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.838 0 C-N-CA 122.805 0.442 . . . . 0.0 111.673 176.256 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 44.8 t -74.98 131.02 40.35 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-O 121.192 0.52 . . . . 0.0 109.829 175.316 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 4.5 mpt_? -68.29 -37.34 80.55 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 125.623 1.569 . . . . 0.0 112.976 -176.836 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 15.9 mm-40 -76.65 -33.54 58.31 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 123.848 0.859 . . . . 0.0 111.151 179.334 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 78.3 t80 -63.3 -27.79 69.57 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 123.964 0.906 . . . . 0.0 111.287 174.923 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 52.9 mm-40 -63.59 -19.6 64.97 Favored 'General case' 0 N--CA 1.476 0.858 0 N-CA-C 112.855 0.687 . . . . 0.0 112.855 175.307 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 6.7 mpt_? -111.85 10.67 20.76 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 126.404 1.882 . . . . 0.0 111.645 177.008 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 58.05 36.34 80.97 Favored Glycine 0 CA--C 1.534 1.26 0 C-N-CA 125.542 1.544 . . . . 0.0 114.216 -179.879 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 6.1 t -132.54 13.46 4.51 Favored 'General case' 0 N--CA 1.479 0.983 0 N-CA-C 115.143 1.534 . . . . 0.0 115.143 -175.031 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 39.6 t -59.9 131.77 51.88 Favored 'General case' 0 CA--C 1.55 0.967 0 O-C-N 121.379 -0.825 . . . . 0.0 111.157 176.984 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 21.8 m -73.95 1.89 9.81 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 125.985 1.714 . . . . 0.0 115.217 -177.347 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 63.4 mtm-85 -132.49 148.67 70.55 Favored Pre-proline 0 N--CA 1.474 0.75 0 C-N-CA 125.657 1.583 . . . . 0.0 112.867 -175.466 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -67.81 162.21 40.54 Favored 'Trans proline' 0 CA--C 1.542 0.923 0 C-N-CA 121.92 1.747 . . . . 0.0 109.425 171.674 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 17.2 m-20 -53.45 -25.44 16.1 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 125.025 1.33 . . . . 0.0 114.205 -177.437 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 16.8 p -83.84 -12.75 55.12 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 127.342 2.257 . . . . 0.0 115.317 178.855 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 16.2 mt-10 -111.5 -22.77 11.1 Favored 'General case' 0 N--CA 1.478 0.943 0 N-CA-C 115.291 1.589 . . . . 0.0 115.291 -176.835 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 3.8 t -66.92 164.85 16.63 Favored 'General case' 0 CA--C 1.545 0.769 0 N-CA-C 114.059 1.133 . . . . 0.0 114.059 -178.571 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 44.1 mmtm -100.58 6.66 44.22 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 126.541 1.937 . . . . 0.0 113.6 -176.94 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 51.9 m-85 -141.3 167.57 21.86 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 127.64 2.376 . . . . 0.0 108.448 173.503 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -80.08 148.04 31.19 Favored 'General case' 0 CA--C 1.544 0.75 0 O-C-N 120.94 -1.1 . . . . 0.0 113.584 -176.372 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 20.6 m170 -120.27 87.86 40.79 Favored Pre-proline 0 CA--C 1.554 1.097 0 C-N-CA 125.79 1.636 . . . . 0.0 110.563 -179.366 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -59.67 146.08 96.35 Favored 'Trans proline' 0 C--N 1.354 0.863 0 C-N-CA 123.442 2.761 . . . . 0.0 114.871 -178.032 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 48.1 p -82.86 -178.78 7.23 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 124.305 1.042 . . . . 0.0 112.474 175.942 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -59.8 -19.85 53.19 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 125.698 1.599 . . . . 0.0 113.599 173.934 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 51.8 m -109.23 -15.59 14.25 Favored 'General case' 0 N--CA 1.476 0.828 0 N-CA-C 114.888 1.44 . . . . 0.0 114.888 -179.259 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 78.8 m -65.67 159.52 24.76 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-N 119.896 1.225 . . . . 0.0 114.046 179.459 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 41.1 mt-30 -119.37 140.81 49.76 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 125.257 1.423 . . . . 0.0 111.063 178.15 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 1.1 m -131.79 149.87 33.29 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.576 0 C-N-CA 125.118 1.367 . . . . 0.0 112.546 -177.388 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 -144.59 139.13 27.92 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 125.929 1.692 . . . . 0.0 110.455 176.445 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 89.4 m-20 45.54 34.83 1.77 Allowed 'General case' 0 CA--C 1.554 1.124 0 N-CA-C 115.464 1.653 . . . . 0.0 115.464 176.18 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 81.07 19.81 66.41 Favored Glycine 0 CA--C 1.536 1.359 0 C-N-CA 124.243 0.925 . . . . 0.0 114.781 -179.363 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 44.3 mtt180 -137.33 160.83 37.94 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 125.145 1.378 . . . . 0.0 112.311 -179.067 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 3.3 m -137.41 142.63 36.39 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.648 0 C-N-CA 127.817 2.447 . . . . 0.0 109.972 -177.075 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 43.4 mt -91.26 126.34 43.94 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.567 0 O-C-N 121.386 -0.821 . . . . 0.0 109.871 -178.504 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -70.05 146.15 51.19 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 123.954 0.901 . . . . 0.0 111.334 177.689 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 29.4 t -67.08 100.22 0.74 Allowed 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 124.675 1.19 . . . . 0.0 112.244 -178.122 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 32.9 p90 -61.3 -37.8 84.51 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 115.017 -0.992 . . . . 0.0 110.017 175.557 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 70.9 m-20 -61.89 -44.63 96.41 Favored 'General case' 0 CA--C 1.539 0.55 0 O-C-N 121.8 -0.562 . . . . 0.0 110.475 176.746 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 43.3 t -63.57 -46.11 87.36 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 119.748 1.158 . . . . 0.0 111.247 177.763 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 34.4 mt -61.16 -40.75 95.02 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 124.059 0.944 . . . . 0.0 113.42 176.759 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 31.3 mmmt -81.23 -12.88 59.01 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 124.78 1.232 . . . . 0.0 113.746 179.297 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 85.66 38.08 9.07 Favored Glycine 0 CA--C 1.539 1.539 0 C-N-CA 124.681 1.134 . . . . 0.0 114.336 179.438 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 47.8 ttp180 -121.86 -20.76 6.28 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 126.716 2.006 . . . . 0.0 114.764 -176.705 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 5.0 t -68.43 147.25 52.32 Favored 'General case' 0 CA--C 1.544 0.742 0 CA-C-N 119.442 1.019 . . . . 0.0 113.349 -177.835 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 86.1 p -154.49 7.6 0.31 Allowed 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 126.738 2.015 . . . . 0.0 113.146 179.559 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 76.8 mtm-85 -69.56 161.71 29.02 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 126.126 1.77 . . . . 0.0 113.74 -178.451 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -119.46 -0.26 10.92 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 125.884 1.674 . . . . 0.0 112.136 176.219 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 17.8 m120 -143.54 37.06 1.33 Allowed 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 128.217 2.607 . . . . 0.0 109.831 179.28 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 7.8 t -54.0 128.71 31.57 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 125.049 1.339 . . . . 0.0 111.272 -178.42 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 27.0 mtmt -83.47 0.83 44.62 Favored 'General case' 0 N--CA 1.477 0.899 0 N-CA-C 113.731 1.011 . . . . 0.0 113.731 -177.856 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 84.7 m-85 -122.82 154.0 38.81 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 125.203 1.401 . . . . 0.0 111.438 -175.778 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -75.56 112.32 11.78 Favored 'General case' 0 CA--C 1.531 0.242 0 N-CA-C 113.513 0.931 . . . . 0.0 113.513 -175.548 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 12.0 m170 -69.05 117.36 51.04 Favored Pre-proline 0 CA--C 1.545 0.777 0 N-CA-C 105.111 -2.181 . . . . 0.0 105.111 169.972 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -71.41 132.51 20.84 Favored 'Trans proline' 0 CA--C 1.541 0.849 0 C-N-CA 121.821 1.68 . . . . 0.0 114.719 -169.948 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 86.7 Cg_endo -77.16 153.88 32.24 Favored 'Trans proline' 0 CA--C 1.544 0.979 0 C-N-CA 123.39 2.727 . . . . 0.0 111.501 178.18 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 98.6 Cg_exo -44.81 -39.96 14.25 Favored 'Trans proline' 0 CA--C 1.539 0.771 0 C-N-CA 124.561 3.507 . . . . 0.0 116.11 179.902 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 72.7 m80 -73.4 -14.38 61.26 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 115.138 1.533 . . . . 0.0 115.138 179.796 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.442 HD13 HD21 ' A' ' 16' ' ' LEU . 92.8 mt -116.04 -16.29 11.07 Favored 'General case' 0 N--CA 1.474 0.725 0 C-N-CA 124.817 1.247 . . . . 0.0 113.383 179.814 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 61.2 mtpt -54.5 -36.68 64.45 Favored 'General case' 0 N--CA 1.48 1.033 0 CA-C-N 119.572 1.078 . . . . 0.0 111.11 172.569 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 19.6 m -63.97 -42.73 97.16 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 124.644 1.178 . . . . 0.0 111.65 176.211 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 89.9 mm-40 -66.85 -43.73 82.85 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 123.543 0.737 . . . . 0.0 110.51 178.827 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 93.8 mt -63.32 -43.46 97.73 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-O 118.405 -0.807 . . . . 0.0 112.401 177.378 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -65.81 -35.81 81.73 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-N 120.339 1.427 . . . . 0.0 111.827 176.58 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 66.7 mt -62.48 -42.48 95.87 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.845 0 CA-C-N 119.034 0.834 . . . . 0.0 109.677 175.25 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 82.4 m-20 -63.92 -44.49 92.74 Favored 'General case' 0 CA--C 1.544 0.743 0 O-C-N 121.658 -0.651 . . . . 0.0 110.537 174.927 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -59.76 -45.61 95.46 Favored Glycine 0 CA--C 1.528 0.865 0 C-N-CA 125.328 1.442 . . . . 0.0 112.452 179.294 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 86.6 mtt-85 -58.42 -19.24 34.58 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 125.177 1.391 . . . . 0.0 113.389 175.843 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 53.9 m-80 -103.86 6.19 36.34 Favored 'General case' 0 CA--C 1.551 1.017 0 C-N-CA 125.976 1.711 . . . . 0.0 113.279 178.501 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 35.4 m-80 -129.88 -36.73 1.56 Allowed 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 125.374 1.47 . . . . 0.0 112.525 178.848 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 61.5 tp -59.09 -30.26 67.96 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 125.625 1.57 . . . . 0.0 112.525 177.482 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 1.6 pp -57.14 -7.08 0.49 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.878 0 C-N-CA 126.93 2.092 . . . . 0.0 115.648 178.475 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 39.3 mt-30 -67.21 -13.77 62.28 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 124.489 1.115 . . . . 0.0 113.1 176.348 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -73.4 -13.02 61.01 Favored 'General case' 0 CA--C 1.548 0.883 0 N-CA-C 114.142 1.164 . . . . 0.0 114.142 178.234 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 67.4 mttm -60.76 156.2 17.58 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 125.448 1.499 . . . . 0.0 112.864 178.625 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 43.5 t30 . . . . . 0 CA--C 1.542 0.666 0 C-N-CA 125.33 1.452 . . . . 0.0 111.468 179.413 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.7 mpp? . . . . . 0 CA--C 1.546 0.789 0 N-CA-C 113.198 0.814 . . . . 0.0 113.198 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -150.25 166.98 28.27 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 126.025 1.73 . . . . 0.0 111.993 179.65 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 28.2 m -140.16 163.17 24.15 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.998 0 C-N-CA 125.952 1.701 . . . . 0.0 111.594 179.542 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 40.6 m -144.24 163.71 32.86 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 125.268 1.427 . . . . 0.0 111.874 -179.682 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 30.8 m -139.62 164.34 24.07 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.023 0 C-N-CA 126.041 1.737 . . . . 0.0 111.17 179.08 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 12.4 p -62.71 125.63 86.73 Favored Pre-proline 0 N--CA 1.477 0.879 0 C-N-CA 124.1 0.96 . . . . 0.0 112.064 179.178 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 96.4 Cg_endo -76.44 166.99 26.49 Favored 'Trans proline' 0 CA--C 1.542 0.875 0 C-N-CA 123.336 2.691 . . . . 0.0 112.847 -179.978 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 47.4 pt -126.0 -2.11 4.96 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.099 0 C-N-CA 125.259 1.423 . . . . 0.0 113.547 178.825 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 32.2 ttt85 -49.27 -36.61 21.1 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 125.796 1.638 . . . . 0.0 113.856 -178.515 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 -67.57 -17.93 64.82 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 126.187 1.795 . . . . 0.0 115.084 -179.842 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 68.9 p -134.53 -10.36 2.46 Favored 'General case' 0 N--CA 1.481 1.1 0 N-CA-C 115.25 1.574 . . . . 0.0 115.25 -178.482 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 86.3 tttt -51.95 -28.7 17.53 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 125.055 1.342 . . . . 0.0 114.338 178.947 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -96.25 -6.93 36.86 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 125.403 1.481 . . . . 0.0 113.982 177.814 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 65.4 mt -98.44 -11.92 21.88 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 126.344 1.858 . . . . 0.0 115.454 -175.479 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 4.8 m -77.09 75.66 3.66 Favored 'General case' 0 N--CA 1.478 0.944 0 CA-C-O 122.366 1.079 . . . . 0.0 110.949 -179.788 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.523 HD21 HD13 ' A' ' 75' ' ' LEU . 12.2 tp -75.98 143.24 41.64 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 128.027 2.531 . . . . 0.0 112.455 -177.757 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -68.44 148.78 50.14 Favored 'General case' 0 N--CA 1.474 0.755 0 O-C-N 120.729 -1.232 . . . . 0.0 112.255 177.578 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 20.9 m -82.68 149.95 4.48 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.827 0 C-N-CA 122.927 0.491 . . . . 0.0 110.286 173.142 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' CYS . . . . . 0.46 ' HB2' ' CE1' ' A' ' 38' ' ' HIS . 48.1 t -67.31 123.4 20.24 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-O 122.352 1.073 . . . . 0.0 111.463 178.071 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 2.7 mpt_? -64.39 -28.74 69.89 Favored 'General case' 0 N--CA 1.467 0.41 0 C-N-CA 124.965 1.306 . . . . 0.0 113.372 -175.903 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 11.5 mm-40 -82.93 -38.87 22.2 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 123.18 0.592 . . . . 0.0 110.138 177.839 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 81.1 t80 -61.65 -31.98 72.12 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 124.669 1.188 . . . . 0.0 111.042 174.772 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 12.6 mm100 -61.56 -16.86 51.81 Favored 'General case' 0 CA--C 1.545 0.771 0 N-CA-C 113.429 0.9 . . . . 0.0 113.429 175.698 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 5.6 mpt_? -121.69 14.04 10.88 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 126.338 1.855 . . . . 0.0 111.727 177.737 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 58.61 36.1 83.9 Favored Glycine 0 CA--C 1.535 1.289 0 C-N-CA 125.16 1.362 . . . . 0.0 114.183 -179.984 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 6.9 t -128.63 16.73 6.42 Favored 'General case' 0 N--CA 1.477 0.896 0 N-CA-C 114.489 1.292 . . . . 0.0 114.489 -176.005 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 9.1 t -67.31 173.98 3.58 Favored 'General case' 0 CA--C 1.558 1.264 0 O-C-N 121.633 -0.667 . . . . 0.0 110.858 173.985 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 90.7 p -136.24 9.43 3.22 Favored 'General case' 0 N--CA 1.477 0.902 0 N-CA-C 115.359 1.614 . . . . 0.0 115.359 -176.241 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 65.6 mtm-85 -132.69 153.61 81.16 Favored Pre-proline 0 N--CA 1.475 0.793 0 C-N-CA 125.941 1.696 . . . . 0.0 112.13 -178.449 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_endo -73.51 161.81 41.45 Favored 'Trans proline' 0 CA--C 1.541 0.827 0 C-N-CA 122.0 1.8 . . . . 0.0 109.109 173.109 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 -53.9 -28.44 36.55 Favored 'General case' 0 N--CA 1.473 0.709 0 N-CA-C 113.241 0.83 . . . . 0.0 113.241 177.69 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 27.2 p -72.1 -20.16 61.69 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 125.933 1.693 . . . . 0.0 115.069 178.887 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -114.84 -30.7 6.35 Favored 'General case' 0 N--CA 1.477 0.892 0 N-CA-C 114.295 1.221 . . . . 0.0 114.295 -178.014 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 34' ' ' CYS . . . . . 0.433 ' HB3' ' CE1' ' A' ' 38' ' ' HIS . 3.1 t -59.04 158.1 9.11 Favored 'General case' 0 CA--C 1.549 0.905 0 N-CA-C 114.675 1.361 . . . . 0.0 114.675 -175.654 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 36.7 mmtm -86.89 -0.31 56.28 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 126.773 2.029 . . . . 0.0 115.102 -173.095 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 75.3 m-85 -144.29 168.41 20.15 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 127.015 2.126 . . . . 0.0 109.388 175.692 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -73.7 150.69 41.06 Favored 'General case' 0 CA--C 1.548 0.871 0 O-C-N 120.414 -1.428 . . . . 0.0 113.842 -177.052 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' HIS . . . . . 0.46 ' CE1' ' HB2' ' A' ' 19' ' ' CYS . 7.1 m80 -127.33 84.16 64.15 Favored Pre-proline 0 CA--C 1.55 0.945 0 C-N-CA 125.451 1.5 . . . . 0.0 110.782 -177.415 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 35.2 Cg_endo -63.87 150.44 88.41 Favored 'Trans proline' 0 C--N 1.353 0.779 0 C-N-CA 123.636 2.891 . . . . 0.0 115.146 -177.078 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 54.1 p -89.35 -176.25 5.01 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 125.109 1.363 . . . . 0.0 111.695 174.536 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 60.9 mtpt -59.6 -21.9 61.05 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 125.516 1.526 . . . . 0.0 113.605 174.274 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 40.0 m -109.14 -16.13 14.16 Favored 'General case' 0 N--CA 1.477 0.923 0 N-CA-C 114.716 1.376 . . . . 0.0 114.716 -179.346 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 92.3 m -64.88 136.28 56.68 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-N 119.465 1.03 . . . . 0.0 112.218 179.462 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 42.0 tt0 -81.53 126.3 31.52 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 124.669 1.188 . . . . 0.0 110.502 179.165 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 18.7 t -119.75 134.65 62.59 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.941 0 C-N-CA 125.927 1.691 . . . . 0.0 109.688 -178.37 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -144.06 130.17 19.61 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 125.128 1.371 . . . . 0.0 111.331 -179.057 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 61.9 t30 42.75 37.01 0.93 Allowed 'General case' 0 CA--C 1.553 1.082 0 C-N-CA 126.989 2.115 . . . . 0.0 116.526 177.885 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 88.1 14.35 62.62 Favored Glycine 0 CA--C 1.536 1.35 0 O-C-N 121.103 -0.998 . . . . 0.0 114.929 179.653 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 31.1 mtt180 -138.52 167.56 21.67 Favored 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 126.101 1.76 . . . . 0.0 111.95 -179.57 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 4.4 m -140.03 146.56 24.71 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.571 0 C-N-CA 127.119 2.167 . . . . 0.0 108.911 -179.892 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 26.1 mt -95.72 127.98 47.3 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.814 0 O-C-N 121.108 -0.995 . . . . 0.0 109.611 -179.071 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -73.27 151.66 41.28 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 123.462 0.705 . . . . 0.0 111.683 177.44 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 13.2 t -73.46 98.87 2.85 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 124.421 1.089 . . . . 0.0 113.064 -176.881 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 30.0 p90 -61.66 -38.22 86.95 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 123.942 0.897 . . . . 0.0 110.139 174.843 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 66.1 m-20 -61.08 -42.38 98.39 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 123.011 0.524 . . . . 0.0 110.509 176.978 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 47.6 t -64.4 -42.37 96.14 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-N 119.519 1.054 . . . . 0.0 111.441 177.425 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 31.0 mt -63.73 -40.38 96.59 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 123.763 0.825 . . . . 0.0 112.921 176.399 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 31.4 mmmt -81.35 -9.46 59.74 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 124.763 1.225 . . . . 0.0 114.017 179.486 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 79.41 37.16 24.86 Favored Glycine 0 CA--C 1.536 1.4 0 C-N-CA 124.477 1.037 . . . . 0.0 113.525 -179.644 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 72.8 ttt-85 -117.19 -24.02 7.66 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 127.163 2.185 . . . . 0.0 113.966 -176.826 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 5.8 t -67.4 139.96 57.16 Favored 'General case' 0 CA--C 1.544 0.716 0 CA-C-O 121.768 0.794 . . . . 0.0 112.734 -177.92 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 7.3 t -152.73 14.94 0.56 Allowed 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 126.407 1.883 . . . . 0.0 111.938 179.149 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 74.4 mtm-85 -73.4 162.59 29.14 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 125.903 1.681 . . . . 0.0 113.007 -178.865 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -120.53 1.15 10.61 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 125.513 1.525 . . . . 0.0 112.515 177.048 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 68.3 m-80 -143.32 29.14 1.45 Allowed 'General case' 0 CA--C 1.552 1.022 0 C-N-CA 127.613 2.365 . . . . 0.0 110.772 -179.504 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 7.4 t -52.11 125.6 16.14 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 126.087 1.755 . . . . 0.0 111.876 -177.542 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 30.4 mtmt -85.25 1.28 48.92 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 124.578 1.151 . . . . 0.0 113.308 -178.558 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 87.3 m-85 -115.13 147.65 39.98 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 124.191 0.997 . . . . 0.0 111.469 -175.402 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -73.42 112.79 9.82 Favored 'General case' 0 N--CA 1.465 0.287 0 C-N-CA 123.473 0.709 . . . . 0.0 111.9 -176.18 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 12.1 m170 -68.71 114.02 19.74 Favored Pre-proline 0 CA--C 1.547 0.831 0 N-CA-C 107.487 -1.301 . . . . 0.0 107.487 174.285 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 67.7 Cg_exo -47.93 112.56 0.59 Allowed 'Trans proline' 0 CA--C 1.543 0.943 0 C-N-CA 124.842 3.694 . . . . 0.0 117.153 -173.691 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -76.69 153.55 34.03 Favored 'Trans proline' 0 CA--C 1.547 1.149 0 C-N-CA 122.068 1.845 . . . . 0.0 111.734 176.215 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 81.4 Cg_exo -42.27 -49.52 6.02 Favored 'Trans proline' 0 CA--C 1.539 0.73 0 C-N-CA 125.046 3.831 . . . . 0.0 116.823 -179.059 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 1.7 t60 -66.8 -29.94 70.01 Favored 'General case' 0 N--CA 1.478 0.954 0 N-CA-C 113.585 0.957 . . . . 0.0 113.585 -179.393 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.523 HD13 HD21 ' A' ' 16' ' ' LEU . 85.5 mt -93.64 -21.35 19.44 Favored 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 114.026 1.121 . . . . 0.0 114.026 -178.058 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 54.1 mtpt -53.5 -38.87 64.12 Favored 'General case' 0 N--CA 1.48 1.037 0 CA-C-N 120.204 1.366 . . . . 0.0 111.611 175.397 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 29.7 m -62.73 -43.98 97.4 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 124.937 1.295 . . . . 0.0 111.561 175.855 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 94.5 mm-40 -66.21 -43.04 87.86 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 123.622 0.769 . . . . 0.0 110.933 178.33 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 88.1 mt -62.02 -50.44 72.02 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 123.876 0.87 . . . . 0.0 111.554 177.632 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -62.61 -28.85 70.18 Favored 'General case' 0 N--CA 1.476 0.843 0 CA-C-N 120.025 1.284 . . . . 0.0 113.489 178.919 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 61.2 mt -70.23 -43.59 78.53 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.727 0 C-N-CA 123.723 0.809 . . . . 0.0 109.743 174.892 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 24.8 m-80 -66.2 -35.97 81.84 Favored 'General case' 0 CA--C 1.542 0.647 0 O-C-N 121.352 -0.842 . . . . 0.0 110.958 175.453 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -59.68 -46.13 94.53 Favored Glycine 0 CA--C 1.532 1.109 0 C-N-CA 124.487 1.041 . . . . 0.0 112.158 177.247 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 80.2 mtt85 -61.2 -18.2 57.01 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 124.25 1.02 . . . . 0.0 113.53 174.576 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 51.9 m-80 -104.72 11.18 34.28 Favored 'General case' 0 CA--C 1.551 0.991 0 C-N-CA 126.136 1.774 . . . . 0.0 112.428 178.32 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 21.9 t30 -127.77 -48.54 1.38 Allowed 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 125.817 1.647 . . . . 0.0 112.511 -179.58 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 94.6 mt -61.58 -16.38 47.49 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 124.308 1.043 . . . . 0.0 113.551 179.673 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 36.2 pt -83.73 -15.87 11.2 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.76 0 C-N-CA 127.514 2.326 . . . . 0.0 114.627 177.712 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 43.2 tt0 -68.25 109.09 3.43 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 124.046 0.938 . . . . 0.0 113.124 -175.114 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 4.2 tm0? -68.73 -32.04 71.53 Favored 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 123.845 0.858 . . . . 0.0 113.177 -178.848 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -141.21 123.9 16.05 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 126.161 1.784 . . . . 0.0 110.302 178.411 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 59.1 t30 . . . . . 0 CA--C 1.544 0.735 0 C-N-CA 124.216 1.006 . . . . 0.0 112.567 -179.227 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.3 mpt? . . . . . 0 CA--C 1.546 0.813 0 N-CA-C 113.194 0.812 . . . . 0.0 113.194 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -149.97 166.38 29.82 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 125.99 1.716 . . . . 0.0 112.08 179.606 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 6.5 m -141.0 148.45 21.56 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.98 0 C-N-CA 126.03 1.732 . . . . 0.0 111.437 179.813 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 20.1 m -69.0 -24.17 64.19 Favored 'General case' 0 N--CA 1.478 0.94 0 N-CA-C 114.758 1.392 . . . . 0.0 114.758 -178.189 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 25.4 m -143.79 162.82 15.67 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.965 0 C-N-CA 126.55 1.94 . . . . 0.0 110.64 179.796 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 23.5 p -60.87 139.84 93.63 Favored Pre-proline 0 N--CA 1.476 0.869 0 C-N-CA 123.44 0.696 . . . . 0.0 112.186 179.209 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 69.0 Cg_endo -77.63 -4.92 15.06 Favored 'Trans proline' 0 CA--C 1.543 0.937 0 C-N-CA 123.843 3.028 . . . . 0.0 115.129 -178.163 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 17.8 pt -62.06 156.67 3.97 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.673 0 C-N-CA 125.676 1.59 . . . . 0.0 113.462 -178.293 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 66.2 ttt180 -144.4 -36.66 0.32 Allowed 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 124.411 1.085 . . . . 0.0 113.397 176.172 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 13.2 m-20 -61.67 -25.39 67.36 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 124.597 1.159 . . . . 0.0 113.536 178.025 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 25.7 p -126.15 1.35 7.17 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 125.829 1.652 . . . . 0.0 113.731 179.914 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 16.1 tppt? -53.82 -45.28 70.76 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 124.378 1.071 . . . . 0.0 111.78 177.656 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -73.07 -23.67 60.58 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 124.606 1.163 . . . . 0.0 113.473 178.628 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 95.0 mt -91.67 -14.92 29.28 Favored 'General case' 0 N--CA 1.467 0.376 0 C-N-CA 126.064 1.746 . . . . 0.0 114.429 -177.802 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 12.8 m -75.83 78.93 2.75 Favored 'General case' 0 N--CA 1.475 0.791 0 CA-C-N 119.508 1.049 . . . . 0.0 110.785 -179.208 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.47 HD21 HD13 ' A' ' 75' ' ' LEU . 10.6 tp -75.52 141.42 43.03 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 128.021 2.528 . . . . 0.0 111.985 -176.352 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 53.0 mt-10 -71.77 151.32 43.62 Favored 'General case' 0 N--CA 1.472 0.642 0 O-C-N 120.933 -1.104 . . . . 0.0 112.452 178.623 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 16.9 m -86.71 156.54 3.29 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.904 0 C-N-CA 123.107 0.563 . . . . 0.0 111.201 174.487 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 42.2 t -75.89 132.09 40.09 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-O 121.725 0.774 . . . . 0.0 110.677 176.685 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 3.8 mpt_? -66.62 -28.17 68.28 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 124.641 1.176 . . . . 0.0 113.167 -177.79 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -84.47 -36.13 22.49 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 118.36 0.527 . . . . 0.0 110.415 178.62 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 59.1 t80 -62.69 -31.28 72.14 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 123.686 0.794 . . . . 0.0 110.835 173.565 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 12.2 mm100 -62.48 -17.93 60.7 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 124.028 0.931 . . . . 0.0 113.334 175.387 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 1.7 mpp_? -118.16 13.12 13.73 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 126.417 1.887 . . . . 0.0 111.673 176.159 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 58.76 36.04 84.78 Favored Glycine 0 CA--C 1.533 1.218 0 C-N-CA 125.12 1.343 . . . . 0.0 113.894 -179.572 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 6.4 t -130.08 15.27 5.71 Favored 'General case' 0 N--CA 1.477 0.91 0 N-CA-C 114.827 1.418 . . . . 0.0 114.827 -175.333 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 8.8 t -67.99 169.8 9.39 Favored 'General case' 0 CA--C 1.557 1.212 0 CA-C-N 118.865 0.757 . . . . 0.0 110.454 173.435 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 50.5 m -132.23 13.58 4.65 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 125.302 1.441 . . . . 0.0 114.394 -176.09 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 75.5 mtm-85 -135.8 144.87 50.53 Favored Pre-proline 0 N--CA 1.472 0.63 0 C-N-CA 125.493 1.517 . . . . 0.0 112.337 -177.184 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_endo -69.37 165.72 29.55 Favored 'Trans proline' 0 CA--C 1.544 0.986 0 C-N-CA 121.955 1.77 . . . . 0.0 109.697 171.472 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -54.27 -31.31 53.43 Favored 'General case' 0 N--CA 1.478 0.939 0 O-C-N 121.196 -0.94 . . . . 0.0 112.468 177.554 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 24.6 p -70.15 -10.9 60.25 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 126.496 1.918 . . . . 0.0 115.141 177.47 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 44.6 mm-40 -122.83 -29.91 3.91 Favored 'General case' 0 N--CA 1.476 0.841 0 N-CA-C 115.184 1.55 . . . . 0.0 115.184 -177.003 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 3.4 t -66.99 164.75 17.02 Favored 'General case' 0 CA--C 1.546 0.81 0 N-CA-C 115.123 1.527 . . . . 0.0 115.123 -175.364 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -80.96 -12.31 59.41 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 126.777 2.031 . . . . 0.0 113.433 -179.632 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 60.5 m-85 -139.81 176.55 8.65 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 126.556 1.943 . . . . 0.0 110.173 179.408 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -84.58 148.49 26.44 Favored 'General case' 0 CA--C 1.547 0.845 0 O-C-N 121.134 -0.979 . . . . 0.0 113.361 -177.214 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 66.8 m170 -119.64 87.98 38.2 Favored Pre-proline 0 CA--C 1.55 0.958 0 C-N-CA 125.847 1.659 . . . . 0.0 111.177 179.385 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_endo -62.92 144.41 93.19 Favored 'Trans proline' 0 CA--C 1.539 0.759 0 C-N-CA 123.458 2.772 . . . . 0.0 114.45 -178.323 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 45.1 p -81.78 -175.09 5.39 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 124.438 1.095 . . . . 0.0 111.941 175.233 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 61.2 mtpt -60.12 -21.3 61.38 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 125.359 1.464 . . . . 0.0 113.152 173.198 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 46.1 m -109.27 -21.03 12.74 Favored 'General case' 0 N--CA 1.478 0.951 0 N-CA-C 114.548 1.314 . . . . 0.0 114.548 -179.958 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 81.9 m -61.59 135.6 57.7 Favored 'General case' 0 CA--C 1.544 0.718 0 CA-C-N 119.653 1.115 . . . . 0.0 112.352 179.39 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 38.4 tt0 -79.2 129.46 34.48 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.695 1.198 . . . . 0.0 111.091 179.993 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 13.7 t -122.87 133.45 68.94 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.037 0 C-N-CA 125.692 1.597 . . . . 0.0 110.025 -178.268 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 50.7 mt-10 -145.16 129.05 17.38 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 125.156 1.382 . . . . 0.0 111.813 -178.594 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 61.7 t30 39.66 38.82 0.46 Allowed 'General case' 0 CA--C 1.553 1.08 0 C-N-CA 127.572 2.349 . . . . 0.0 117.273 176.735 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 93.79 9.64 59.63 Favored Glycine 0 CA--C 1.535 1.3 0 O-C-N 120.955 -1.091 . . . . 0.0 115.168 178.961 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 31.7 mtt180 -137.69 170.91 15.24 Favored 'General case' 0 N--CA 1.466 0.331 0 C-N-CA 125.682 1.593 . . . . 0.0 111.827 179.591 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 5.3 m -135.85 171.95 16.38 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.675 0 C-N-CA 128.876 2.87 . . . . 0.0 107.324 177.593 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 38.7 mt -122.29 129.04 75.62 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.941 0 CA-C-N 120.209 1.368 . . . . 0.0 109.099 -179.927 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -73.72 146.08 44.67 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 124.176 0.99 . . . . 0.0 111.636 178.458 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 15.5 t -70.3 100.47 1.72 Allowed 'General case' 0 C--O 1.24 0.584 0 C-N-CA 124.972 1.309 . . . . 0.0 113.133 -176.918 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 31.3 p90 -61.51 -38.57 87.85 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 115.281 -0.872 . . . . 0.0 110.207 175.021 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 73.7 m-20 -61.38 -42.11 98.18 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 123.116 0.566 . . . . 0.0 110.855 177.433 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 48.4 t -64.31 -42.22 96.45 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 119.452 1.024 . . . . 0.0 111.472 177.538 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 29.9 mt -64.94 -40.89 95.71 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 123.636 0.774 . . . . 0.0 112.862 176.397 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 31.4 mmmt -79.51 -10.44 59.8 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 124.703 1.201 . . . . 0.0 113.872 179.087 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 80.25 37.52 21.08 Favored Glycine 0 CA--C 1.537 1.409 0 C-N-CA 124.642 1.115 . . . . 0.0 113.712 -179.932 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 50.5 ttp180 -120.24 -19.82 7.55 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 126.822 2.049 . . . . 0.0 114.507 -176.614 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 6.2 t -68.08 139.36 56.22 Favored 'General case' 0 CA--C 1.545 0.774 0 CA-C-N 119.247 0.93 . . . . 0.0 112.603 -178.376 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 87.6 p -150.68 9.31 0.6 Allowed 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 126.601 1.96 . . . . 0.0 112.944 -179.958 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 80.3 mtm-85 -68.13 163.45 22.54 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 126.339 1.856 . . . . 0.0 113.797 -178.66 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -119.46 -2.28 10.58 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 126.362 1.865 . . . . 0.0 112.831 176.981 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 36.2 m-20 -144.46 31.56 1.2 Allowed 'General case' 0 CA--C 1.552 1.036 0 C-N-CA 127.659 2.384 . . . . 0.0 110.88 -178.329 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 8.1 t -51.74 125.53 15.24 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 126.104 1.762 . . . . 0.0 111.866 -178.346 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 27.4 mtmt -84.12 2.09 41.1 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 124.607 1.163 . . . . 0.0 113.374 -178.588 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 80.6 m-85 -117.65 149.19 41.12 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 124.334 1.053 . . . . 0.0 111.591 -174.763 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -76.09 117.75 18.12 Favored 'General case' 0 N--CA 1.464 0.253 0 C-N-CA 123.516 0.727 . . . . 0.0 111.293 -176.49 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 15.3 m170 -72.25 114.32 28.48 Favored Pre-proline 0 CA--C 1.549 0.907 0 N-CA-C 107.46 -1.311 . . . . 0.0 107.46 174.602 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 63.6 Cg_exo -47.27 115.9 1.55 Allowed 'Trans proline' 0 CA--C 1.543 0.96 0 C-N-CA 124.855 3.703 . . . . 0.0 116.522 -174.433 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -76.3 149.36 31.47 Favored 'Trans proline' 0 CA--C 1.542 0.887 0 C-N-CA 121.906 1.737 . . . . 0.0 110.472 175.955 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 84.6 Cg_exo -47.05 -39.32 25.41 Favored 'Trans proline' 0 CA--C 1.537 0.671 0 C-N-CA 123.868 3.045 . . . . 0.0 115.192 179.547 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 12.6 t-80 -69.8 -17.76 63.42 Favored 'General case' 0 N--CA 1.473 0.698 0 N-CA-C 114.99 1.478 . . . . 0.0 114.99 179.473 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.47 HD13 HD21 ' A' ' 16' ' ' LEU . 84.3 mt -114.19 -16.87 12.0 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 124.64 1.176 . . . . 0.0 112.848 178.742 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 54.2 mtpt -54.65 -36.2 64.3 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-N 119.725 1.148 . . . . 0.0 111.449 174.103 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 25.1 m -63.21 -43.73 97.31 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 123.635 0.774 . . . . 0.0 111.455 176.168 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 16.4 mm100 -67.5 -44.84 77.5 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 123.664 0.786 . . . . 0.0 110.75 178.129 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 81.7 mt -61.74 -48.69 79.57 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 124.2 1.0 . . . . 0.0 112.233 177.921 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -63.85 -35.67 81.39 Favored 'General case' 0 N--CA 1.474 0.741 0 CA-C-N 119.886 1.221 . . . . 0.0 112.733 179.725 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 60.2 mt -64.23 -45.49 96.09 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.763 0 CA-C-N 118.802 0.728 . . . . 0.0 110.062 176.203 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 32.2 m-80 -65.85 -37.88 87.35 Favored 'General case' 0 CA--C 1.542 0.672 0 O-C-N 121.696 -0.627 . . . . 0.0 111.354 175.956 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -63.08 -48.79 77.12 Favored Glycine 0 CA--C 1.528 0.846 0 C-N-CA 124.502 1.048 . . . . 0.0 111.981 177.653 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 71.8 mtp85 -57.73 -39.38 77.17 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 124.53 1.132 . . . . 0.0 112.024 176.231 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 49.6 t30 -67.34 -31.14 71.2 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 123.776 0.83 . . . . 0.0 112.641 176.694 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 56.7 t30 -86.48 -30.65 21.83 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 125.085 1.354 . . . . 0.0 113.536 179.791 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 37.4 tp -54.55 -13.53 1.0 Allowed 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 127.71 2.404 . . . . 0.0 115.414 -179.014 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 21.0 pt -64.68 10.76 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.548 0.9 0 C-N-CA 127.205 2.202 . . . . 0.0 115.355 177.856 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -49.97 -27.61 5.64 Favored 'General case' 0 N--CA 1.477 0.892 0 N-CA-C 116.356 1.984 . . . . 0.0 116.356 -177.413 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 90' ' ' GLN . . . . . 0.451 ' NE2' ' H ' ' A' ' 90' ' ' GLN . 0.0 OUTLIER -80.82 -4.5 54.89 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 124.922 1.289 . . . . 0.0 114.044 177.046 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 39.5 ttpt -129.6 -30.95 2.05 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 126.426 1.891 . . . . 0.0 113.499 -178.065 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 54.0 t-20 . . . . . 0 C--O 1.243 0.74 0 C-N-CA 125.436 1.495 . . . . 0.0 111.486 179.574 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.5 mmt . . . . . 0 CA--C 1.542 0.641 0 N-CA-C 113.141 0.793 . . . . 0.0 113.141 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -49.49 -25.93 3.02 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 126.539 1.936 . . . . 0.0 114.839 -179.451 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 26.7 m -66.0 -16.11 20.06 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.754 0 C-N-CA 125.548 1.539 . . . . 0.0 114.452 177.521 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 89.2 p -139.75 -18.69 0.94 Allowed 'General case' 0 N--CA 1.478 0.935 0 N-CA-C 116.722 2.119 . . . . 0.0 116.722 -177.467 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 34.1 m -74.99 41.73 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.542 0 CA-C-N 120.553 1.524 . . . . 0.0 114.439 179.651 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 60.9 p -57.57 151.28 41.12 Favored Pre-proline 0 N--CA 1.479 1.004 0 C-N-CA 124.97 1.308 . . . . 0.0 112.832 179.886 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 85.6 Cg_exo -49.06 133.8 29.14 Favored 'Trans proline' 0 C--N 1.353 0.815 0 C-N-CA 124.229 3.286 . . . . 0.0 115.08 -178.563 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 9.8 tp -58.03 132.39 22.65 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.637 0 C-N-CA 123.952 0.901 . . . . 0.0 111.513 179.068 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 34.8 ptt-85 -161.6 161.82 29.83 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 126.868 2.067 . . . . 0.0 110.855 -176.192 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 8.7 p-10 -63.38 -27.21 69.15 Favored 'General case' 0 CA--C 1.544 0.735 0 N-CA-C 113.53 0.937 . . . . 0.0 113.53 177.545 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 25.5 p -87.1 2.27 50.29 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 125.314 1.445 . . . . 0.0 114.112 178.079 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 3.3 tmpt? -54.45 -39.93 67.88 Favored 'General case' 0 N--CA 1.479 0.992 0 O-C-N 120.734 -1.229 . . . . 0.0 112.866 -178.601 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -75.29 -24.7 57.55 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 123.868 0.867 . . . . 0.0 113.051 177.683 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 86.8 mt -89.37 -14.65 35.12 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 126.127 1.771 . . . . 0.0 114.375 -178.227 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 6.8 m -78.03 75.86 4.56 Favored 'General case' 0 N--CA 1.477 0.907 0 CA-C-N 119.289 0.95 . . . . 0.0 111.008 -178.958 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.458 HD21 HD13 ' A' ' 75' ' ' LEU . 12.0 tp -75.66 145.88 40.67 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 127.531 2.332 . . . . 0.0 112.374 -178.227 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 15.9 mt-10 -75.24 150.9 38.48 Favored 'General case' 0 N--CA 1.472 0.638 0 O-C-N 120.602 -1.311 . . . . 0.0 112.752 179.29 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 13.0 m -83.52 155.56 3.75 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 C-N-CA 122.787 0.435 . . . . 0.0 111.596 176.29 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 42.6 t -72.89 129.5 38.28 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-O 122.063 0.935 . . . . 0.0 110.608 176.046 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 3.9 mpt_? -67.82 -27.82 67.05 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 124.925 1.29 . . . . 0.0 113.211 -177.542 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 15.8 mm-40 -84.13 -36.38 22.97 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 123.297 0.639 . . . . 0.0 110.11 178.423 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 72.7 t80 -63.27 -30.93 71.98 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 124.214 1.005 . . . . 0.0 110.917 174.19 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 12.6 mm100 -62.17 -16.03 50.16 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 123.886 0.874 . . . . 0.0 113.045 174.899 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 6.5 mpt_? -119.4 12.84 12.56 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 126.72 2.008 . . . . 0.0 111.622 176.684 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 58.22 36.12 81.18 Favored Glycine 0 CA--C 1.534 1.249 0 C-N-CA 125.479 1.514 . . . . 0.0 114.565 179.742 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 6.4 t -132.07 12.25 4.69 Favored 'General case' 0 N--CA 1.478 0.962 0 N-CA-C 115.202 1.556 . . . . 0.0 115.202 -175.384 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 31.0 t -61.03 131.84 51.91 Favored 'General case' 0 CA--C 1.548 0.897 0 O-C-N 121.175 -0.953 . . . . 0.0 110.783 176.53 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 75.4 p -83.18 6.67 18.52 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 125.94 1.696 . . . . 0.0 114.645 -178.04 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 75.3 mtm-85 -127.38 152.87 76.97 Favored Pre-proline 0 N--CA 1.473 0.685 0 C-N-CA 125.851 1.661 . . . . 0.0 113.476 -175.69 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo -72.66 160.61 46.03 Favored 'Trans proline' 0 CA--C 1.54 0.79 0 C-N-CA 122.098 1.865 . . . . 0.0 109.053 172.461 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 16.7 m-20 -55.3 -22.12 17.46 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 124.759 1.223 . . . . 0.0 113.822 -178.71 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 14.9 p -83.55 -22.08 32.48 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 127.306 2.242 . . . . 0.0 115.5 179.296 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -101.51 -31.9 10.65 Favored 'General case' 0 N--CA 1.477 0.883 0 CA-C-N 119.742 1.155 . . . . 0.0 113.839 -177.519 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 4.3 t -56.67 150.31 16.07 Favored 'General case' 0 CA--C 1.545 0.763 0 N-CA-C 115.007 1.484 . . . . 0.0 115.007 -174.105 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 13.4 mptt -81.9 -2.24 50.58 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 127.046 2.139 . . . . 0.0 113.134 -177.241 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 63.8 m-85 -138.79 169.8 17.14 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 127.461 2.304 . . . . 0.0 109.587 174.622 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -80.37 149.06 30.36 Favored 'General case' 0 CA--C 1.547 0.857 0 N-CA-C 114.382 1.253 . . . . 0.0 114.382 -175.948 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 21.2 m170 -121.07 86.78 42.88 Favored Pre-proline 0 CA--C 1.556 1.178 0 C-N-CA 125.99 1.716 . . . . 0.0 111.173 -179.179 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 35.2 Cg_endo -65.25 150.01 87.93 Favored 'Trans proline' 0 CA--C 1.539 0.771 0 C-N-CA 123.279 2.653 . . . . 0.0 114.671 -178.8 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 46.1 p -88.4 -175.34 4.96 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 124.476 1.11 . . . . 0.0 111.536 174.19 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 62.8 mttp -61.21 -18.53 58.72 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 125.379 1.471 . . . . 0.0 113.388 173.221 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 47.8 m -109.19 -20.99 12.78 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 125.078 1.351 . . . . 0.0 114.645 -178.783 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 71.6 m -63.58 137.55 58.16 Favored 'General case' 0 CA--C 1.543 0.701 0 CA-C-N 119.304 0.956 . . . . 0.0 113.32 -179.883 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 4.3 tm0? -82.88 134.28 35.09 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 124.774 1.23 . . . . 0.0 111.257 178.817 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -139.07 145.06 28.11 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.677 0 C-N-CA 125.251 1.42 . . . . 0.0 112.259 179.775 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -147.27 140.6 25.36 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 126.019 1.727 . . . . 0.0 110.911 176.802 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 61.1 t30 41.4 38.13 0.78 Allowed 'General case' 0 CA--C 1.553 1.073 0 C-N-CA 126.585 1.954 . . . . 0.0 116.166 177.53 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 84.53 16.65 65.76 Favored Glycine 0 CA--C 1.537 1.424 0 O-C-N 121.091 -1.006 . . . . 0.0 115.358 -179.938 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 55.5 mtt85 -136.92 160.87 37.6 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 124.913 1.285 . . . . 0.0 112.043 -179.945 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 5.8 m -135.89 150.1 28.24 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.698 0 C-N-CA 128.034 2.533 . . . . 0.0 109.847 -177.512 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 40.4 mt -98.84 127.63 51.25 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.75 0 O-C-N 121.28 -0.887 . . . . 0.0 109.992 -179.055 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -73.44 147.43 44.2 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 124.268 1.027 . . . . 0.0 111.716 177.6 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 17.9 t -69.26 100.08 1.26 Allowed 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 124.93 1.292 . . . . 0.0 112.784 -177.392 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 30.2 p90 -61.57 -38.47 87.63 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 115.23 -0.895 . . . . 0.0 110.163 175.183 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 71.1 m-20 -61.47 -42.69 99.17 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 123.127 0.571 . . . . 0.0 110.761 177.29 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 47.6 t -64.11 -42.32 96.93 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-N 119.491 1.041 . . . . 0.0 111.574 177.669 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 28.6 mt -65.46 -40.57 93.35 Favored 'General case' 0 CA--C 1.543 0.674 0 O-C-N 121.436 -0.79 . . . . 0.0 112.881 176.625 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 31.3 mmmt -79.84 -11.31 59.83 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 124.679 1.191 . . . . 0.0 113.928 179.167 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 82.17 37.79 14.53 Favored Glycine 0 CA--C 1.537 1.409 0 C-N-CA 124.577 1.085 . . . . 0.0 113.959 179.76 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 50.5 ttp180 -121.23 -18.29 7.44 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 126.652 1.981 . . . . 0.0 114.518 -176.646 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 6.0 t -71.67 133.69 45.83 Favored 'General case' 0 CA--C 1.545 0.765 0 CA-C-N 119.298 0.954 . . . . 0.0 112.747 -178.331 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 59.8 m -142.93 12.84 1.86 Allowed 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 126.85 2.06 . . . . 0.0 112.022 178.874 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 82.5 mtm-85 -70.6 163.52 26.8 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 125.791 1.636 . . . . 0.0 113.74 -178.323 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -119.77 -3.19 10.29 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 126.515 1.926 . . . . 0.0 112.968 177.268 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 43.9 m-20 -145.13 34.7 1.09 Allowed 'General case' 0 CA--C 1.551 1.017 0 C-N-CA 127.745 2.418 . . . . 0.0 110.308 -178.348 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 8.4 t -51.17 127.63 19.77 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 125.688 1.595 . . . . 0.0 112.28 -177.341 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 36.1 mtmt -85.02 5.63 28.6 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 125.324 1.45 . . . . 0.0 113.612 -177.281 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 84.4 m-85 -126.57 155.34 42.6 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 124.87 1.268 . . . . 0.0 112.061 -175.532 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -76.99 114.94 16.34 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 123.679 0.792 . . . . 0.0 112.267 -176.598 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 10.7 m170 -71.5 113.62 21.2 Favored Pre-proline 0 CA--C 1.546 0.807 0 N-CA-C 107.605 -1.257 . . . . 0.0 107.605 173.539 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 89.3 Cg_exo -50.1 111.36 0.51 Allowed 'Trans proline' 0 CA--C 1.542 0.901 0 C-N-CA 124.801 3.667 . . . . 0.0 117.226 -173.871 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 97.1 Cg_endo -76.34 152.97 35.2 Favored 'Trans proline' 0 CA--C 1.547 1.15 0 C-N-CA 122.109 1.873 . . . . 0.0 111.109 175.254 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 91.6 Cg_exo -43.95 -44.92 11.87 Favored 'Trans proline' 0 CA--C 1.538 0.717 0 C-N-CA 124.755 3.637 . . . . 0.0 116.308 -179.51 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 25.6 m170 -74.76 -5.82 45.45 Favored 'General case' 0 N--CA 1.478 0.95 0 N-CA-C 115.111 1.523 . . . . 0.0 115.111 -179.523 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.458 HD13 HD21 ' A' ' 16' ' ' LEU . 95.5 mt -116.16 -21.24 9.49 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 124.852 1.261 . . . . 0.0 113.122 177.198 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 57.4 mtpt -54.09 -35.46 62.13 Favored 'General case' 0 N--CA 1.477 0.922 0 CA-C-N 119.752 1.16 . . . . 0.0 111.439 175.304 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 23.0 m -63.62 -46.82 83.98 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 124.798 1.239 . . . . 0.0 111.416 174.902 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 75.1 mt-30 -62.51 -44.98 95.03 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.64 0.776 . . . . 0.0 110.884 177.708 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 82.2 mt -61.77 -50.18 73.41 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 124.205 1.002 . . . . 0.0 111.861 177.998 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 7.5 pt-20 -63.6 -35.16 79.59 Favored 'General case' 0 N--CA 1.474 0.726 0 CA-C-N 119.838 1.199 . . . . 0.0 112.895 179.279 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 60.4 mt -60.62 -41.21 87.18 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.795 0 CA-C-N 119.269 0.941 . . . . 0.0 110.063 176.369 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 12.7 t-20 -69.67 -45.0 69.36 Favored 'General case' 0 CA--C 1.545 0.783 0 O-C-N 121.827 -0.545 . . . . 0.0 110.595 175.316 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -56.65 -40.13 87.44 Favored Glycine 0 CA--C 1.534 1.273 0 C-N-CA 125.171 1.367 . . . . 0.0 113.357 177.726 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 86.4 mtt-85 -62.38 -29.49 70.51 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 125.432 1.493 . . . . 0.0 112.52 176.241 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 62.7 t30 -84.45 -36.93 21.99 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 124.006 0.922 . . . . 0.0 110.637 174.765 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -77.49 7.08 5.9 Favored 'General case' 0 CA--C 1.555 1.139 0 C-N-CA 126.405 1.882 . . . . 0.0 113.104 176.781 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 13.6 tp -62.51 -5.64 2.74 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 126.964 2.106 . . . . 0.0 115.04 -177.149 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 49.9 pt -56.1 -11.68 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.479 1.002 0 C-N-CA 126.655 1.982 . . . . 0.0 115.234 177.821 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 20.1 pt20 -114.83 10.96 16.58 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 126.211 1.804 . . . . 0.0 113.762 179.664 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 25.2 tm0? -60.3 -24.31 64.86 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 125.061 1.344 . . . . 0.0 114.16 -179.699 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 19.5 ptpt -143.1 166.16 25.41 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 125.976 1.71 . . . . 0.0 112.275 178.907 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 45.3 t30 . . . . . 0 CA--C 1.542 0.668 0 C-N-CA 125.409 1.484 . . . . 0.0 111.435 -179.733 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.3 mmt . . . . . 0 CA--C 1.545 0.754 0 N-CA-C 113.48 0.919 . . . . 0.0 113.48 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -64.67 157.61 26.76 Favored 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 124.93 1.292 . . . . 0.0 113.162 179.057 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 30.6 m -67.25 -18.21 23.74 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.175 0 N-CA-C 114.502 1.297 . . . . 0.0 114.502 179.685 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 8.1 t -156.05 172.32 18.61 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 125.854 1.662 . . . . 0.0 111.163 178.899 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 27.8 m -64.41 153.94 7.31 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.876 0 C-N-CA 124.867 1.267 . . . . 0.0 112.861 179.051 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 20.1 p -72.65 154.61 91.37 Favored Pre-proline 0 N--CA 1.475 0.786 0 C-N-CA 124.509 1.124 . . . . 0.0 112.451 178.335 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 82.6 Cg_endo -71.88 162.8 40.86 Favored 'Trans proline' 0 C--N 1.351 0.707 0 C-N-CA 123.217 2.612 . . . . 0.0 113.069 -178.992 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 12.4 tt -66.42 22.09 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.484 1.269 0 C-N-CA 127.178 2.191 . . . . 0.0 115.048 179.001 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 1.4 mpt_? -126.39 -8.68 6.35 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 127.637 2.375 . . . . 0.0 112.059 176.845 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -70.87 -10.6 59.92 Favored 'General case' 0 CA--C 1.549 0.937 0 C-N-CA 124.699 1.2 . . . . 0.0 112.268 174.965 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 21.3 p -59.92 -2.8 0.44 Allowed 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 127.182 2.193 . . . . 0.0 115.468 177.716 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 85.0 tttt -48.72 -34.71 12.56 Favored 'General case' 0 N--CA 1.477 0.918 0 CA-C-N 120.699 1.59 . . . . 0.0 113.857 179.08 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -65.7 -25.74 67.45 Favored 'General case' 0 N--CA 1.474 0.772 0 N-CA-C 113.818 1.044 . . . . 0.0 113.818 177.488 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 87.1 mt -88.81 -8.9 53.54 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 127.26 2.224 . . . . 0.0 113.797 -179.418 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 4.1 m -77.43 76.94 3.97 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-O 122.738 1.256 . . . . 0.0 110.366 -179.632 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -75.65 142.26 42.62 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 128.428 2.691 . . . . 0.0 111.716 -177.139 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 51.8 mt-10 -70.89 149.86 46.33 Favored 'General case' 0 N--CA 1.471 0.612 0 O-C-N 120.718 -1.239 . . . . 0.0 112.08 176.927 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 16.5 m -84.1 155.2 3.66 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.921 0 C-N-CA 123.163 0.585 . . . . 0.0 111.191 174.555 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 42.3 t -74.76 133.56 41.96 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-O 121.861 0.839 . . . . 0.0 110.841 176.861 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 3.4 mpt_? -67.95 -26.96 66.21 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 124.994 1.317 . . . . 0.0 113.437 -177.562 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 7.8 mm-40 -87.86 -32.9 18.75 Favored 'General case' 0 N--CA 1.465 0.32 0 C-N-CA 123.053 0.541 . . . . 0.0 110.701 178.427 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 64.2 t80 -64.15 -31.69 72.98 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 123.513 0.725 . . . . 0.0 110.212 172.93 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 12.0 mm100 -61.61 -24.21 66.54 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 123.669 0.788 . . . . 0.0 112.541 174.382 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 28.0 mtm105 -103.48 -2.36 26.98 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 125.967 1.707 . . . . 0.0 112.575 177.649 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 72.58 35.86 59.02 Favored Glycine 0 CA--C 1.533 1.191 0 C-N-CA 126.223 1.868 . . . . 0.0 113.983 179.927 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 5.3 t -137.15 10.62 3.03 Favored 'General case' 0 N--CA 1.48 1.053 0 N-CA-C 116.122 1.897 . . . . 0.0 116.122 -175.033 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 28.9 t -60.77 131.73 51.61 Favored 'General case' 0 CA--C 1.55 0.971 0 CA-C-N 119.723 1.147 . . . . 0.0 111.518 177.545 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 29.0 m -80.16 5.14 15.26 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 125.811 1.644 . . . . 0.0 114.894 -177.581 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 79.1 mtm-85 -129.69 145.22 56.12 Favored Pre-proline 0 N--CA 1.475 0.798 0 C-N-CA 125.243 1.417 . . . . 0.0 113.491 -175.28 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 93.5 Cg_endo -70.22 166.79 27.01 Favored 'Trans proline' 0 CA--C 1.543 0.959 0 C-N-CA 122.251 1.967 . . . . 0.0 109.803 171.382 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 7.1 p-10 -54.61 -28.76 48.83 Favored 'General case' 0 N--CA 1.475 0.821 0 O-C-N 121.031 -1.043 . . . . 0.0 113.507 177.088 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 35.0 p -75.52 -9.25 58.42 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 125.472 1.509 . . . . 0.0 114.995 178.874 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 25.5 mm-40 -122.12 -25.16 4.96 Favored 'General case' 0 N--CA 1.477 0.901 0 N-CA-C 115.763 1.764 . . . . 0.0 115.763 -175.748 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 4.3 t -71.02 164.55 25.33 Favored 'General case' 0 CA--C 1.545 0.788 0 N-CA-C 115.181 1.549 . . . . 0.0 115.181 -175.164 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -83.33 -13.29 55.37 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 126.888 2.075 . . . . 0.0 113.428 -179.805 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 59.5 m-85 -136.76 171.79 13.98 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 127.093 2.157 . . . . 0.0 110.105 179.068 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -81.26 151.96 27.85 Favored 'General case' 0 CA--C 1.545 0.757 0 N-CA-C 114.555 1.317 . . . . 0.0 114.555 -176.15 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 67.7 m170 -124.25 85.32 55.3 Favored Pre-proline 0 CA--C 1.553 1.072 0 C-N-CA 126.315 1.846 . . . . 0.0 110.638 -179.788 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_endo -63.42 151.71 83.62 Favored 'Trans proline' 0 C--N 1.352 0.762 0 C-N-CA 123.606 2.871 . . . . 0.0 115.166 -177.43 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 59.6 p -84.77 -176.31 6.16 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 124.785 1.234 . . . . 0.0 111.93 174.492 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 67.7 mttm -63.24 -18.34 63.43 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 125.477 1.511 . . . . 0.0 113.407 173.686 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 70.8 p -109.26 -21.23 12.65 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 125.368 1.467 . . . . 0.0 114.696 -178.92 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 84.0 m -63.68 138.89 58.68 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 119.463 1.029 . . . . 0.0 113.581 179.522 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 24.3 mt-30 -78.79 136.82 37.47 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 124.808 1.243 . . . . 0.0 111.449 178.242 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 11.2 t -130.23 135.4 60.88 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.687 0 C-N-CA 124.789 1.235 . . . . 0.0 110.478 -179.484 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -145.91 132.72 20.06 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 125.149 1.379 . . . . 0.0 111.202 178.236 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 63.2 t30 41.16 38.39 0.73 Allowed 'General case' 0 CA--C 1.552 1.038 0 C-N-CA 126.951 2.1 . . . . 0.0 116.419 177.622 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 87.26 14.99 63.11 Favored Glycine 0 CA--C 1.536 1.377 0 O-C-N 121.071 -1.018 . . . . 0.0 115.136 179.892 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 30.0 mtt180 -137.01 163.75 30.0 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 125.452 1.501 . . . . 0.0 112.702 -179.664 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 6.2 m -137.6 141.35 39.51 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.562 0 C-N-CA 127.87 2.468 . . . . 0.0 109.91 -179.243 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 49.8 mt -90.2 142.29 13.14 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.964 0 O-C-N 121.092 -1.005 . . . . 0.0 108.991 178.591 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -90.8 152.28 20.85 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 123.54 0.736 . . . . 0.0 112.693 -179.718 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 3.7 t -70.29 88.87 0.64 Allowed 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.997 1.719 . . . . 0.0 111.398 -177.061 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 28.9 p90 -57.7 -36.86 72.55 Favored 'General case' 0 N--CA 1.469 0.508 0 O-C-N 121.341 -0.849 . . . . 0.0 111.934 179.374 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 66.8 m-20 -59.48 -30.79 68.79 Favored 'General case' 0 CA--C 1.542 0.648 0 O-C-N 121.807 -0.558 . . . . 0.0 111.66 177.269 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 47.9 t -71.28 -41.46 69.99 Favored 'General case' 0 N--CA 1.469 0.513 0 O-C-N 120.744 -1.223 . . . . 0.0 111.104 177.054 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 48.3 mt -66.94 -40.25 87.53 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 123.912 0.885 . . . . 0.0 112.49 175.731 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 14.2 mmmm -78.48 -8.4 58.49 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 125.078 1.351 . . . . 0.0 114.591 -179.381 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 76.05 49.59 8.47 Favored Glycine 0 CA--C 1.534 1.219 0 CA-C-N 118.786 0.721 . . . . 0.0 112.26 -179.222 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.13 -21.8 1.19 Allowed 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 125.981 1.713 . . . . 0.0 115.588 -174.843 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 7.4 t -56.18 113.76 1.68 Allowed 'General case' 0 CA--C 1.546 0.816 0 N-CA-C 114.362 1.245 . . . . 0.0 114.362 -174.159 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 19.9 m -142.13 15.55 2.07 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 127.871 2.468 . . . . 0.0 110.968 179.188 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.473 HH21 ' HA ' ' A' ' 66' ' ' CYS . 20.1 ttm105 -63.34 143.2 58.01 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 127.354 2.262 . . . . 0.0 112.96 -176.283 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 3.5 mp0 -64.93 -35.18 80.31 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 124.301 1.041 . . . . 0.0 112.892 179.761 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 52.5 m-80 -152.39 109.85 3.58 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 126.697 1.999 . . . . 0.0 109.271 179.543 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' CYS . . . . . 0.473 ' HA ' HH21 ' A' ' 63' ' ' ARG . 59.0 m -69.36 139.09 54.15 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-O 121.84 0.829 . . . . 0.0 111.138 177.751 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 35.2 mtmt -115.51 15.65 16.66 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 125.788 1.635 . . . . 0.0 111.144 176.457 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 68.7 m-85 -139.03 150.43 45.79 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 127.714 2.405 . . . . 0.0 111.381 -174.683 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -73.63 122.06 21.69 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 124.598 1.159 . . . . 0.0 112.874 -178.406 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 4.0 m170 -72.92 117.59 61.06 Favored Pre-proline 0 CA--C 1.547 0.83 0 N-CA-C 107.609 -1.256 . . . . 0.0 107.609 171.455 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 90.1 Cg_exo -48.89 111.47 0.48 Allowed 'Trans proline' 0 CA--C 1.545 1.045 0 C-N-CA 124.475 3.45 . . . . 0.0 116.238 -176.301 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 68.1 Cg_endo -74.53 154.1 44.68 Favored 'Trans proline' 0 CA--C 1.542 0.893 0 C-N-CA 122.391 2.061 . . . . 0.0 111.048 176.38 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -54.95 -34.66 87.21 Favored 'Trans proline' 0 CA--C 1.536 0.59 0 C-N-CA 123.532 2.821 . . . . 0.0 114.682 -177.413 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 19.4 t-80 -75.66 -13.44 60.33 Favored 'General case' 0 N--CA 1.474 0.734 0 N-CA-C 114.519 1.303 . . . . 0.0 114.519 178.308 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 87.7 mt -115.55 -14.6 11.5 Favored 'General case' 0 N--CA 1.474 0.769 0 N-CA-C 113.948 1.092 . . . . 0.0 113.948 178.461 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 56.0 mtpt -54.55 -32.71 58.88 Favored 'General case' 0 N--CA 1.475 0.78 0 CA-C-N 119.728 1.149 . . . . 0.0 110.638 173.103 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 17.4 m -62.89 -42.98 99.97 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 124.648 1.179 . . . . 0.0 111.585 175.208 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 -66.65 -47.23 73.19 Favored 'General case' 0 CA--C 1.536 0.438 0 O-C-N 121.419 -0.801 . . . . 0.0 110.093 176.663 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 44.3 mt -61.92 -39.15 91.03 Favored 'General case' 0 N--CA 1.471 0.584 0 N-CA-C 113.183 0.809 . . . . 0.0 113.183 178.287 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 17.7 mm-40 -53.49 -54.29 39.28 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 124.733 1.213 . . . . 0.0 110.443 174.485 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 69.5 mt -68.45 -37.52 77.93 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.402 0 C-N-CA 126.032 1.733 . . . . 0.0 111.197 -176.186 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 72.8 m-20 -63.13 -44.26 96.09 Favored 'General case' 0 CA--C 1.542 0.66 0 O-C-N 121.623 -0.673 . . . . 0.0 110.294 173.081 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -63.39 -46.0 93.7 Favored Glycine 0 CA--C 1.529 0.913 0 C-N-CA 124.431 1.015 . . . . 0.0 112.421 179.326 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 81.8 mtt-85 -58.64 -37.15 75.32 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 124.596 1.158 . . . . 0.0 111.434 175.81 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 43.8 t30 -73.53 -44.27 58.01 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 123.767 0.827 . . . . 0.0 111.887 175.603 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 30.1 t30 -59.9 -29.86 68.64 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 125.174 1.39 . . . . 0.0 113.849 179.414 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 32.4 tp -49.49 -26.51 3.45 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 125.695 1.598 . . . . 0.0 114.464 -179.102 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 9.4 pt -53.59 -32.54 20.96 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.745 0 C-N-CA 124.635 1.174 . . . . 0.0 112.939 176.138 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 18.6 tt0 -61.0 -30.85 70.53 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 124.126 0.97 . . . . 0.0 112.318 177.552 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -93.67 2.48 56.3 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 125.539 1.536 . . . . 0.0 112.889 178.28 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 59.6 mtpt -125.44 -16.22 5.92 Favored 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 125.316 1.447 . . . . 0.0 114.765 -178.758 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 45.7 t30 . . . . . 0 CA--C 1.542 0.661 0 C-N-CA 125.629 1.572 . . . . 0.0 111.502 -179.573 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 94.7 mtp . . . . . 0 CA--C 1.545 0.771 0 N-CA-C 113.405 0.891 . . . . 0.0 113.405 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -65.15 157.36 28.89 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 124.897 1.279 . . . . 0.0 113.144 179.022 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 32.8 m -132.66 11.89 1.55 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.239 0 C-N-CA 125.565 1.546 . . . . 0.0 113.407 -179.352 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 20.0 m -60.24 151.53 27.1 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 125.562 1.545 . . . . 0.0 113.825 -179.164 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 40.3 t -140.34 148.25 22.53 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.992 0 C-N-CA 126.291 1.837 . . . . 0.0 109.197 179.057 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 15.2 p -62.03 153.75 72.22 Favored Pre-proline 0 N--CA 1.479 1.003 0 C-N-CA 124.472 1.109 . . . . 0.0 112.867 178.762 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_exo -52.98 144.39 45.64 Favored 'Trans proline' 0 CA--C 1.541 0.825 0 C-N-CA 123.784 2.989 . . . . 0.0 115.083 179.806 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 47.0 pt -133.13 14.13 1.46 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.205 0 C-N-CA 126.027 1.731 . . . . 0.0 113.009 179.113 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 46.9 ptt85 -140.95 11.98 2.23 Favored 'General case' 0 N--CA 1.481 1.111 0 N-CA-C 115.282 1.586 . . . . 0.0 115.282 -177.33 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -53.19 -30.94 40.3 Favored 'General case' 0 CA--C 1.547 0.845 0 N-CA-C 116.291 1.96 . . . . 0.0 116.291 -175.407 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 21.8 p -134.79 -5.72 2.46 Favored 'General case' 0 N--CA 1.483 1.198 0 N-CA-C 115.963 1.838 . . . . 0.0 115.963 -178.735 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 18.6 ptpt -54.56 -25.69 27.63 Favored 'General case' 0 N--CA 1.485 1.279 0 CA-C-N 121.485 1.948 . . . . 0.0 115.606 -178.466 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -77.71 -22.97 49.6 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 123.729 0.812 . . . . 0.0 112.785 175.403 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 85.7 mt -95.06 -20.34 19.4 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 127.269 2.228 . . . . 0.0 114.081 -177.649 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 4.5 m -73.19 73.69 1.26 Allowed 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 125.251 1.42 . . . . 0.0 112.029 -178.957 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.545 HD21 HD13 ' A' ' 75' ' ' LEU . 10.2 tp -75.67 145.25 41.12 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 127.137 2.175 . . . . 0.0 112.098 -178.751 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 11.2 mt-10 -72.95 152.19 41.51 Favored 'General case' 0 N--CA 1.471 0.588 0 O-C-N 120.589 -1.319 . . . . 0.0 112.865 179.146 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 18.0 m -85.21 156.18 3.49 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.852 0 C-N-CA 123.333 0.653 . . . . 0.0 111.446 175.559 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 42.6 t -75.69 128.06 34.39 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-O 121.61 0.719 . . . . 0.0 110.44 176.741 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 4.3 mpt_? -66.82 -27.64 67.72 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 124.384 1.073 . . . . 0.0 113.141 -177.658 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -78.92 -40.75 31.27 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.457 0.703 . . . . 0.0 109.518 177.803 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 63.8 t80 -62.79 -35.28 79.36 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 124.752 1.221 . . . . 0.0 111.2 175.745 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 50.3 mm-40 -62.04 -15.92 48.12 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 124.408 1.083 . . . . 0.0 113.406 175.248 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 12.0 mtp-105 -120.82 12.71 11.37 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 127.06 2.144 . . . . 0.0 112.266 -179.852 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 58.06 34.62 73.37 Favored Glycine 0 CA--C 1.535 1.285 0 C-N-CA 125.061 1.315 . . . . 0.0 113.845 -179.791 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 7.6 t -129.87 14.1 5.82 Favored 'General case' 0 N--CA 1.475 0.796 0 N-CA-C 114.597 1.332 . . . . 0.0 114.597 -175.342 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 6.8 t -68.57 173.35 5.14 Favored 'General case' 0 CA--C 1.556 1.176 0 O-C-N 121.409 -0.807 . . . . 0.0 110.837 174.133 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 91.6 p -139.4 9.34 2.47 Favored 'General case' 0 N--CA 1.477 0.878 0 N-CA-C 115.097 1.517 . . . . 0.0 115.097 -176.825 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 48.3 mtt85 -130.86 145.47 57.85 Favored Pre-proline 0 N--CA 1.47 0.569 0 C-N-CA 125.596 1.558 . . . . 0.0 112.116 -177.589 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -69.05 166.44 26.72 Favored 'Trans proline' 0 CA--C 1.543 0.958 0 C-N-CA 121.962 1.775 . . . . 0.0 109.735 171.973 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -54.24 -29.79 47.88 Favored 'General case' 0 N--CA 1.476 0.862 0 O-C-N 121.129 -0.982 . . . . 0.0 113.054 176.946 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 31.7 p -73.1 -7.63 52.17 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 125.991 1.717 . . . . 0.0 115.004 178.317 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 21.8 mt-10 -127.39 -24.33 3.37 Favored 'General case' 0 N--CA 1.476 0.838 0 N-CA-C 116.059 1.874 . . . . 0.0 116.059 -176.167 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 1.1 t -71.71 164.64 25.59 Favored 'General case' 0 CA--C 1.543 0.691 0 N-CA-C 115.415 1.635 . . . . 0.0 115.415 -176.538 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -81.62 -10.81 59.33 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 126.591 1.956 . . . . 0.0 113.717 -178.598 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 63.1 m-85 -140.06 174.0 10.96 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 126.549 1.939 . . . . 0.0 110.336 179.507 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -80.11 150.02 30.4 Favored 'General case' 0 CA--C 1.548 0.871 0 N-CA-C 113.349 0.87 . . . . 0.0 113.349 -176.957 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 65.8 m170 -123.42 86.14 52.19 Favored Pre-proline 0 CA--C 1.553 1.092 0 C-N-CA 126.049 1.74 . . . . 0.0 110.965 -179.327 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_endo -63.82 152.64 79.75 Favored 'Trans proline' 0 CA--C 1.541 0.842 0 C-N-CA 123.704 2.936 . . . . 0.0 114.998 -177.894 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 39.2 p -92.32 -174.44 3.72 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 124.99 1.316 . . . . 0.0 112.096 175.563 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -62.09 -17.02 56.32 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 125.693 1.597 . . . . 0.0 113.559 173.31 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 61.2 m -109.07 -25.71 10.54 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 124.719 1.208 . . . . 0.0 114.081 -179.744 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 75.2 m -60.56 129.52 41.98 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 123.861 0.864 . . . . 0.0 113.137 -179.618 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 33.9 mt-30 -77.05 141.62 40.21 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 123.161 0.584 . . . . 0.0 110.978 176.115 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 14.5 t -129.48 139.59 51.3 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 C-N-CA 125.438 1.495 . . . . 0.0 110.604 -177.695 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 74.1 mm-40 -145.32 129.35 17.49 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 125.213 1.405 . . . . 0.0 111.49 179.943 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 63.3 t30 42.88 37.23 1.03 Allowed 'General case' 0 CA--C 1.555 1.138 0 N-CA-C 116.298 1.962 . . . . 0.0 116.298 176.684 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 85.58 17.18 62.49 Favored Glycine 0 CA--C 1.536 1.399 0 O-C-N 120.975 -1.078 . . . . 0.0 114.813 -179.407 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 60.8 mtt180 -138.72 162.01 35.75 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 125.842 1.657 . . . . 0.0 111.472 -179.1 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 4.9 m -138.35 142.25 35.7 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.626 0 C-N-CA 126.949 2.1 . . . . 0.0 109.938 -177.869 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 31.8 mt -90.36 129.28 41.46 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.766 0 O-C-N 121.289 -0.882 . . . . 0.0 110.337 -178.048 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -75.53 149.24 38.43 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 124.16 0.984 . . . . 0.0 111.733 177.868 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 15.2 t -69.45 99.52 1.25 Allowed 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 124.876 1.27 . . . . 0.0 112.985 -176.696 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 32.1 p90 -61.66 -38.56 88.19 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 115.165 -0.925 . . . . 0.0 110.154 175.108 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 69.9 m-20 -61.26 -41.78 97.52 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 123.17 0.588 . . . . 0.0 111.033 177.187 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 48.2 t -64.63 -41.65 96.03 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-N 119.48 1.036 . . . . 0.0 111.462 177.678 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 31.2 mt -66.5 -41.63 88.6 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 123.804 0.841 . . . . 0.0 112.882 176.504 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 31.4 mmmt -77.77 -10.97 59.82 Favored 'General case' 0 N--CA 1.478 0.966 0 C-N-CA 124.668 1.187 . . . . 0.0 113.71 179.158 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 81.14 38.39 15.44 Favored Glycine 0 CA--C 1.537 1.412 0 C-N-CA 124.605 1.098 . . . . 0.0 113.803 179.644 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 50.9 ttp180 -121.97 -20.78 6.22 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 126.551 1.94 . . . . 0.0 114.555 -176.592 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 5.4 t -67.74 142.84 56.14 Favored 'General case' 0 CA--C 1.544 0.728 0 CA-C-N 119.318 0.963 . . . . 0.0 112.973 -178.286 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 78.0 p -154.07 10.93 0.4 Allowed 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 126.669 1.987 . . . . 0.0 112.846 179.224 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 79.8 mtm-85 -68.5 161.82 26.97 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 126.026 1.731 . . . . 0.0 113.781 -178.507 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -116.04 -5.06 11.96 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 126.353 1.861 . . . . 0.0 112.849 177.023 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 62.1 m-20 -144.33 37.85 1.25 Allowed 'General case' 0 CA--C 1.552 1.03 0 C-N-CA 127.939 2.496 . . . . 0.0 109.912 -178.205 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 7.4 t -52.45 128.4 25.57 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 125.586 1.554 . . . . 0.0 112.167 -177.041 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 30.4 mtmt -84.64 4.49 32.15 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 125.07 1.348 . . . . 0.0 114.089 -177.374 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 86.8 m-85 -127.24 155.71 43.03 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 124.823 1.249 . . . . 0.0 112.173 -175.304 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -77.31 114.43 16.12 Favored 'General case' 0 N--CA 1.467 0.412 0 C-N-CA 123.699 0.799 . . . . 0.0 112.079 -177.306 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 9.3 m170 -69.57 115.16 30.09 Favored Pre-proline 0 CA--C 1.546 0.805 0 N-CA-C 107.741 -1.207 . . . . 0.0 107.741 173.849 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 92.9 Cg_exo -49.71 114.1 1.22 Allowed 'Trans proline' 0 CA--C 1.543 0.967 0 C-N-CA 124.554 3.503 . . . . 0.0 116.238 -174.887 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -77.42 149.76 27.81 Favored 'Trans proline' 0 CA--C 1.542 0.923 0 C-N-CA 122.114 1.876 . . . . 0.0 110.435 175.876 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 88.5 Cg_exo -46.87 -39.47 24.48 Favored 'Trans proline' 0 CA--C 1.539 0.739 0 C-N-CA 123.895 3.064 . . . . 0.0 115.437 -179.968 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 12.7 t-80 -70.71 -17.78 62.82 Favored 'General case' 0 N--CA 1.472 0.666 0 N-CA-C 115.08 1.511 . . . . 0.0 115.08 179.774 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.545 HD13 HD21 ' A' ' 16' ' ' LEU . 76.3 mt -113.32 -16.36 12.51 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 124.597 1.159 . . . . 0.0 113.009 178.143 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 53.6 mtpt -54.72 -34.73 62.82 Favored 'General case' 0 N--CA 1.478 0.964 0 CA-C-N 119.742 1.156 . . . . 0.0 111.533 174.365 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 23.0 m -63.75 -43.72 95.62 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 123.461 0.705 . . . . 0.0 111.329 175.805 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 91.1 mm-40 -67.22 -45.7 76.03 Favored 'General case' 0 N--CA 1.469 0.514 0 O-C-N 121.458 -0.776 . . . . 0.0 111.002 177.598 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 81.8 mt -61.82 -49.86 74.59 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 124.376 1.07 . . . . 0.0 112.285 178.467 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.35 -35.84 82.2 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-N 119.541 1.064 . . . . 0.0 112.735 -179.598 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 59.4 mt -62.58 -44.29 99.24 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.785 0 CA-C-N 118.759 0.709 . . . . 0.0 109.851 174.582 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 13.3 t-20 -63.98 -39.8 94.94 Favored 'General case' 0 CA--C 1.546 0.814 0 O-C-N 121.677 -0.639 . . . . 0.0 110.5 175.78 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -57.77 -47.91 85.46 Favored Glycine 0 CA--C 1.532 1.115 0 C-N-CA 124.858 1.218 . . . . 0.0 112.259 176.564 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 91.4 mtt-85 -58.15 -37.03 73.87 Favored 'General case' 0 N--CA 1.48 1.056 0 CA-C-N 118.525 1.163 . . . . 0.0 112.148 176.021 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 17.3 t-20 -76.05 -14.69 60.2 Favored 'General case' 0 CA--C 1.553 1.059 0 C-N-CA 124.897 1.279 . . . . 0.0 113.538 177.808 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 24.2 t-20 -99.85 -46.01 5.53 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 125.763 1.625 . . . . 0.0 112.185 -179.524 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 90.7 mt -74.91 9.28 1.97 Allowed 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 126.417 1.887 . . . . 0.0 114.995 -178.374 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 76.6 mt -48.96 -40.33 12.51 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.056 0 C-N-CA 125.512 1.525 . . . . 0.0 112.813 -179.149 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 91.1 mt-30 -59.57 -23.7 63.13 Favored 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 114.097 1.147 . . . . 0.0 114.097 179.249 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 24.2 tt0 -64.26 -22.1 66.83 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 124.357 1.063 . . . . 0.0 112.72 177.672 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -69.76 -15.24 63.1 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 125.14 1.376 . . . . 0.0 113.832 178.346 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 44.8 t30 . . . . . 0 CA--C 1.545 0.769 0 C-N-CA 125.103 1.361 . . . . 0.0 112.632 179.774 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.3 mpt? . . . . . 0 CA--C 1.545 0.757 0 N-CA-C 113.099 0.778 . . . . 0.0 113.099 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -139.19 15.5 2.61 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 125.807 1.643 . . . . 0.0 113.502 -179.128 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 33.4 m -57.87 -19.79 13.09 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.194 0 N-CA-C 114.734 1.383 . . . . 0.0 114.734 -179.378 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 45.4 p -75.08 -12.99 60.44 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 125.736 1.614 . . . . 0.0 114.291 177.591 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 26.9 m -126.28 159.87 34.54 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.75 0 C-N-CA 124.649 1.18 . . . . 0.0 113.423 -178.817 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 55.8 p -146.17 168.6 11.3 Favored Pre-proline 0 N--CA 1.474 0.769 0 C-N-CA 128.615 2.766 . . . . 0.0 108.53 -177.908 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 75.0 Cg_exo -48.84 -42.43 37.33 Favored 'Trans proline' 0 C--N 1.351 0.708 0 C-N-CA 122.807 2.338 . . . . 0.0 114.343 178.974 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 43.5 pt -71.47 -5.12 5.4 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 N-CA-C 114.647 1.351 . . . . 0.0 114.647 179.281 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 98.4 mtt180 -114.49 4.35 15.21 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 127.15 2.18 . . . . 0.0 111.975 176.741 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -135.04 -39.18 0.77 Allowed 'General case' 0 N--CA 1.473 0.683 0 N-CA-C 114.266 1.21 . . . . 0.0 114.266 -176.021 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 43.5 p -66.42 -6.53 14.82 Favored 'General case' 0 N--CA 1.482 1.172 0 N-CA-C 115.165 1.543 . . . . 0.0 115.165 179.477 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 22.8 tptm -51.87 -38.75 57.28 Favored 'General case' 0 N--CA 1.476 0.867 0 CA-C-N 119.945 1.248 . . . . 0.0 112.933 178.846 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -68.84 -32.97 73.04 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 123.817 0.847 . . . . 0.0 112.923 177.181 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 83.9 mt -85.13 -13.89 48.75 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 126.816 2.046 . . . . 0.0 114.017 -178.714 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 11.1 m -77.97 79.17 4.44 Favored 'General case' 0 N--CA 1.475 0.821 0 CA-C-O 122.442 1.115 . . . . 0.0 110.398 -178.538 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -75.64 140.78 42.76 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 128.492 2.717 . . . . 0.0 111.363 -177.612 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 14.5 mt-10 -74.47 151.49 39.56 Favored 'General case' 0 N--CA 1.472 0.664 0 O-C-N 120.49 -1.381 . . . . 0.0 112.179 177.917 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 13.9 m -83.46 155.77 3.76 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.765 0 C-N-CA 122.848 0.459 . . . . 0.0 110.605 175.372 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 40.5 t -75.0 130.12 38.82 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-O 121.646 0.736 . . . . 0.0 110.648 177.096 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 3.5 mpt_? -67.59 -28.68 67.97 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 124.355 1.062 . . . . 0.0 113.207 -177.32 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -82.26 -33.06 29.34 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 118.262 0.483 . . . . 0.0 110.831 178.436 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 72.9 t80 -64.96 -35.92 82.72 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 123.702 0.801 . . . . 0.0 109.657 172.938 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 60.2 mm-40 -65.01 -18.6 65.44 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 124.132 0.973 . . . . 0.0 112.591 173.786 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 47.9 mtp180 -106.67 3.26 26.59 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 126.481 1.912 . . . . 0.0 112.494 178.523 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 62.61 34.04 88.38 Favored Glycine 0 CA--C 1.537 1.417 0 C-N-CA 125.197 1.379 . . . . 0.0 113.606 -178.077 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 5.3 t -138.12 16.09 2.82 Favored 'General case' 0 N--CA 1.478 0.937 0 N-CA-C 115.464 1.653 . . . . 0.0 115.464 -174.854 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 7.5 t -64.71 168.79 5.69 Favored 'General case' 0 CA--C 1.558 1.277 0 CA-C-N 119.275 0.943 . . . . 0.0 111.441 175.647 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 50.7 m -128.95 7.2 5.54 Favored 'General case' 0 N--CA 1.48 1.046 0 N-CA-C 115.562 1.69 . . . . 0.0 115.562 -175.289 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 87.9 mtt180 -137.07 145.68 51.4 Favored Pre-proline 0 N--CA 1.474 0.748 0 C-N-CA 125.527 1.531 . . . . 0.0 111.921 -178.874 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 74.6 Cg_endo -69.26 167.66 23.13 Favored 'Trans proline' 0 CA--C 1.544 1.005 0 C-N-CA 122.231 1.954 . . . . 0.0 110.141 172.49 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -54.38 -31.19 54.24 Favored 'General case' 0 N--CA 1.48 1.038 0 O-C-N 121.079 -1.013 . . . . 0.0 112.492 177.543 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 23.5 p -71.33 -6.94 43.73 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 126.318 1.847 . . . . 0.0 114.982 177.206 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 29.4 mt-10 -132.56 -21.44 2.24 Favored 'General case' 0 N--CA 1.476 0.836 0 N-CA-C 116.342 1.979 . . . . 0.0 116.342 -176.27 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 3.7 t -72.19 169.87 15.23 Favored 'General case' 0 CA--C 1.552 1.037 0 CA-C-N 119.935 1.243 . . . . 0.0 114.214 -177.977 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 56.0 mtmt -88.26 -10.66 48.91 Favored 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 126.518 1.927 . . . . 0.0 114.081 -178.516 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 66.7 m-85 -139.33 171.63 13.99 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 127.301 2.24 . . . . 0.0 109.389 177.02 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -82.38 150.86 26.91 Favored 'General case' 0 CA--C 1.546 0.809 0 N-CA-C 114.644 1.349 . . . . 0.0 114.644 -175.894 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 57.4 m170 -122.88 88.28 50.52 Favored Pre-proline 0 CA--C 1.552 1.028 0 C-N-CA 126.017 1.727 . . . . 0.0 110.577 179.073 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 26.5 Cg_endo -61.79 148.06 93.92 Favored 'Trans proline' 0 C--N 1.352 0.731 0 C-N-CA 123.148 2.565 . . . . 0.0 114.569 -178.315 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 59.7 p -82.48 -178.92 7.24 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 124.405 1.082 . . . . 0.0 111.908 175.055 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 31.2 mmmt -61.43 -17.36 53.98 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 125.445 1.498 . . . . 0.0 113.352 173.383 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 50.5 m -109.2 -17.94 13.73 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 125.016 1.326 . . . . 0.0 114.535 -178.686 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 83.5 m -69.27 154.14 42.52 Favored 'General case' 0 CA--C 1.543 0.676 0 CA-C-N 119.704 1.138 . . . . 0.0 112.682 177.833 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 39.0 mt-30 -110.13 141.21 43.33 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 124.483 1.113 . . . . 0.0 111.466 178.807 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -133.38 148.34 30.97 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.558 0 C-N-CA 125.054 1.342 . . . . 0.0 112.632 -177.48 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -146.01 140.79 27.09 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 125.934 1.694 . . . . 0.0 110.524 177.015 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 7.3 t-20 46.51 30.7 1.14 Allowed 'General case' 0 CA--C 1.553 1.069 0 C-N-CA 126.083 1.753 . . . . 0.0 115.245 179.207 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 82.09 22.81 58.54 Favored Glycine 0 CA--C 1.537 1.425 0 O-C-N 121.044 -1.035 . . . . 0.0 114.19 -178.253 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 53.2 mtt85 -138.13 160.64 38.87 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 125.249 1.42 . . . . 0.0 112.088 -178.446 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 4.4 m -136.78 138.59 46.01 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.514 0 C-N-CA 127.733 2.413 . . . . 0.0 109.886 -176.99 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 20.6 mt -88.48 129.77 39.09 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.558 0 O-C-N 121.306 -0.871 . . . . 0.0 109.63 -179.033 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -75.39 147.2 40.21 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 123.84 0.856 . . . . 0.0 111.067 178.054 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 11.8 t -69.23 98.79 1.07 Allowed 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 124.489 1.115 . . . . 0.0 112.538 -177.094 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 30.8 p90 -60.91 -38.18 84.82 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.104 175.645 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 70.1 m-20 -62.14 -36.65 82.44 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 123.571 0.748 . . . . 0.0 111.695 177.098 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 29.6 t -66.67 -42.12 87.07 Favored 'General case' 0 CA--C 1.539 0.558 0 CA-C-N 119.613 1.097 . . . . 0.0 111.146 176.461 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 31.8 mt -67.75 -39.89 84.17 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 123.82 0.848 . . . . 0.0 112.836 176.573 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' LYS . . . . . 0.444 ' HE2' ' HA ' ' A' ' 58' ' ' LYS . 10.0 mmpt? -80.82 -7.55 59.45 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 125.034 1.334 . . . . 0.0 114.161 -179.397 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 78.26 39.45 22.86 Favored Glycine 0 CA--C 1.536 1.366 0 C-N-CA 124.428 1.013 . . . . 0.0 113.837 179.021 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 34.7 ttm105 -120.73 -27.42 5.07 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 126.805 2.042 . . . . 0.0 113.755 -177.17 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 7.2 t -65.81 127.26 31.27 Favored 'General case' 0 CA--C 1.544 0.741 0 CA-C-N 118.991 0.814 . . . . 0.0 112.229 -178.293 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 63.8 p -152.53 17.67 0.62 Allowed 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 126.475 1.91 . . . . 0.0 112.493 -178.968 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 81.9 mtt85 -61.62 153.68 27.2 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 126.445 1.898 . . . . 0.0 114.286 -177.869 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -75.54 -19.9 59.02 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 123.604 0.762 . . . . 0.0 110.853 171.01 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -158.99 131.01 6.56 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 128.128 2.571 . . . . 0.0 108.658 176.879 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 4.2 t -110.67 159.07 17.93 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 124.456 1.103 . . . . 0.0 111.159 -179.998 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 32.5 mtmt -117.55 2.7 12.4 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 125.723 1.609 . . . . 0.0 113.533 -177.304 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 88.4 m-85 -123.45 151.74 42.37 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 125.95 1.7 . . . . 0.0 110.461 -176.987 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -75.08 115.42 14.69 Favored 'General case' 0 N--CA 1.467 0.396 0 O-C-N 121.595 -0.69 . . . . 0.0 112.017 -176.331 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 14.4 m170 -70.53 114.0 22.77 Favored Pre-proline 0 CA--C 1.547 0.857 0 N-CA-C 108.199 -1.038 . . . . 0.0 108.199 175.161 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 66.4 Cg_exo -46.96 109.53 0.22 Allowed 'Trans proline' 0 CA--C 1.544 1.01 0 C-N-CA 125.074 3.849 . . . . 0.0 117.143 -174.168 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_endo -77.59 151.59 28.89 Favored 'Trans proline' 0 CA--C 1.544 1.013 0 C-N-CA 122.815 2.343 . . . . 0.0 111.35 176.462 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_exo -47.26 -40.67 27.94 Favored 'Trans proline' 0 CA--C 1.539 0.769 0 C-N-CA 123.916 3.077 . . . . 0.0 115.496 179.059 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 8.3 m-70 -70.64 -15.79 62.76 Favored 'General case' 0 N--CA 1.476 0.866 0 N-CA-C 114.87 1.433 . . . . 0.0 114.87 178.98 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 85.7 mt -116.42 -15.21 10.94 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 124.116 0.966 . . . . 0.0 113.562 178.956 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 54.9 mtpt -55.73 -32.32 63.26 Favored 'General case' 0 N--CA 1.475 0.808 0 CA-C-N 119.736 1.153 . . . . 0.0 110.527 172.944 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 21.5 m -62.82 -45.45 92.57 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 124.206 1.002 . . . . 0.0 111.227 174.811 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 77.6 mt-30 -64.94 -46.54 81.17 Favored 'General case' 0 CA--C 1.54 0.57 0 O-C-N 121.39 -0.819 . . . . 0.0 110.518 176.636 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 85.1 mt -61.92 -39.8 93.3 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 124.33 1.052 . . . . 0.0 112.711 178.164 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 20.1 mm-40 -55.71 -53.64 54.13 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 124.89 1.276 . . . . 0.0 110.428 174.975 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 62.3 mt -67.68 -38.63 80.71 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.428 0 C-N-CA 125.711 1.605 . . . . 0.0 111.074 -175.97 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 54.7 m-20 -62.32 -43.46 98.76 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 123.157 0.583 . . . . 0.0 110.394 172.65 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -64.04 -48.82 71.86 Favored Glycine 0 CA--C 1.527 0.832 0 C-N-CA 124.209 0.909 . . . . 0.0 111.81 178.558 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 83.1 mtt-85 -56.68 -37.89 71.49 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 124.842 1.257 . . . . 0.0 112.069 176.662 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 52.1 t30 -66.44 -12.46 57.28 Favored 'General case' 0 CA--C 1.553 1.064 0 C-N-CA 124.528 1.131 . . . . 0.0 113.881 175.953 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 47.5 m-80 -113.96 -21.91 10.36 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 125.779 1.632 . . . . 0.0 112.609 178.333 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 33.6 tp -64.83 -22.14 66.93 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 126.628 1.971 . . . . 0.0 113.199 178.105 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 29.6 pt -52.95 135.8 14.45 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.423 0 C-N-CA 126.936 2.094 . . . . 0.0 112.32 178.427 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 63.3 mm-40 -58.72 -17.62 24.43 Favored 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 124.765 1.226 . . . . 0.0 114.144 -179.97 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 54.7 tt0 -66.0 -18.59 65.44 Favored 'General case' 0 CA--C 1.55 0.979 0 C-N-CA 125.117 1.367 . . . . 0.0 112.529 174.829 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -132.19 -40.65 1.02 Allowed 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 125.699 1.6 . . . . 0.0 113.114 -179.967 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 58.2 t-20 . . . . . 0 CA--C 1.543 0.68 0 C-N-CA 125.705 1.602 . . . . 0.0 112.194 178.456 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 64.5 mtt . . . . . 0 CA--C 1.545 0.757 0 N-CA-C 113.467 0.914 . . . . 0.0 113.467 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -150.06 166.89 28.37 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 126.07 1.748 . . . . 0.0 111.849 179.555 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 10.7 p -150.63 153.36 10.35 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.914 0 C-N-CA 125.369 1.467 . . . . 0.0 111.044 179.529 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 62.9 p -70.42 166.22 20.84 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 124.952 1.301 . . . . 0.0 113.198 178.478 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 6.1 p -134.56 4.77 1.17 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.168 0 C-N-CA 125.184 1.393 . . . . 0.0 113.009 -179.536 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 18.6 p -141.91 153.73 64.52 Favored Pre-proline 0 N--CA 1.478 0.931 0 C-N-CA 126.739 2.016 . . . . 0.0 111.074 179.693 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 86.6 Cg_endo -71.71 164.93 34.1 Favored 'Trans proline' 0 CA--C 1.541 0.873 0 C-N-CA 123.298 2.665 . . . . 0.0 112.826 179.85 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 9.6 tp -147.35 149.42 15.58 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.762 0 C-N-CA 125.433 1.493 . . . . 0.0 110.868 178.772 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 35.4 ptt-85 -65.81 160.02 24.04 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 124.989 1.315 . . . . 0.0 114.208 -179.669 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -136.49 11.25 3.22 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 126.538 1.935 . . . . 0.0 112.886 178.608 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 16.9 p -69.78 2.61 3.19 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 127.772 2.429 . . . . 0.0 115.715 -179.19 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -40.55 -43.0 1.78 Allowed 'General case' 0 N--CA 1.481 1.114 0 C-N-CA 126.425 1.89 . . . . 0.0 116.02 -177.346 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -74.55 -22.61 58.92 Favored 'General case' 0 N--CA 1.476 0.875 0 N-CA-C 114.687 1.366 . . . . 0.0 114.687 -179.282 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 67.8 mt -86.09 -10.32 55.12 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 126.72 2.008 . . . . 0.0 114.091 -177.463 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 3.6 m -75.76 76.24 2.72 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 124.752 1.221 . . . . 0.0 110.922 -178.698 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.433 HD21 HD13 ' A' ' 75' ' ' LEU . 13.7 tp -75.43 140.76 43.1 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 127.684 2.394 . . . . 0.0 111.51 -177.099 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 47.1 mp0 -67.53 150.88 48.26 Favored 'General case' 0 CA--C 1.543 0.683 0 O-C-N 120.569 -1.332 . . . . 0.0 111.977 178.396 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 21.2 m -87.08 149.58 4.06 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.075 0 C-N-CA 122.915 0.486 . . . . 0.0 111.054 174.588 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' CYS . . . . . 0.434 ' SG ' ' NZ ' ' A' ' 35' ' ' LYS . 46.9 t -70.89 134.72 47.5 Favored 'General case' 0 CA--C 1.538 0.493 0 O-C-N 121.621 -0.675 . . . . 0.0 110.782 177.035 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 3.7 mpt_? -71.75 -33.39 68.62 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 125.521 1.528 . . . . 0.0 112.721 -178.09 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 34.9 mt-10 -73.91 -38.0 64.46 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 123.731 0.812 . . . . 0.0 110.498 178.539 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 76.8 t80 -63.15 -28.7 70.24 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 124.804 1.242 . . . . 0.0 111.922 177.237 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 53.4 mm-40 -64.04 -19.97 65.59 Favored 'General case' 0 N--CA 1.477 0.9 0 N-CA-C 112.982 0.734 . . . . 0.0 112.982 175.978 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 6.8 mpt_? -110.8 9.36 22.59 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 125.987 1.715 . . . . 0.0 111.865 177.732 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 58.47 35.05 77.92 Favored Glycine 0 CA--C 1.533 1.186 0 C-N-CA 125.065 1.317 . . . . 0.0 114.094 -179.831 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 6.4 t -129.24 8.81 5.58 Favored 'General case' 0 N--CA 1.478 0.959 0 N-CA-C 114.51 1.3 . . . . 0.0 114.51 -175.76 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 12.4 t -60.34 136.66 58.11 Favored 'General case' 0 CA--C 1.55 0.962 0 C-N-CA 123.555 0.742 . . . . 0.0 111.305 177.61 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 33.1 m -80.6 -1.96 44.36 Favored 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 115.984 1.846 . . . . 0.0 115.984 -176.302 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 23.1 mtm-85 -134.21 151.71 76.94 Favored Pre-proline 0 N--CA 1.479 0.991 0 C-N-CA 124.971 1.308 . . . . 0.0 113.277 -174.702 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 89.7 Cg_endo -71.22 167.7 25.45 Favored 'Trans proline' 0 CA--C 1.544 0.983 0 C-N-CA 122.553 2.169 . . . . 0.0 109.924 172.306 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -53.16 -28.52 26.69 Favored 'General case' 0 N--CA 1.475 0.808 0 N-CA-C 114.518 1.303 . . . . 0.0 114.518 178.776 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 12.4 p -75.99 -14.81 60.23 Favored 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 115.024 1.49 . . . . 0.0 115.024 179.057 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -121.42 -18.39 7.31 Favored 'General case' 0 N--CA 1.476 0.843 0 N-CA-C 116.711 2.115 . . . . 0.0 116.711 -173.122 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 2.9 t -72.81 172.23 11.2 Favored 'General case' 0 CA--C 1.55 0.966 0 N-CA-C 116.349 1.981 . . . . 0.0 116.349 -176.763 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.434 ' NZ ' ' SG ' ' A' ' 19' ' ' CYS . 7.0 ptpp? -75.2 -22.69 57.82 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 129.543 3.137 . . . . 0.0 115.274 -178.347 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 11.5 m-85 -144.08 176.36 9.36 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 126.678 1.991 . . . . 0.0 110.268 -176.632 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -77.26 147.57 36.23 Favored 'General case' 0 CA--C 1.548 0.894 0 O-C-N 121.137 -0.977 . . . . 0.0 113.428 -176.577 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 55.0 m170 -120.68 87.36 41.85 Favored Pre-proline 0 CA--C 1.552 1.037 0 C-N-CA 125.843 1.657 . . . . 0.0 110.623 179.854 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_endo -61.57 146.57 96.8 Favored 'Trans proline' 0 CA--C 1.539 0.768 0 C-N-CA 123.552 2.835 . . . . 0.0 115.014 -177.683 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 53.6 p -84.64 -174.7 5.42 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 125.148 1.379 . . . . 0.0 112.266 175.714 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -60.75 -22.12 63.71 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 125.712 1.605 . . . . 0.0 113.67 174.355 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 66.7 p -109.16 -19.75 13.23 Favored 'General case' 0 N--CA 1.478 0.94 0 N-CA-C 114.413 1.264 . . . . 0.0 114.413 179.444 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 98.4 m -60.51 129.87 43.77 Favored 'General case' 0 CA--C 1.542 0.667 0 CA-C-N 119.723 1.147 . . . . 0.0 112.54 179.296 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 48.6 tt0 -83.46 133.76 34.89 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 124.815 1.246 . . . . 0.0 110.395 178.904 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 21.5 t -116.9 141.94 32.9 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.929 0 C-N-CA 125.525 1.53 . . . . 0.0 109.939 -177.719 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 74.5 mm-40 -142.63 125.67 16.29 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 125.239 1.416 . . . . 0.0 111.303 -179.175 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 63.6 t30 42.17 38.16 1.06 Allowed 'General case' 0 CA--C 1.555 1.152 0 N-CA-C 116.708 2.114 . . . . 0.0 116.708 175.718 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 88.62 14.9 60.74 Favored Glycine 0 CA--C 1.536 1.398 0 O-C-N 120.869 -1.144 . . . . 0.0 115.082 -179.656 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 48.3 mtt-85 -139.82 168.48 19.73 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 126.341 1.857 . . . . 0.0 112.099 -178.988 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 3.5 m -139.85 138.17 38.6 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.539 0 C-N-CA 126.947 2.099 . . . . 0.0 109.491 179.636 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 70.8 mt -86.21 135.66 24.57 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.783 0 O-C-N 120.992 -1.068 . . . . 0.0 109.451 179.955 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -80.75 150.08 29.4 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 123.66 0.784 . . . . 0.0 112.454 178.687 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 7.5 t -70.09 94.16 0.86 Allowed 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 126.183 1.793 . . . . 0.0 110.135 -179.479 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 29.5 p90 -56.41 -37.66 70.48 Favored 'General case' 0 N--CA 1.471 0.587 0 O-C-N 121.069 -1.019 . . . . 0.0 112.118 -179.738 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 -60.45 -29.16 68.85 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 123.452 0.701 . . . . 0.0 112.276 177.623 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 47.8 p -71.14 -37.87 72.27 Favored 'General case' 0 N--CA 1.471 0.58 0 O-C-N 121.079 -1.013 . . . . 0.0 111.757 177.035 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 69.8 mt -74.16 -42.82 59.32 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.416 1.086 . . . . 0.0 111.876 176.74 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 31.2 mmmt -74.13 -11.96 60.45 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 124.766 1.227 . . . . 0.0 113.795 179.836 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 80.48 41.22 11.65 Favored Glycine 0 CA--C 1.536 1.355 0 C-N-CA 124.449 1.023 . . . . 0.0 114.052 178.462 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 48.4 ttp180 -127.06 -18.65 4.55 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 126.264 1.826 . . . . 0.0 114.834 -176.694 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 8.4 t -67.46 151.18 47.84 Favored 'General case' 0 CA--C 1.548 0.87 0 CA-C-N 119.286 0.948 . . . . 0.0 112.538 -179.818 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 88.4 p -149.13 2.43 0.57 Allowed 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 126.167 1.787 . . . . 0.0 114.036 -179.603 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 86.3 mtm-85 -88.45 175.12 7.74 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 126.551 1.941 . . . . 0.0 112.56 179.783 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -138.8 24.53 2.6 Favored 'General case' 0 CA--C 1.551 1.01 0 C-N-CA 126.772 2.029 . . . . 0.0 109.749 174.02 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 6.7 p-10 -147.54 10.89 0.97 Allowed 'General case' 0 CA--C 1.547 0.85 0 N-CA-C 115.577 1.695 . . . . 0.0 115.577 -173.789 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 3.8 m -50.03 148.17 3.5 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.805 1.242 . . . . 0.0 113.495 -178.355 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 22.6 mtmt -78.29 6.94 7.19 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 123.152 0.581 . . . . 0.0 111.918 173.485 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 58.0 m-85 -127.55 150.85 49.51 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 126.698 1.999 . . . . 0.0 111.214 -174.149 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -79.17 126.89 31.33 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 124.048 0.939 . . . . 0.0 113.285 -175.445 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 38.1 m170 -75.5 115.49 46.15 Favored Pre-proline 0 CA--C 1.548 0.872 0 N-CA-C 106.717 -1.586 . . . . 0.0 106.717 170.496 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 81.7 Cg_exo -53.2 122.52 11.31 Favored 'Trans proline' 0 CA--C 1.543 0.955 0 C-N-CA 123.659 2.906 . . . . 0.0 115.146 -175.552 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_endo -77.91 155.03 30.2 Favored 'Trans proline' 0 CA--C 1.542 0.908 0 C-N-CA 122.226 1.951 . . . . 0.0 111.119 177.5 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 80.4 Cg_exo -45.32 -37.12 13.68 Favored 'Trans proline' 0 CA--C 1.538 0.724 0 C-N-CA 124.306 3.337 . . . . 0.0 115.848 179.214 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 76.4 m80 -78.66 -13.21 59.94 Favored 'General case' 0 N--CA 1.474 0.729 0 N-CA-C 115.336 1.606 . . . . 0.0 115.336 -179.898 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.433 HD13 HD21 ' A' ' 16' ' ' LEU . 50.8 mt -118.7 -9.64 10.16 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.617 1.167 . . . . 0.0 113.252 177.732 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 56.3 mtpt -55.84 -39.2 71.08 Favored 'General case' 0 N--CA 1.481 1.096 0 CA-C-N 120.293 1.406 . . . . 0.0 110.098 171.209 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 20.4 m -62.63 -41.44 99.02 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 124.423 1.089 . . . . 0.0 111.463 175.026 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 47.2 tp60 -66.2 -42.34 88.94 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 124.311 1.044 . . . . 0.0 110.929 178.185 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 27.6 mt -67.74 -42.3 82.07 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-O 118.516 -0.754 . . . . 0.0 112.597 178.054 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 3.1 pt-20 -64.01 -36.83 85.28 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-N 119.869 1.213 . . . . 0.0 111.056 175.665 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 64.2 mt -63.06 -42.91 98.43 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.721 0 CA-C-N 118.97 0.805 . . . . 0.0 109.812 175.332 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 60.0 m-20 -60.97 -48.14 83.2 Favored 'General case' 0 CA--C 1.545 0.783 0 CA-C-N 118.495 0.589 . . . . 0.0 110.28 175.724 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -59.95 -46.25 94.46 Favored Glycine 0 N--CA 1.471 0.991 0 C-N-CA 124.955 1.265 . . . . 0.0 112.51 179.076 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 58.2 mtp180 -60.46 -13.53 14.15 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 125.832 1.653 . . . . 0.0 113.653 175.692 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 53.8 m-80 -114.42 7.57 16.33 Favored 'General case' 0 CA--C 1.553 1.084 0 C-N-CA 125.977 1.711 . . . . 0.0 112.462 177.738 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 28.7 t30 -121.35 -36.8 3.02 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 126.148 1.779 . . . . 0.0 112.221 179.609 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 68.9 mt -81.5 4.18 22.14 Favored 'General case' 0 CA--C 1.551 1.012 0 C-N-CA 126.422 1.889 . . . . 0.0 113.202 178.585 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 41.3 pt -57.62 157.71 1.42 Allowed 'Isoleucine or valine' 0 C--O 1.238 0.466 0 C-N-CA 127.679 2.391 . . . . 0.0 114.968 -177.916 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 5.9 tp-100 -59.76 138.81 57.67 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 124.991 1.316 . . . . 0.0 110.412 175.895 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 6.2 pt20 -147.96 2.91 0.7 Allowed 'General case' 0 CA--C 1.547 0.844 0 N-CA-C 114.827 1.417 . . . . 0.0 114.827 -176.066 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 63.7 tttp -64.77 144.18 57.43 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 124.786 1.234 . . . . 0.0 111.068 176.353 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 44.8 t30 . . . . . 0 CA--C 1.544 0.733 0 C-N-CA 124.429 1.092 . . . . 0.0 112.443 178.744 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.6 mmt . . . . . 0 CA--C 1.544 0.713 0 N-CA-C 113.217 0.821 . . . . 0.0 113.217 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -139.21 14.73 2.61 Favored 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 125.995 1.718 . . . . 0.0 113.31 -179.283 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 30.4 m -67.04 -15.38 19.55 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.145 0 C-N-CA 125.209 1.404 . . . . 0.0 114.527 -179.561 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 85.0 p -151.56 167.1 29.14 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 126.032 1.733 . . . . 0.0 111.711 179.582 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 27.2 m -131.06 2.03 2.02 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.263 0 C-N-CA 124.938 1.295 . . . . 0.0 114.277 -178.242 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 36.0 p -144.31 153.9 56.52 Favored Pre-proline 0 N--CA 1.48 1.047 0 C-N-CA 125.691 1.596 . . . . 0.0 111.047 178.199 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 95.9 Cg_endo -71.71 175.31 9.77 Favored 'Trans proline' 0 CA--C 1.54 0.81 0 C-N-CA 123.427 2.751 . . . . 0.0 112.852 179.596 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 50.3 pt -67.77 -8.59 9.0 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.022 0 N-CA-C 114.662 1.356 . . . . 0.0 114.662 178.928 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 19.8 mmm180 -57.41 117.84 4.54 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 125.955 1.702 . . . . 0.0 113.287 -179.505 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -63.54 -28.88 70.25 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 123.394 0.678 . . . . 0.0 111.637 175.169 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 32.6 p -74.18 5.55 4.32 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 126.071 1.748 . . . . 0.0 114.238 177.29 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 19.0 ptpt -51.07 -31.82 20.05 Favored 'General case' 0 N--CA 1.481 1.108 0 CA-C-N 120.555 1.525 . . . . 0.0 114.859 -179.424 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -78.93 -24.71 43.83 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 123.945 0.898 . . . . 0.0 112.992 176.945 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 71.3 mt -98.08 -18.3 18.61 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 126.536 1.934 . . . . 0.0 114.659 -177.119 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 6.5 m -77.19 77.76 3.73 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 124.508 1.123 . . . . 0.0 110.68 -178.01 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -75.7 143.43 42.13 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 129.022 2.929 . . . . 0.0 111.843 -177.758 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 52.3 mt-10 -71.08 151.29 44.67 Favored 'General case' 0 N--CA 1.472 0.651 0 O-C-N 120.695 -1.253 . . . . 0.0 112.386 177.212 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 15.7 m -84.11 155.79 3.66 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.03 0 C-N-CA 123.277 0.631 . . . . 0.0 111.286 174.04 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 52.8 t -75.59 133.34 40.95 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-O 121.852 0.834 . . . . 0.0 111.199 176.924 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 3.1 mpt_? -69.59 -26.62 64.54 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 124.716 1.207 . . . . 0.0 112.91 -178.876 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -82.79 -36.54 25.53 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 122.966 0.506 . . . . 0.0 109.906 177.353 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 61.3 t80 -65.27 -34.41 78.27 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 124.245 1.018 . . . . 0.0 110.344 175.161 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 12.0 mm100 -63.11 -14.2 45.62 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 124.527 1.131 . . . . 0.0 112.86 173.791 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 81.9 mtt85 -119.16 10.17 11.99 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 127.091 2.156 . . . . 0.0 112.083 -179.845 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 57.34 35.14 70.01 Favored Glycine 0 CA--C 1.534 1.26 0 C-N-CA 125.528 1.537 . . . . 0.0 114.304 -179.637 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 4.8 t -134.65 6.08 3.45 Favored 'General case' 0 N--CA 1.477 0.91 0 N-CA-C 115.205 1.557 . . . . 0.0 115.205 -174.604 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 17.6 t -58.82 128.65 38.28 Favored 'General case' 0 CA--C 1.547 0.835 0 O-C-N 120.938 -1.101 . . . . 0.0 111.037 177.374 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 78.5 p -83.92 6.55 21.31 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 125.616 1.567 . . . . 0.0 114.346 -178.371 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 61.6 mtm-85 -131.35 145.22 56.7 Favored Pre-proline 0 N--CA 1.471 0.618 0 C-N-CA 125.421 1.488 . . . . 0.0 113.979 -172.991 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 98.1 Cg_endo -70.29 166.19 29.08 Favored 'Trans proline' 0 CA--C 1.544 1.001 0 C-N-CA 122.225 1.95 . . . . 0.0 109.816 171.074 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -54.28 -29.23 46.44 Favored 'General case' 0 N--CA 1.476 0.843 0 O-C-N 121.142 -0.973 . . . . 0.0 113.423 176.692 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 30.6 p -73.82 -13.22 60.9 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 125.873 1.669 . . . . 0.0 115.092 178.9 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 29.9 mm-40 -115.94 -29.85 6.23 Favored 'General case' 0 N--CA 1.478 0.926 0 N-CA-C 115.182 1.549 . . . . 0.0 115.182 -177.073 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 4.1 t -65.12 166.5 9.48 Favored 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 115.499 1.666 . . . . 0.0 115.499 -173.883 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.36 -13.03 47.67 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 127.391 2.277 . . . . 0.0 112.524 -179.324 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 57.8 m-85 -137.67 175.97 9.12 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 126.383 1.873 . . . . 0.0 110.237 -179.296 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -83.55 150.89 25.67 Favored 'General case' 0 CA--C 1.544 0.726 0 N-CA-C 113.725 1.009 . . . . 0.0 113.725 -177.487 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 66.0 m170 -122.19 85.85 46.99 Favored Pre-proline 0 CA--C 1.55 0.975 0 C-N-CA 126.116 1.766 . . . . 0.0 111.001 -179.624 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_endo -63.09 144.93 93.52 Favored 'Trans proline' 0 C--N 1.351 0.709 0 C-N-CA 123.402 2.735 . . . . 0.0 114.694 -177.841 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 59.9 p -82.83 -175.76 5.96 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 124.608 1.163 . . . . 0.0 111.906 174.909 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 75.2 mmtt -61.1 -19.91 62.02 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 125.497 1.519 . . . . 0.0 113.481 173.524 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 68.6 p -109.17 -18.22 13.67 Favored 'General case' 0 N--CA 1.477 0.884 0 N-CA-C 114.863 1.431 . . . . 0.0 114.863 -179.594 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 91.2 m -62.74 139.66 58.69 Favored 'General case' 0 CA--C 1.543 0.694 0 CA-C-N 119.576 1.08 . . . . 0.0 113.723 -179.61 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 47.2 tp60 -80.76 130.03 34.85 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 125.422 1.489 . . . . 0.0 110.371 178.235 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 9.9 t -126.52 137.2 58.53 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.022 0 C-N-CA 125.324 1.45 . . . . 0.0 110.509 -178.012 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -147.07 130.89 17.04 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 125.293 1.437 . . . . 0.0 111.745 178.512 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 62.2 t30 40.12 38.85 0.55 Allowed 'General case' 0 CA--C 1.553 1.065 0 C-N-CA 127.211 2.204 . . . . 0.0 116.758 176.802 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 90.12 11.54 62.96 Favored Glycine 0 CA--C 1.537 1.42 0 O-C-N 121.016 -1.053 . . . . 0.0 115.299 179.41 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 44.7 mtm180 -135.91 164.36 28.13 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 125.622 1.569 . . . . 0.0 112.038 179.78 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 8.2 m -139.29 149.19 23.09 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.573 0 C-N-CA 127.581 2.352 . . . . 0.0 109.413 -179.628 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 40.2 mt -97.54 129.42 47.69 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.913 0 O-C-N 121.018 -1.051 . . . . 0.0 110.651 -177.527 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -74.58 145.76 43.1 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 124.125 0.97 . . . . 0.0 111.406 177.206 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 13.2 t -69.47 99.61 1.27 Allowed 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 124.828 1.251 . . . . 0.0 113.175 -176.683 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 41.3 p90 -61.89 -38.92 90.15 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 115.157 -0.929 . . . . 0.0 110.29 175.299 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 65.9 m-20 -60.79 -41.3 95.3 Favored 'General case' 0 CA--C 1.54 0.577 0 O-C-N 121.787 -0.571 . . . . 0.0 110.836 176.78 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 43.8 t -65.09 -41.76 94.72 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-N 119.548 1.067 . . . . 0.0 111.347 177.269 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 31.1 mt -65.41 -41.9 93.13 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 124.009 0.923 . . . . 0.0 112.923 176.492 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 31.4 mmmt -78.33 -12.59 60.01 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 124.948 1.299 . . . . 0.0 113.753 179.325 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 84.03 39.27 9.45 Favored Glycine 0 CA--C 1.536 1.395 0 C-N-CA 124.639 1.114 . . . . 0.0 114.078 179.281 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 50.4 tpt85 -123.09 -23.3 4.97 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 126.44 1.896 . . . . 0.0 114.879 -177.075 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 6.5 t -64.24 131.5 47.56 Favored 'General case' 0 CA--C 1.543 0.709 0 CA-C-N 119.437 1.017 . . . . 0.0 112.895 -176.829 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 48.4 m -141.86 12.0 2.04 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 126.765 2.026 . . . . 0.0 112.234 179.868 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 76.2 mtm-85 -73.48 155.95 38.71 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 125.741 1.617 . . . . 0.0 113.341 -178.135 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 35.7 mm-40 -111.95 -2.31 15.17 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 125.796 1.638 . . . . 0.0 112.275 176.398 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 28.6 m120 -143.13 32.43 1.36 Allowed 'General case' 0 CA--C 1.552 1.02 0 C-N-CA 127.303 2.241 . . . . 0.0 110.916 -177.749 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 8.0 t -51.76 132.79 31.61 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 125.973 1.709 . . . . 0.0 112.219 -177.465 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 26.1 mtmt -90.12 4.08 51.46 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 124.42 1.088 . . . . 0.0 113.365 -179.297 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 85.3 m-85 -120.91 148.85 43.5 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 122.052 0.93 . . . . 0.0 112.375 -174.409 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -73.01 114.27 10.97 Favored 'General case' 0 N--CA 1.464 0.271 0 C-N-CA 123.896 0.878 . . . . 0.0 111.566 -176.879 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 13.2 m170 -71.37 114.61 29.34 Favored Pre-proline 0 CA--C 1.548 0.87 0 N-CA-C 107.382 -1.34 . . . . 0.0 107.382 174.557 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 65.9 Cg_exo -48.74 116.45 2.14 Favored 'Trans proline' 0 CA--C 1.542 0.921 0 C-N-CA 124.611 3.54 . . . . 0.0 116.975 -174.096 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -75.99 149.36 32.71 Favored 'Trans proline' 0 CA--C 1.545 1.044 0 C-N-CA 122.265 1.977 . . . . 0.0 110.518 174.937 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_exo -46.16 -41.04 21.79 Favored 'Trans proline' 0 CA--C 1.537 0.674 0 C-N-CA 124.068 3.179 . . . . 0.0 115.685 -179.789 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 13.8 t-80 -69.38 -17.28 63.66 Favored 'General case' 0 N--CA 1.474 0.765 0 N-CA-C 114.984 1.476 . . . . 0.0 114.984 179.761 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 93.2 mt -112.85 -16.95 12.63 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 124.367 1.067 . . . . 0.0 113.029 178.197 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 54.7 mtpt -54.56 -37.43 65.45 Favored 'General case' 0 N--CA 1.478 0.973 0 CA-C-N 119.791 1.178 . . . . 0.0 111.623 174.798 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 21.9 m -62.24 -41.76 98.72 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 123.731 0.812 . . . . 0.0 111.495 176.469 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 16.5 mm100 -69.67 -45.33 68.6 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 123.734 0.814 . . . . 0.0 110.898 178.324 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 89.4 mt -62.69 -46.2 89.25 Favored 'General case' 0 N--CA 1.466 0.345 0 C-N-CA 124.077 0.951 . . . . 0.0 112.423 178.738 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -64.91 -36.94 85.98 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-N 119.651 1.114 . . . . 0.0 112.28 178.97 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 63.7 mt -65.21 -45.43 93.82 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.707 0 CA-C-N 118.803 0.729 . . . . 0.0 110.064 176.176 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 24.5 m-80 -64.01 -38.82 92.48 Favored 'General case' 0 CA--C 1.54 0.587 0 O-C-N 121.627 -0.67 . . . . 0.0 111.456 176.645 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -66.23 -49.92 54.28 Favored Glycine 0 CA--C 1.529 0.907 0 C-N-CA 123.948 0.785 . . . . 0.0 111.959 177.977 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 72.6 mtp85 -54.88 -33.8 62.32 Favored 'General case' 0 N--CA 1.48 1.035 0 CA-C-N 118.806 1.303 . . . . 0.0 112.953 178.223 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 35.9 m-80 -76.09 -2.15 29.45 Favored 'General case' 0 CA--C 1.552 1.049 0 C-N-CA 125.016 1.326 . . . . 0.0 114.173 176.423 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 53.0 m-80 -126.84 -35.3 2.31 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 125.332 1.453 . . . . 0.0 113.679 -179.94 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -78.08 -11.83 59.94 Favored 'General case' 0 CA--C 1.546 0.803 0 CA-C-N 119.381 0.991 . . . . 0.0 113.199 176.869 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 23.7 pt 0.95 68.31 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.483 1.18 0 C-N-CA 131.092 3.757 . . . . 0.0 117.376 -178.717 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 44.6 tt0 -156.37 161.79 40.11 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 126.767 2.027 . . . . 0.0 109.987 179.677 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -139.44 160.82 38.94 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 125.632 1.573 . . . . 0.0 112.389 -179.988 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 60.8 tttp -62.07 -35.04 77.45 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 125.193 1.397 . . . . 0.0 114.258 -178.727 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 48.4 t-20 . . . . . 0 CA--C 1.54 0.593 0 C-N-CA 125.099 1.359 . . . . 0.0 111.64 -179.547 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.541 0.615 0 N-CA-C 113.964 1.098 . . . . 0.0 113.964 . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -55.29 -23.66 24.37 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 125.433 1.493 . . . . 0.0 114.572 -179.643 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 34.5 m -62.08 -17.6 18.11 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.878 0 C-N-CA 125.19 1.396 . . . . 0.0 113.75 176.986 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 47.4 m -57.71 -15.68 8.61 Favored 'General case' 0 N--CA 1.476 0.836 0 N-CA-C 115.157 1.54 . . . . 0.0 115.157 -179.692 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 27.5 m -60.32 -23.63 28.47 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.987 0 C-N-CA 124.586 1.154 . . . . 0.0 113.856 178.192 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 18.0 p -140.52 105.7 6.47 Favored Pre-proline 0 N--CA 1.475 0.805 0 C-N-CA 125.037 1.335 . . . . 0.0 110.591 178.811 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 94.9 Cg_endo -73.26 -14.16 25.6 Favored 'Trans proline' 0 C--N 1.352 0.761 0 C-N-CA 123.488 2.792 . . . . 0.0 115.207 -177.092 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 19.3 pt -56.97 -17.51 5.69 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.927 0 C-N-CA 126.035 1.734 . . . . 0.0 114.486 -179.171 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 37.0 mtt180 -58.06 -32.98 68.54 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 125.555 1.542 . . . . 0.0 111.665 176.281 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -72.96 -12.6 61.0 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 125.502 1.521 . . . . 0.0 113.774 178.201 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 38.7 p -124.57 5.23 8.26 Favored 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 125.682 1.593 . . . . 0.0 113.56 -179.179 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 83.0 tttt -43.21 -41.98 4.07 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 126.919 2.088 . . . . 0.0 115.335 -178.284 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 1.8 p90 -91.8 -8.22 47.32 Favored 'General case' 0 N--CA 1.474 0.73 0 N-CA-C 114.468 1.284 . . . . 0.0 114.468 -178.773 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 88.4 mt -95.84 -18.19 20.56 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 125.688 1.595 . . . . 0.0 114.766 -175.849 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 2.5 m -75.44 77.35 2.49 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 124.454 1.102 . . . . 0.0 111.898 -178.604 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -75.86 144.63 41.1 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 127.178 2.191 . . . . 0.0 111.534 -179.822 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 11.5 mt-10 -73.57 151.11 41.03 Favored 'General case' 0 N--CA 1.472 0.668 0 O-C-N 120.563 -1.336 . . . . 0.0 111.402 176.014 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 12.3 m -82.82 145.88 7.85 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.789 0 N-CA-C 108.543 -0.91 . . . . 0.0 108.543 173.237 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 42.0 t -60.21 127.52 32.25 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-O 121.687 0.756 . . . . 0.0 111.213 179.643 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.439 ' H ' ' HD2' ' A' ' 20' ' ' ARG . 3.6 mpt_? -60.06 -31.69 70.23 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 124.976 1.311 . . . . 0.0 112.94 -176.585 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 28.9 mm-40 -81.44 -34.86 31.23 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 123.343 0.657 . . . . 0.0 110.777 177.782 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 51.3 t80 -63.99 -24.92 67.9 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 124.364 1.066 . . . . 0.0 111.383 173.942 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 80.7 mt-30 -58.86 -23.9 61.45 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 123.533 0.733 . . . . 0.0 112.919 176.003 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -117.24 13.06 14.56 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 125.508 1.523 . . . . 0.0 111.943 176.895 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 62.06 37.5 94.55 Favored Glycine 0 CA--C 1.533 1.204 0 C-N-CA 125.014 1.293 . . . . 0.0 113.986 -178.937 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 7.2 t -127.24 18.46 7.03 Favored 'General case' 0 N--CA 1.479 1.001 0 N-CA-C 114.688 1.366 . . . . 0.0 114.688 -176.28 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 14.5 t -67.32 172.04 5.26 Favored 'General case' 0 CA--C 1.558 1.279 0 O-C-N 121.572 -0.705 . . . . 0.0 110.319 172.733 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 90.4 p -132.26 8.48 4.33 Favored 'General case' 0 N--CA 1.477 0.897 0 N-CA-C 115.088 1.514 . . . . 0.0 115.088 -176.001 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 62.3 mtm-85 -133.23 146.84 62.64 Favored Pre-proline 0 N--CA 1.471 0.62 0 C-N-CA 125.557 1.543 . . . . 0.0 112.424 -178.098 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 77.6 Cg_endo -69.28 166.74 25.96 Favored 'Trans proline' 0 CA--C 1.543 0.963 0 C-N-CA 121.95 1.767 . . . . 0.0 109.61 171.352 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -53.9 -30.98 48.49 Favored 'General case' 0 N--CA 1.477 0.879 0 O-C-N 121.034 -1.041 . . . . 0.0 112.91 176.781 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 40.5 p -72.94 -6.52 45.79 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 125.93 1.692 . . . . 0.0 115.015 178.637 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 18.5 mt-10 -128.08 -24.17 3.2 Favored 'General case' 0 N--CA 1.477 0.907 0 N-CA-C 115.333 1.605 . . . . 0.0 115.333 -177.773 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 3.1 t -70.18 166.28 20.3 Favored 'General case' 0 CA--C 1.546 0.791 0 N-CA-C 114.979 1.474 . . . . 0.0 114.979 -176.556 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 13.2 mmmm -83.37 -11.42 57.64 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 127.057 2.143 . . . . 0.0 113.1 179.557 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 77.0 m-85 -140.43 173.79 11.16 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 126.417 1.887 . . . . 0.0 110.763 -178.125 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -80.17 152.94 28.93 Favored 'General case' 0 CA--C 1.545 0.778 0 O-C-N 121.224 -0.923 . . . . 0.0 113.224 -178.642 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 61.3 m170 -127.04 90.16 50.13 Favored Pre-proline 0 CA--C 1.552 1.039 0 C-N-CA 125.718 1.607 . . . . 0.0 110.307 179.398 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 33.9 Cg_endo -63.19 165.76 16.31 Favored 'Trans proline' 0 CA--C 1.541 0.85 0 C-N-CA 123.685 2.923 . . . . 0.0 114.903 -178.223 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 85.7 p -128.1 -174.22 3.15 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 126.385 1.874 . . . . 0.0 112.687 178.928 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 61.9 pttt -38.53 -37.51 0.32 Allowed 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 128.823 2.849 . . . . 0.0 117.902 -178.216 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 33.1 p -109.19 -16.4 14.09 Favored 'General case' 0 N--CA 1.476 0.842 0 N-CA-C 115.028 1.492 . . . . 0.0 115.028 -177.898 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 80.4 m -61.21 128.3 35.73 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 124.319 1.048 . . . . 0.0 113.33 -177.764 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 44.6 tt0 -81.71 128.96 34.53 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 125.329 1.452 . . . . 0.0 110.008 178.105 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 17.6 t -122.42 134.07 66.74 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.918 0 C-N-CA 125.489 1.515 . . . . 0.0 109.663 -178.226 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -142.92 130.83 21.64 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 125.142 1.377 . . . . 0.0 110.703 -179.576 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 46.1 36.14 2.95 Favored 'General case' 0 CA--C 1.555 1.148 0 C-N-CA 126.177 1.791 . . . . 0.0 115.169 179.47 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 80.54 19.41 68.62 Favored Glycine 0 CA--C 1.537 1.429 0 O-C-N 120.969 -1.082 . . . . 0.0 114.66 -179.592 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 45.3 mtt180 -137.14 161.25 36.66 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 125.901 1.68 . . . . 0.0 111.179 -179.292 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 3.0 m -138.17 137.75 43.96 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.512 0 C-N-CA 127.143 2.177 . . . . 0.0 109.647 -176.877 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 75.8 mt -87.67 131.04 36.37 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.743 0 O-C-N 121.083 -1.011 . . . . 0.0 109.294 179.273 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -73.84 149.27 41.71 Favored 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 123.91 0.884 . . . . 0.0 111.926 177.694 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 8.0 t -67.38 95.64 0.46 Allowed 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 125.19 1.396 . . . . 0.0 111.681 -177.909 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 22.2 p90 -58.16 -36.63 73.3 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 123.673 0.789 . . . . 0.0 111.176 177.817 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 73.1 m-20 -61.02 -34.89 75.55 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 123.099 0.56 . . . . 0.0 111.863 177.137 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 25.3 p -68.51 -41.61 79.74 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-N 119.019 0.827 . . . . 0.0 111.666 177.4 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 38.5 mt -71.5 -40.24 70.32 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 125.183 1.393 . . . . 0.0 113.187 178.165 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' LYS . . . . . 0.428 ' HE2' ' HA ' ' A' ' 58' ' ' LYS . 11.3 mmpt? -83.46 -10.23 58.5 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 124.794 1.238 . . . . 0.0 114.122 -179.21 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 82.02 39.19 11.88 Favored Glycine 0 CA--C 1.536 1.396 0 C-N-CA 124.319 0.961 . . . . 0.0 114.725 177.773 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 6.9 tpm_? -124.41 -9.78 7.47 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 126.186 1.794 . . . . 0.0 113.863 -178.272 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -56.76 125.12 20.93 Favored 'General case' 0 CA--C 1.544 0.712 0 CA-C-N 119.22 0.918 . . . . 0.0 112.544 -177.349 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 14.7 m -137.93 32.08 2.44 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 126.282 1.833 . . . . 0.0 111.875 -174.658 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 84.0 mtm-85 -130.71 174.11 10.26 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 126.38 1.872 . . . . 0.0 113.418 -175.694 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 76.5 mm-40 -137.83 23.23 2.86 Favored 'General case' 0 CA--C 1.555 1.142 0 C-N-CA 127.65 2.38 . . . . 0.0 109.219 174.075 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 5.5 p-10 -151.67 21.73 0.7 Allowed 'General case' 0 CA--C 1.549 0.94 0 C-N-CA 126.11 1.764 . . . . 0.0 115.075 -171.386 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 38.9 m -51.21 145.01 8.51 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 124.205 1.002 . . . . 0.0 113.696 -178.254 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 24.6 mtmt -88.81 7.79 32.29 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 123.817 0.847 . . . . 0.0 111.682 173.375 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 63.7 m-85 -127.14 148.72 50.16 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 125.818 1.647 . . . . 0.0 111.641 -172.488 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -74.17 117.19 15.69 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 124.168 0.987 . . . . 0.0 113.06 -175.951 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 6.3 m170 -65.21 129.96 94.62 Favored Pre-proline 0 CA--C 1.547 0.835 0 N-CA-C 106.612 -1.625 . . . . 0.0 106.612 170.776 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 83.3 Cg_endo -72.11 120.6 6.91 Favored 'Trans proline' 0 CA--C 1.545 1.057 0 C-N-CA 122.562 2.175 . . . . 0.0 113.142 -172.338 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -75.66 150.85 35.92 Favored 'Trans proline' 0 CA--C 1.541 0.87 0 C-N-CA 122.884 2.39 . . . . 0.0 111.063 178.021 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 84.9 Cg_exo -47.23 -39.01 26.64 Favored 'Trans proline' 0 CA--C 1.537 0.668 0 C-N-CA 123.863 3.042 . . . . 0.0 115.257 179.592 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 7.5 t-80 -69.36 -17.72 63.72 Favored 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 115.057 1.503 . . . . 0.0 115.057 179.452 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 93.4 mt -114.55 -15.61 11.99 Favored 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 124.854 1.262 . . . . 0.0 112.953 178.224 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 57.0 mtpt -54.89 -35.4 64.07 Favored 'General case' 0 N--CA 1.477 0.876 0 CA-C-N 119.736 1.153 . . . . 0.0 111.149 173.591 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 15.3 m -63.3 -41.23 98.94 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 123.902 0.881 . . . . 0.0 111.699 175.917 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 91.0 mm-40 -70.4 -44.44 67.98 Favored 'General case' 0 N--CA 1.468 0.452 0 O-C-N 121.268 -0.895 . . . . 0.0 111.05 177.281 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 95.5 mt -62.5 -40.48 96.86 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 123.748 0.819 . . . . 0.0 111.529 177.629 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 8.2 mm-40 -52.02 -56.12 16.28 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 124.884 1.274 . . . . 0.0 110.639 174.331 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 72.9 mt -68.79 -45.66 80.62 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.25 0 C-N-CA 125.798 1.639 . . . . 0.0 111.977 -173.781 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 38.5 m-80 -64.25 -34.64 78.57 Favored 'General case' 0 CA--C 1.542 0.645 0 CA-C-N 119.069 0.85 . . . . 0.0 111.501 175.878 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -70.25 -52.16 19.01 Favored Glycine 0 CA--C 1.528 0.886 0 C-N-CA 123.684 0.659 . . . . 0.0 111.663 176.738 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 53.0 mtp180 -58.04 -36.18 72.38 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 124.66 1.184 . . . . 0.0 112.485 177.869 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 88.3 m-20 -66.94 -9.59 40.06 Favored 'General case' 0 CA--C 1.551 0.994 0 N-CA-C 113.918 1.081 . . . . 0.0 113.918 175.438 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 58.3 m-80 -120.99 -19.71 7.12 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 125.578 1.551 . . . . 0.0 113.147 178.907 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 47.1 tp -65.28 -24.55 67.34 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 125.814 1.646 . . . . 0.0 112.796 177.826 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 31.2 pt -55.74 150.39 2.63 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.544 0 C-N-CA 127.134 2.173 . . . . 0.0 113.192 178.088 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 78.1 mt-30 -130.74 8.73 4.92 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 125.504 1.521 . . . . 0.0 113.492 -178.932 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 14.5 pt20 -71.13 166.63 21.04 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 125.111 1.364 . . . . 0.0 113.408 178.982 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 8.7 mptt -135.73 160.31 38.93 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 126.23 1.812 . . . . 0.0 110.947 178.31 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 47.2 t-20 . . . . . 0 CA--C 1.542 0.64 0 C-N-CA 125.267 1.427 . . . . 0.0 111.465 -179.841 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.6 ttt . . . . . 0 CA--C 1.545 0.757 0 N-CA-C 112.834 0.679 . . . . 0.0 112.834 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -118.91 5.79 11.41 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 126.09 1.756 . . . . 0.0 113.344 179.722 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 26.9 m -130.4 6.38 2.16 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.197 0 C-N-CA 126.344 1.857 . . . . 0.0 113.02 -179.218 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 63.3 p -121.88 -0.37 9.58 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 125.94 1.696 . . . . 0.0 114.758 -176.995 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 27.4 m -132.44 24.16 1.42 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.199 0 C-N-CA 126.358 1.863 . . . . 0.0 112.497 -178.743 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 41.0 p -58.66 153.46 40.96 Favored Pre-proline 0 N--CA 1.477 0.898 0 C-N-CA 126.307 1.843 . . . . 0.0 113.08 179.739 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -64.0 -15.7 50.69 Favored 'Trans proline' 0 CA--C 1.539 0.749 0 C-N-CA 123.156 2.57 . . . . 0.0 115.311 -178.705 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 45.1 pt -79.19 33.56 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.547 0.848 0 C-N-CA 126.16 1.784 . . . . 0.0 113.987 179.872 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 6.9 mmp_? -52.63 127.35 22.67 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 125.218 1.407 . . . . 0.0 110.856 178.136 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -62.85 145.42 55.1 Favored 'General case' 0 CA--C 1.543 0.696 0 CA-C-O 121.698 0.761 . . . . 0.0 113.001 -179.947 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 32.4 p -134.73 -0.67 2.83 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 126.25 1.82 . . . . 0.0 112.797 177.331 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 20.9 ttmt -54.23 -44.98 72.18 Favored 'General case' 0 N--CA 1.478 0.974 0 CA-C-N 120.077 1.308 . . . . 0.0 111.701 178.41 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -69.54 -25.43 64.01 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 124.541 1.137 . . . . 0.0 113.376 178.003 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 94.7 mt -91.93 -17.52 25.06 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 126.061 1.744 . . . . 0.0 114.762 -177.32 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 17.1 m -78.49 74.7 5.02 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 124.567 1.147 . . . . 0.0 111.534 -177.717 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.5 HD21 HD13 ' A' ' 75' ' ' LEU . 10.4 tp -75.8 147.63 39.05 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 127.399 2.28 . . . . 0.0 112.039 -178.647 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 9.5 mt-10 -73.46 150.84 41.35 Favored 'General case' 0 N--CA 1.473 0.684 0 O-C-N 120.54 -1.35 . . . . 0.0 113.095 179.351 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 17.9 m -82.67 153.25 3.93 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.768 0 C-N-CA 122.833 0.453 . . . . 0.0 111.212 175.201 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 48.2 t -74.29 135.43 42.6 Favored 'General case' 0 CA--C 1.539 0.526 0 N-CA-C 109.766 -0.457 . . . . 0.0 109.766 174.911 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 5.3 mpt_? -71.99 -41.21 67.93 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 125.203 1.401 . . . . 0.0 112.856 -177.087 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 17.1 mm-40 -72.69 -33.72 66.7 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 124.414 1.086 . . . . 0.0 111.773 179.969 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 83.5 t80 -62.18 -26.62 68.44 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 124.093 0.957 . . . . 0.0 111.759 175.29 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 77.4 mm-40 -60.61 -20.92 61.96 Favored 'General case' 0 N--CA 1.478 0.926 0 N-CA-C 113.637 0.977 . . . . 0.0 113.637 176.79 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -117.06 13.72 14.85 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 125.693 1.597 . . . . 0.0 112.106 177.083 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 59.14 36.8 90.2 Favored Glycine 0 CA--C 1.533 1.203 0 C-N-CA 125.092 1.329 . . . . 0.0 114.145 -179.78 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 7.2 t -127.54 13.18 7.0 Favored 'General case' 0 N--CA 1.479 1.01 0 N-CA-C 114.48 1.289 . . . . 0.0 114.48 -175.941 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 27.9 t -62.96 137.6 58.31 Favored 'General case' 0 CA--C 1.551 1.004 0 O-C-N 121.435 -0.79 . . . . 0.0 111.749 177.283 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 32.7 m -77.46 -2.99 38.14 Favored 'General case' 0 N--CA 1.475 0.814 0 N-CA-C 115.604 1.705 . . . . 0.0 115.604 -177.501 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 87.3 mtt180 -135.25 148.23 65.49 Favored Pre-proline 0 N--CA 1.475 0.797 0 C-N-CA 125.687 1.595 . . . . 0.0 112.561 -176.825 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -68.96 166.09 27.77 Favored 'Trans proline' 0 CA--C 1.543 0.959 0 C-N-CA 122.241 1.961 . . . . 0.0 110.132 173.348 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 7.4 p-10 -53.51 -28.66 32.34 Favored 'General case' 0 N--CA 1.475 0.792 0 N-CA-C 114.18 1.178 . . . . 0.0 114.18 178.817 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 12.6 p -77.94 -8.91 58.76 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 125.809 1.644 . . . . 0.0 115.02 178.452 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 39.5 mm-40 -124.9 -19.97 5.1 Favored 'General case' 0 N--CA 1.477 0.895 0 N-CA-C 116.315 1.968 . . . . 0.0 116.315 -172.908 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 4.7 t -69.73 170.13 11.53 Favored 'General case' 0 CA--C 1.551 1.011 0 N-CA-C 114.988 1.477 . . . . 0.0 114.988 -177.05 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -89.15 -6.99 56.56 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 127.877 2.471 . . . . 0.0 113.785 -179.762 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 56.2 m-85 -140.41 169.73 17.12 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 126.23 1.812 . . . . 0.0 110.507 178.328 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -78.61 145.93 34.43 Favored 'General case' 0 CA--C 1.548 0.866 0 O-C-N 121.12 -0.987 . . . . 0.0 113.3 -176.753 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 21.4 m170 -120.38 89.23 43.56 Favored Pre-proline 0 CA--C 1.555 1.141 0 C-N-CA 126.047 1.739 . . . . 0.0 110.535 -178.386 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -67.2 173.24 8.84 Favored 'Trans proline' 0 CA--C 1.542 0.924 0 C-N-CA 123.789 2.993 . . . . 0.0 114.943 -178.651 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 73.8 p -129.28 -178.9 4.85 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 126.089 1.756 . . . . 0.0 111.234 175.212 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 29.9 mtpp -49.89 -31.73 12.86 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 126.42 1.888 . . . . 0.0 115.203 -179.884 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 17.5 m -92.76 -25.63 18.09 Favored 'General case' 0 N--CA 1.477 0.913 0 N-CA-C 114.324 1.231 . . . . 0.0 114.324 -178.619 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 59.2 m -63.16 143.06 58.12 Favored 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 114.615 1.339 . . . . 0.0 114.615 -176.793 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 22.2 mt-30 -85.04 132.33 34.34 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 124.944 1.298 . . . . 0.0 110.844 176.689 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 12.8 t -129.11 135.28 62.36 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.731 0 C-N-CA 124.919 1.288 . . . . 0.0 110.677 -178.454 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -146.31 131.88 18.79 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 125.057 1.343 . . . . 0.0 111.234 178.218 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 63.0 t30 41.98 37.71 0.89 Allowed 'General case' 0 CA--C 1.553 1.076 0 C-N-CA 126.835 2.054 . . . . 0.0 116.379 177.405 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 85.78 16.17 64.1 Favored Glycine 0 CA--C 1.536 1.386 0 O-C-N 120.944 -1.098 . . . . 0.0 114.987 -179.751 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 66.5 mtt180 -136.02 161.15 36.47 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 125.6 1.56 . . . . 0.0 111.388 -179.633 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 3.1 m -139.21 144.24 29.64 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.62 0 C-N-CA 127.433 2.293 . . . . 0.0 109.562 -176.965 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 8.7 mt -94.81 126.72 47.18 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.764 0 O-C-N 121.385 -0.822 . . . . 0.0 110.811 -176.746 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -71.15 147.53 48.27 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 124.311 1.045 . . . . 0.0 112.032 178.186 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 23.7 t -70.27 99.87 1.61 Allowed 'General case' 0 C--O 1.24 0.563 0 C-N-CA 125.06 1.344 . . . . 0.0 112.301 -177.894 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 41.0 p90 -61.68 -38.18 86.84 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 115.413 -0.812 . . . . 0.0 110.316 175.531 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 62.2 m-20 -60.72 -44.33 96.77 Favored 'General case' 0 CA--C 1.539 0.545 0 O-C-N 121.856 -0.527 . . . . 0.0 110.444 176.402 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 37.7 t -64.48 -42.91 95.59 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 119.761 1.164 . . . . 0.0 111.447 177.51 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 30.7 mt -62.13 -40.46 96.0 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 124.179 0.992 . . . . 0.0 113.049 176.625 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 31.2 mmmt -83.19 -9.46 59.15 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 124.99 1.316 . . . . 0.0 113.856 179.266 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 81.82 38.36 14.04 Favored Glycine 0 CA--C 1.536 1.402 0 C-N-CA 124.642 1.115 . . . . 0.0 114.269 179.281 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 19.7 tpp180 -120.46 -22.4 6.47 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 126.568 1.947 . . . . 0.0 114.67 -176.893 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 5.4 t -66.25 144.79 56.39 Favored 'General case' 0 CA--C 1.546 0.789 0 CA-C-N 119.277 0.944 . . . . 0.0 113.372 -177.391 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 86.6 p -153.68 9.07 0.39 Allowed 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 126.799 2.04 . . . . 0.0 113.164 179.682 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 76.4 mtm-85 -67.82 162.89 23.02 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 126.137 1.775 . . . . 0.0 113.969 -178.349 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -122.97 8.29 9.3 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 126.376 1.87 . . . . 0.0 112.181 176.512 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -152.34 33.15 0.52 Allowed 'General case' 0 CA--C 1.551 1.012 0 C-N-CA 127.885 2.474 . . . . 0.0 110.053 -179.712 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 7.0 t -51.17 125.61 14.42 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 125.636 1.574 . . . . 0.0 112.276 -176.679 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 32.2 mtmt -84.8 8.15 18.26 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 124.742 1.217 . . . . 0.0 114.137 -176.971 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 89.0 m-85 -128.61 157.74 40.43 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 125.696 1.598 . . . . 0.0 111.488 -177.066 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -79.5 114.02 18.11 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 124.122 0.969 . . . . 0.0 112.289 -177.015 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 10.4 m170 -68.62 119.17 66.97 Favored Pre-proline 0 CA--C 1.545 0.764 0 N-CA-C 105.7 -1.963 . . . . 0.0 105.7 170.966 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -71.46 128.86 14.99 Favored 'Trans proline' 0 CA--C 1.542 0.906 0 C-N-CA 121.865 1.71 . . . . 0.0 114.556 -169.906 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 97.6 Cg_endo -78.69 155.22 27.3 Favored 'Trans proline' 0 CA--C 1.543 0.929 0 C-N-CA 123.403 2.735 . . . . 0.0 112.116 178.751 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 82.9 Cg_exo -45.97 -39.81 19.91 Favored 'Trans proline' 0 CA--C 1.54 0.782 0 C-N-CA 124.454 3.436 . . . . 0.0 115.976 179.385 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 18.3 m-70 -71.48 -15.71 62.33 Favored 'General case' 0 N--CA 1.477 0.89 0 N-CA-C 114.965 1.468 . . . . 0.0 114.965 179.356 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.5 HD13 HD21 ' A' ' 16' ' ' LEU . 78.6 mt -115.36 -18.06 11.13 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 124.468 1.107 . . . . 0.0 113.109 -179.776 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 59.2 mtpt -54.56 -38.23 66.41 Favored 'General case' 0 N--CA 1.476 0.849 0 CA-C-N 119.661 1.119 . . . . 0.0 111.328 173.872 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 25.0 m -62.58 -42.66 99.69 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 124.115 0.966 . . . . 0.0 111.673 176.235 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 89.4 mm-40 -67.25 -44.58 79.05 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 123.739 0.815 . . . . 0.0 110.807 178.323 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 93.2 mt -62.24 -46.54 88.41 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 123.992 0.917 . . . . 0.0 112.341 178.417 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -65.14 -30.48 71.41 Favored 'General case' 0 N--CA 1.476 0.838 0 CA-C-N 120.044 1.293 . . . . 0.0 113.191 178.863 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 64.1 mt -71.73 -43.49 70.04 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.757 0 O-C-N 121.367 -0.833 . . . . 0.0 109.583 175.744 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 22.8 m-80 -64.96 -33.72 76.7 Favored 'General case' 0 CA--C 1.542 0.654 0 O-C-N 121.683 -0.636 . . . . 0.0 111.289 174.826 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -62.86 -48.32 81.89 Favored Glycine 0 CA--C 1.528 0.848 0 C-N-CA 124.518 1.056 . . . . 0.0 111.414 177.193 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 82.2 mtt85 -55.21 -32.7 62.46 Favored 'General case' 0 N--CA 1.482 1.128 0 CA-C-N 118.477 1.139 . . . . 0.0 112.926 175.833 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 17.0 t-20 -78.7 -9.25 59.34 Favored 'General case' 0 CA--C 1.552 1.034 0 C-N-CA 125.105 1.362 . . . . 0.0 114.13 178.582 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 63.7 m-80 -126.13 -25.93 3.47 Favored 'General case' 0 N--CA 1.476 0.868 0 N-CA-C 114.923 1.453 . . . . 0.0 114.923 -177.399 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 95.0 mt -78.25 43.83 0.47 Allowed 'General case' 0 CA--C 1.551 1.018 0 C-N-CA 126.459 1.904 . . . . 0.0 111.574 176.877 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 97.3 mt -60.64 -28.21 42.27 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.823 0 C-N-CA 127.107 2.163 . . . . 0.0 112.986 -177.129 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 1.9 tm0? -139.12 133.84 32.06 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.643 1.177 . . . . 0.0 110.585 179.141 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 6.6 tp-100 -50.68 -29.6 11.6 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 126.373 1.869 . . . . 0.0 115.415 -177.572 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 59.8 mttp -62.05 -22.24 65.59 Favored 'General case' 0 N--CA 1.476 0.866 0 N-CA-C 114.76 1.393 . . . . 0.0 114.76 179.724 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 32.6 t-20 . . . . . 0 N--CA 1.471 0.608 0 CA-C-N 119.635 1.107 . . . . 0.0 112.974 179.129 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.541 0.624 0 N-CA-C 113.936 1.087 . . . . 0.0 113.936 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 81.8 mt -95.06 -22.25 18.03 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 125.894 1.677 . . . . 0.0 114.344 -177.174 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 4.6 m -73.53 74.67 1.46 Allowed 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 125.035 1.334 . . . . 0.0 111.206 -179.238 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.545 HD21 HD13 ' A' ' 75' ' ' LEU . 8.5 tp -75.65 142.66 42.53 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 127.234 2.213 . . . . 0.0 111.64 -177.62 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 12.8 mt-10 -72.17 152.15 42.46 Favored 'General case' 0 N--CA 1.47 0.548 0 O-C-N 120.684 -1.26 . . . . 0.0 112.796 179.613 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 14.9 m -84.01 153.44 3.72 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.811 0 C-N-CA 122.737 0.415 . . . . 0.0 110.483 175.093 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 34.9 t -73.48 134.01 43.79 Favored 'General case' 0 CA--C 1.539 0.528 0 N-CA-C 109.724 -0.472 . . . . 0.0 109.724 175.77 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 5.7 mpt_? -68.99 -43.18 75.39 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 124.898 1.279 . . . . 0.0 112.675 -176.958 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 12.8 mm-40 -70.41 -34.49 72.58 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 124.461 1.105 . . . . 0.0 111.947 -179.549 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 78.3 t80 -61.92 -27.0 68.51 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 124.145 0.978 . . . . 0.0 111.753 175.553 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 71.7 mm-40 -61.86 -21.5 64.72 Favored 'General case' 0 N--CA 1.478 0.93 0 N-CA-C 113.734 1.013 . . . . 0.0 113.734 177.185 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -118.62 13.66 13.41 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 125.521 1.528 . . . . 0.0 112.054 177.375 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 59.83 37.11 92.03 Favored Glycine 0 CA--C 1.533 1.165 0 C-N-CA 124.821 1.2 . . . . 0.0 113.933 -179.207 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 6.1 t -124.93 16.26 8.57 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 124.563 1.145 . . . . 0.0 113.66 -176.446 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 12.4 t -66.0 169.96 6.15 Favored 'General case' 0 CA--C 1.558 1.26 0 C-N-CA 124.245 1.018 . . . . 0.0 111.048 173.978 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 94.5 p -128.82 4.01 5.42 Favored 'General case' 0 N--CA 1.477 0.918 0 N-CA-C 115.673 1.731 . . . . 0.0 115.673 -175.646 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 53.1 mtt-85 -133.39 147.29 64.26 Favored Pre-proline 0 N--CA 1.474 0.744 0 C-N-CA 126.12 1.768 . . . . 0.0 111.027 179.403 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 93.5 Cg_endo -72.64 167.73 26.35 Favored 'Trans proline' 0 CA--C 1.541 0.836 0 C-N-CA 122.251 1.968 . . . . 0.0 109.929 175.42 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -53.91 -30.12 44.89 Favored 'General case' 0 N--CA 1.474 0.766 0 O-C-N 121.32 -0.863 . . . . 0.0 112.936 176.329 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 28.1 p -73.95 -10.21 59.41 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 125.536 1.534 . . . . 0.0 115.059 178.427 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -135.25 -13.4 2.08 Favored 'General case' 0 N--CA 1.478 0.952 0 N-CA-C 116.818 2.155 . . . . 0.0 116.818 -176.132 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 5.1 t -70.62 162.3 29.18 Favored 'General case' 0 CA--C 1.552 1.024 0 CA-C-N 120.553 1.524 . . . . 0.0 113.709 -178.969 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -77.01 -12.19 59.9 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 126.78 2.032 . . . . 0.0 114.106 -179.814 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 62.0 m-85 -137.92 172.87 12.3 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 126.191 1.797 . . . . 0.0 110.571 179.287 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -80.67 149.94 29.58 Favored 'General case' 0 CA--C 1.549 0.915 0 O-C-N 121.147 -0.97 . . . . 0.0 113.097 -177.311 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 65.3 m170 -124.81 89.9 51.78 Favored Pre-proline 0 CA--C 1.552 1.021 0 C-N-CA 125.828 1.651 . . . . 0.0 111.243 -179.097 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 31.1 Cg_endo -62.08 143.05 94.38 Favored 'Trans proline' 0 CA--C 1.542 0.907 0 C-N-CA 123.11 2.54 . . . . 0.0 112.729 179.542 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 45.8 p -80.13 -84.94 0.09 Allowed 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 124.799 1.24 . . . . 0.0 113.678 -178.732 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 35.7 mtmm -144.49 -55.87 0.35 Allowed 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 126.979 2.112 . . . . 0.0 111.579 -179.054 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 35.3 m -76.27 -17.95 59.22 Favored 'General case' 0 N--CA 1.477 0.914 0 N-CA-C 113.234 0.828 . . . . 0.0 113.234 178.184 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 73.9 m -57.34 124.19 18.02 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 124.801 1.24 . . . . 0.0 112.341 179.942 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 56.8 tt0 -87.67 134.85 33.58 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 124.869 1.267 . . . . 0.0 110.566 179.169 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 1.6 m -124.3 148.32 28.57 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.599 0 C-N-CA 125.315 1.446 . . . . 0.0 110.937 179.85 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 70.9 mm-40 -141.32 133.57 28.02 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 125.302 1.441 . . . . 0.0 110.152 179.312 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 63.1 t30 44.23 35.8 1.36 Allowed 'General case' 0 CA--C 1.555 1.144 0 N-CA-C 116.002 1.853 . . . . 0.0 116.002 177.963 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 83.9 20.14 60.06 Favored Glycine 0 CA--C 1.538 1.512 0 O-C-N 120.914 -1.116 . . . . 0.0 114.823 -179.246 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 43.1 mtt180 -139.34 163.46 32.43 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 125.703 1.601 . . . . 0.0 111.843 -178.69 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 2.9 m -137.29 135.13 47.27 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.692 0 C-N-CA 126.942 2.097 . . . . 0.0 110.276 -177.719 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 78.4 mt -83.9 125.85 40.18 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.546 0 O-C-N 121.541 -0.724 . . . . 0.0 109.855 -179.202 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -70.72 143.66 51.21 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 123.8 0.84 . . . . 0.0 110.447 176.358 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 17.2 t -65.08 98.86 0.32 Allowed 'General case' 0 C--O 1.239 0.536 0 C-N-CA 124.494 1.117 . . . . 0.0 113.091 -176.921 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 33.4 p90 -62.37 -37.36 85.42 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 115.188 -0.915 . . . . 0.0 109.971 175.391 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 70.7 m-20 -61.46 -43.61 98.56 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 118.522 0.601 . . . . 0.0 110.394 176.339 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 40.2 t -64.88 -43.32 93.3 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 119.773 1.169 . . . . 0.0 111.488 177.336 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 25.8 mt -64.64 -42.73 95.26 Favored 'General case' 0 CA--C 1.543 0.699 0 N-CA-C 113.555 0.946 . . . . 0.0 113.555 177.246 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 31.0 mmmt -80.59 -18.63 47.68 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 124.713 1.205 . . . . 0.0 113.836 -179.427 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 96.21 41.32 3.76 Favored Glycine 0 CA--C 1.537 1.454 0 C-N-CA 124.582 1.087 . . . . 0.0 114.943 177.911 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 50.5 tpt85 -126.75 -22.3 3.91 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 126.247 1.819 . . . . 0.0 115.213 -177.343 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 5.0 t . . . . . 0 CA--C 1.545 0.775 0 CA-C-N 119.997 1.271 . . . . 0.0 113.714 -175.737 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 9.1 t . . . . . 0 CA--C 1.544 0.72 0 CA-C-O 121.413 0.625 . . . . 0.0 111.409 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 23.6 mtmt -82.43 1.03 39.43 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 123.922 0.889 . . . . 0.0 113.242 -178.645 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 76.4 m-85 -120.37 150.01 41.43 Favored 'General case' 0 C--N 1.326 -0.429 0 C-N-CA 124.581 1.152 . . . . 0.0 111.611 -174.413 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -75.09 111.66 10.54 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 123.411 0.685 . . . . 0.0 111.99 -176.323 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 11.5 m170 -65.26 119.83 62.49 Favored Pre-proline 0 CA--C 1.545 0.787 0 N-CA-C 105.212 -2.144 . . . . 0.0 105.212 171.413 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -69.06 125.18 12.18 Favored 'Trans proline' 0 CA--C 1.543 0.94 0 C-N-CA 122.028 1.819 . . . . 0.0 114.528 -169.803 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 90.3 Cg_endo -78.02 154.87 29.7 Favored 'Trans proline' 0 CA--C 1.542 0.882 0 C-N-CA 123.403 2.735 . . . . 0.0 111.734 178.851 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 81.2 Cg_exo -47.47 -41.74 29.09 Favored 'Trans proline' 0 CA--C 1.538 0.723 0 C-N-CA 123.905 3.07 . . . . 0.0 115.176 179.287 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 6.4 t60 -65.35 -22.82 66.86 Favored 'General case' 0 N--CA 1.476 0.843 0 N-CA-C 114.437 1.273 . . . . 0.0 114.437 179.267 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.545 HD13 HD21 ' A' ' 16' ' ' LEU . 67.7 mt -111.11 -17.89 13.13 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 124.332 1.053 . . . . 0.0 113.027 -179.608 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 25.5 mtpp -55.96 -38.55 70.51 Favored 'General case' 0 N--CA 1.475 0.816 0 CA-C-N 120.144 1.338 . . . . 0.0 110.882 173.678 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 24.0 m -59.27 -43.3 92.51 Favored 'General case' 0 N--CA 1.474 0.734 0 CA-C-N 118.621 0.646 . . . . 0.0 110.933 176.62 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 17.4 mm100 -67.71 -47.88 68.1 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 123.537 0.735 . . . . 0.0 111.101 177.647 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 88.4 mt -60.76 -40.82 93.93 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 124.168 0.987 . . . . 0.0 112.618 178.462 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -55.34 -52.75 62.49 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 124.416 1.087 . . . . 0.0 110.6 175.226 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 73.3 mt -69.61 -37.94 75.45 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.436 0 C-N-CA 125.81 1.644 . . . . 0.0 111.386 -176.27 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 93.1 m-20 -63.82 -40.64 97.09 Favored 'General case' 0 CA--C 1.543 0.675 0 O-C-N 121.586 -0.696 . . . . 0.0 110.372 173.87 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.918 0 C-N-CA 124.139 0.876 . . . . 0.0 111.679 177.657 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.474 0.734 0 N-CA-C 113.865 1.061 . . . . 0.0 113.865 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 78.3 mt -95.53 -18.69 20.42 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 126.489 1.916 . . . . 0.0 114.199 -178.328 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 7.2 m -78.41 79.4 4.85 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 125.082 1.353 . . . . 0.0 110.762 -178.138 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -76.55 144.4 39.71 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 128.196 2.598 . . . . 0.0 111.075 -177.569 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 9.2 mt-10 -73.74 150.83 40.89 Favored 'General case' 0 N--CA 1.472 0.665 0 O-C-N 120.788 -1.195 . . . . 0.0 111.659 175.789 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 16.3 m -81.14 149.05 5.09 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.783 0 N-CA-C 109.404 -0.591 . . . . 0.0 109.404 173.568 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 42.4 t -63.9 126.86 29.02 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-O 121.98 0.895 . . . . 0.0 111.244 179.08 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 3.3 mpt_? -63.7 -26.02 68.47 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 124.743 1.217 . . . . 0.0 113.151 -177.317 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 13.9 mm-40 -82.8 -37.77 24.04 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-O 121.136 0.493 . . . . 0.0 109.785 177.017 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 61.2 t80 -62.67 -30.37 71.33 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 124.759 1.224 . . . . 0.0 111.076 174.677 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 79.5 mt-30 -59.48 -21.41 60.07 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.667 0.787 . . . . 0.0 112.869 175.088 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 3.5 mpt_? -118.33 14.47 13.82 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 126.171 1.788 . . . . 0.0 111.842 178.009 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 58.48 36.38 84.29 Favored Glycine 0 CA--C 1.534 1.251 0 C-N-CA 125.225 1.393 . . . . 0.0 114.194 -179.992 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 6.7 t -128.49 16.63 6.5 Favored 'General case' 0 N--CA 1.476 0.87 0 N-CA-C 114.727 1.38 . . . . 0.0 114.727 -175.85 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 10.2 t -68.06 172.05 6.12 Favored 'General case' 0 CA--C 1.559 1.289 0 O-C-N 121.542 -0.724 . . . . 0.0 110.487 173.104 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 51.1 m -133.98 11.88 3.95 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 125.332 1.453 . . . . 0.0 114.764 -176.114 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 70.2 mtm-85 -134.85 146.38 58.56 Favored Pre-proline 0 N--CA 1.476 0.843 0 C-N-CA 125.281 1.433 . . . . 0.0 112.625 -176.906 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -68.68 166.15 27.04 Favored 'Trans proline' 0 CA--C 1.542 0.885 0 C-N-CA 122.154 1.903 . . . . 0.0 109.96 172.457 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 -54.24 -27.75 36.8 Favored 'General case' 0 N--CA 1.474 0.764 0 N-CA-C 113.725 1.009 . . . . 0.0 113.725 177.762 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 11.7 p -76.82 -11.88 59.89 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 125.491 1.516 . . . . 0.0 114.953 178.588 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 51.2 mm-40 -119.59 -27.26 5.55 Favored 'General case' 0 N--CA 1.476 0.869 0 N-CA-C 116.063 1.875 . . . . 0.0 116.063 -174.468 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 3.3 t -67.93 163.77 21.34 Favored 'General case' 0 CA--C 1.548 0.872 0 N-CA-C 115.773 1.768 . . . . 0.0 115.773 -175.033 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.61 -11.94 59.99 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 127.881 2.472 . . . . 0.0 112.659 -179.989 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 75.6 m-85 -143.07 172.99 11.96 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 126.711 2.004 . . . . 0.0 110.138 179.957 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -79.32 152.56 30.41 Favored 'General case' 0 CA--C 1.547 0.848 0 N-CA-C 114.291 1.219 . . . . 0.0 114.291 -177.787 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 63.3 m170 -126.43 89.6 51.84 Favored Pre-proline 0 CA--C 1.551 0.99 0 C-N-CA 126.138 1.775 . . . . 0.0 109.637 178.21 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 33.6 Cg_endo -63.48 148.08 92.8 Favored 'Trans proline' 0 CA--C 1.539 0.775 0 C-N-CA 123.052 2.501 . . . . 0.0 114.648 -177.367 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 58.2 p -87.29 -173.47 4.41 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 125.445 1.498 . . . . 0.0 112.245 176.061 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 67.9 mttm -62.42 -19.38 63.41 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 125.704 1.602 . . . . 0.0 113.478 173.828 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 61.1 p -109.11 -24.04 11.36 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 125.062 1.345 . . . . 0.0 114.326 -179.965 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 82.6 m -60.98 129.13 39.85 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-N 119.329 0.968 . . . . 0.0 112.902 179.839 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 67.1 tp60 -81.41 135.1 35.64 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 124.171 0.988 . . . . 0.0 110.411 177.628 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 15.0 t -117.48 144.68 24.73 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.819 0 C-N-CA 125.693 1.597 . . . . 0.0 109.299 -179.823 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 50.3 mt-10 -146.16 124.43 12.26 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 125.698 1.599 . . . . 0.0 110.404 179.5 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 62.9 t30 43.64 36.94 1.35 Allowed 'General case' 0 CA--C 1.554 1.133 0 N-CA-C 116.357 1.984 . . . . 0.0 116.357 178.043 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 86.49 16.96 61.17 Favored Glycine 0 CA--C 1.537 1.457 0 O-C-N 120.929 -1.107 . . . . 0.0 114.875 -179.873 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 62.8 mtt180 -138.24 163.73 31.01 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 126.373 1.869 . . . . 0.0 110.807 -179.536 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 5.1 m -139.63 144.2 29.12 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.506 0 C-N-CA 126.994 2.118 . . . . 0.0 109.323 -177.918 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 60.4 mt -94.06 132.82 37.1 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.729 0 O-C-N 121.146 -0.971 . . . . 0.0 110.112 -177.925 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -74.43 148.99 40.64 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 124.156 0.982 . . . . 0.0 112.465 178.344 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 7.8 t -69.2 95.72 0.78 Allowed 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 125.025 1.33 . . . . 0.0 109.981 179.531 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 27.2 p90 -58.01 -36.32 72.51 Favored 'General case' 0 N--CA 1.467 0.385 0 C-N-CA 123.439 0.695 . . . . 0.0 111.417 179.373 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 74.5 m-20 -58.5 -36.23 73.46 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.439 0.696 . . . . 0.0 111.447 177.144 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 47.7 t -70.87 -38.22 73.09 Favored 'General case' 0 CA--C 1.54 0.583 0 O-C-N 121.149 -0.969 . . . . 0.0 111.642 178.251 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 50.0 mt -69.26 -42.66 75.29 Favored 'General case' 0 N--CA 1.474 0.732 0 O-C-N 121.316 -0.865 . . . . 0.0 112.352 175.205 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 31.3 mmmt -75.56 -9.94 59.02 Favored 'General case' 0 N--CA 1.478 0.925 0 C-N-CA 125.038 1.335 . . . . 0.0 113.844 -179.992 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 78.44 37.06 28.55 Favored Glycine 0 CA--C 1.536 1.346 0 C-N-CA 124.414 1.007 . . . . 0.0 113.82 179.519 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 51.1 ttp180 -119.86 -22.55 6.74 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 126.852 2.061 . . . . 0.0 114.256 -177.016 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 3.7 t . . . . . 0 CA--C 1.545 0.771 0 CA-C-O 122.245 1.021 . . . . 0.0 113.604 -177.639 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 86.2 m . . . . . 0 CA--C 1.543 0.677 0 N-CA-C 113.684 0.994 . . . . 0.0 113.684 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 43.0 mtmt -93.42 9.15 37.67 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 124.698 1.199 . . . . 0.0 111.16 173.188 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 70.1 m-85 -129.91 149.27 51.71 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 126.797 2.039 . . . . 0.0 111.351 -173.602 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -74.74 117.1 16.19 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 124.312 1.045 . . . . 0.0 112.901 -176.046 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 1.8 m-70 -67.67 121.58 79.91 Favored Pre-proline 0 CA--C 1.544 0.726 0 CA-C-O 118.194 -0.908 . . . . 0.0 108.829 173.994 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 67.6 Cg_exo -45.68 107.7 0.12 Allowed 'Trans proline' 0 CA--C 1.543 0.969 0 C-N-CA 124.894 3.729 . . . . 0.0 115.392 -178.649 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 98.4 Cg_endo -76.34 155.25 36.79 Favored 'Trans proline' 0 CA--C 1.541 0.857 0 C-N-CA 121.515 1.476 . . . . 0.0 110.606 176.362 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_endo -56.19 -29.68 76.57 Favored 'Trans proline' 0 CA--C 1.54 0.816 0 C-N-CA 123.169 2.579 . . . . 0.0 114.839 -177.664 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 11.8 m-70 -80.15 -14.44 58.47 Favored 'General case' 0 N--CA 1.476 0.853 0 N-CA-C 114.598 1.333 . . . . 0.0 114.598 177.238 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 73.6 mt -116.18 -15.84 11.04 Favored 'General case' 0 N--CA 1.476 0.833 0 CA-C-N 119.394 0.997 . . . . 0.0 113.353 179.63 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 67.2 mttt -52.5 -37.43 57.37 Favored 'General case' 0 N--CA 1.476 0.873 0 CA-C-N 119.76 1.163 . . . . 0.0 111.186 173.273 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 19.4 m -63.37 -44.25 95.29 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 123.722 0.809 . . . . 0.0 111.21 176.431 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 18.5 mm100 -67.93 -42.93 80.28 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 124.067 0.947 . . . . 0.0 111.546 178.636 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 80.5 mt -61.47 -47.59 84.96 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 123.846 0.858 . . . . 0.0 110.996 177.284 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 3.8 pt-20 -64.54 -37.2 86.74 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 119.651 1.114 . . . . 0.0 112.232 177.615 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 60.7 mt -62.9 -46.66 95.78 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.691 0 CA-C-N 119.395 0.998 . . . . 0.0 110.051 177.216 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 16.1 t-20 -63.35 -41.01 98.83 Favored 'General case' 0 CA--C 1.545 0.767 0 CA-C-N 118.598 0.635 . . . . 0.0 111.091 177.585 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 1.258 0 O-C-N 121.421 -0.799 . . . . 0.0 111.924 176.942 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.474 0.771 0 N-CA-C 114.224 1.194 . . . . 0.0 114.224 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 96.2 mt -91.3 -9.93 43.22 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 127.233 2.213 . . . . 0.0 114.954 -176.542 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 7.5 m -78.28 79.18 4.73 Favored 'General case' 0 N--CA 1.475 0.818 0 CA-C-O 122.336 1.065 . . . . 0.0 110.705 -179.175 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.407 HD21 HD13 ' A' ' 75' ' ' LEU . 12.4 tp -75.79 142.0 42.4 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 128.81 2.844 . . . . 0.0 112.023 -177.6 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -70.29 150.17 46.64 Favored 'General case' 0 N--CA 1.475 0.786 0 O-C-N 120.46 -1.4 . . . . 0.0 112.137 177.083 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 27.2 m -84.86 151.97 3.72 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.88 0 N-CA-C 109.676 -0.49 . . . . 0.0 109.676 172.104 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 51.3 t -67.54 125.78 27.25 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-O 121.804 0.812 . . . . 0.0 111.434 178.209 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 3.0 mpt_? -63.91 -26.21 68.49 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 124.763 1.225 . . . . 0.0 112.954 -178.158 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 11.1 mm-40 -81.79 -38.4 25.64 Favored 'General case' 0 CA--C 1.538 0.492 0 N-CA-C 109.662 -0.496 . . . . 0.0 109.662 176.877 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 59.7 t80 -63.84 -33.41 75.62 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 124.782 1.233 . . . . 0.0 110.969 175.093 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 84.7 mt-30 -59.31 -24.07 62.99 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 123.701 0.801 . . . . 0.0 112.396 174.277 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 72.9 mtt85 -114.95 12.49 16.81 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 126.453 1.901 . . . . 0.0 112.582 -175.582 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 58.19 34.95 75.51 Favored Glycine 0 CA--C 1.534 1.231 0 C-N-CA 125.256 1.407 . . . . 0.0 113.927 -179.828 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 6.7 t -131.89 14.67 4.8 Favored 'General case' 0 N--CA 1.474 0.762 0 N-CA-C 114.942 1.46 . . . . 0.0 114.942 -175.169 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 8.8 t -67.69 172.54 5.12 Favored 'General case' 0 CA--C 1.557 1.214 0 O-C-N 121.366 -0.834 . . . . 0.0 110.689 173.822 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 89.9 p -140.48 10.69 2.29 Favored 'General case' 0 N--CA 1.477 0.905 0 N-CA-C 115.349 1.611 . . . . 0.0 115.349 -176.309 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 59.0 mtm-85 -131.72 147.08 64.58 Favored Pre-proline 0 N--CA 1.474 0.731 0 C-N-CA 125.522 1.529 . . . . 0.0 112.405 -178.074 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -68.52 165.96 27.39 Favored 'Trans proline' 0 CA--C 1.542 0.889 0 C-N-CA 121.943 1.762 . . . . 0.0 109.633 171.82 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 7.1 p-10 -53.31 -31.8 45.8 Favored 'General case' 0 N--CA 1.473 0.724 0 O-C-N 121.268 -0.895 . . . . 0.0 113.244 177.826 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 22.7 p -72.76 -9.36 58.56 Favored 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 115.136 1.532 . . . . 0.0 115.136 178.468 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 19.8 mt-10 -122.47 -25.41 4.77 Favored 'General case' 0 N--CA 1.477 0.882 0 N-CA-C 115.9 1.815 . . . . 0.0 115.9 -176.421 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 3.0 t -69.68 164.02 24.37 Favored 'General case' 0 CA--C 1.547 0.829 0 N-CA-C 115.195 1.554 . . . . 0.0 115.195 -176.614 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -79.51 -11.14 59.9 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 127.186 2.194 . . . . 0.0 113.764 -179.495 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 65.9 m-85 -141.67 175.55 9.61 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 126.393 1.877 . . . . 0.0 110.673 -179.446 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -79.58 149.97 31.21 Favored 'General case' 0 CA--C 1.547 0.85 0 O-C-N 120.986 -1.071 . . . . 0.0 113.253 -178.078 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 65.2 m170 -123.88 91.99 49.0 Favored Pre-proline 0 CA--C 1.55 0.962 0 C-N-CA 125.785 1.634 . . . . 0.0 110.412 178.859 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_endo -63.0 162.3 26.41 Favored 'Trans proline' 0 CA--C 1.54 0.81 0 C-N-CA 123.356 2.704 . . . . 0.0 114.155 -179.224 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 84.6 p -131.6 -172.26 2.81 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 125.858 1.663 . . . . 0.0 112.531 178.84 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 60.4 pttt -27.14 -48.84 0.04 OUTLIER 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 129.345 3.058 . . . . 0.0 118.425 -175.997 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 5.5 p -109.66 -12.11 14.68 Favored 'General case' 0 N--CA 1.475 0.806 0 N-CA-C 115.697 1.74 . . . . 0.0 115.697 -176.286 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 66.7 m -57.9 128.63 38.04 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 124.546 1.138 . . . . 0.0 113.977 -176.835 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 44.4 tt0 -81.0 125.72 30.5 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 125.575 1.55 . . . . 0.0 110.215 178.333 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 23.2 t -119.67 133.43 66.47 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.976 0 C-N-CA 125.861 1.665 . . . . 0.0 109.608 -178.222 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -144.74 131.39 19.99 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 124.859 1.264 . . . . 0.0 111.504 -179.205 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 62.6 t30 41.41 38.01 0.76 Allowed 'General case' 0 CA--C 1.552 1.043 0 C-N-CA 127.277 2.231 . . . . 0.0 116.714 177.475 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 88.25 15.41 60.63 Favored Glycine 0 CA--C 1.535 1.324 0 O-C-N 120.979 -1.076 . . . . 0.0 114.975 179.536 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 31.6 mtt180 -139.43 168.3 20.13 Favored 'General case' 0 N--CA 1.467 0.4 0 C-N-CA 126.209 1.804 . . . . 0.0 112.185 -179.355 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 2.2 m -141.31 140.31 31.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 C-N-CA 127.737 2.415 . . . . 0.0 108.79 -178.914 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 47.2 mt -89.23 126.19 42.23 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.608 0 O-C-N 121.098 -1.001 . . . . 0.0 109.727 -179.336 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -71.66 146.83 48.02 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 124.071 0.948 . . . . 0.0 111.436 177.303 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 14.7 t -69.1 99.1 1.06 Allowed 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 124.752 1.221 . . . . 0.0 113.03 -177.072 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 28.1 p90 -61.18 -37.73 83.97 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 115.263 -0.88 . . . . 0.0 109.939 174.746 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 75.3 m-20 -62.25 -43.54 98.6 Favored 'General case' 0 CA--C 1.538 0.501 0 O-C-N 121.776 -0.578 . . . . 0.0 110.665 177.293 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 46.6 t -63.83 -44.14 94.13 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 119.633 1.106 . . . . 0.0 111.3 177.313 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 43.7 mt -62.8 -42.24 99.63 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 124.082 0.953 . . . . 0.0 113.294 176.85 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 31.4 mmmt -80.61 -12.65 59.48 Favored 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 124.904 1.281 . . . . 0.0 113.839 179.876 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 85.99 38.42 8.61 Favored Glycine 0 CA--C 1.538 1.485 0 C-N-CA 124.6 1.095 . . . . 0.0 114.274 179.225 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 49.2 ttp180 -122.07 -20.39 6.29 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 126.721 2.008 . . . . 0.0 114.808 -176.825 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 5.6 t . . . . . 0 CA--C 1.546 0.808 0 CA-C-N 119.393 0.997 . . . . 0.0 113.187 -178.187 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 8.9 t . . . . . 0 CA--C 1.543 0.703 0 CA-C-O 121.202 0.525 . . . . 0.0 111.396 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 17.1 mtmt -83.94 0.26 48.59 Favored 'General case' 0 N--CA 1.476 0.838 0 N-CA-C 113.715 1.006 . . . . 0.0 113.715 -178.843 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 72.2 m-85 -120.96 152.07 38.96 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 122.216 1.008 . . . . 0.0 112.231 -173.21 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -75.61 113.37 12.97 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 123.547 0.739 . . . . 0.0 111.766 -176.656 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 15.4 m170 -68.09 116.4 38.58 Favored Pre-proline 0 CA--C 1.546 0.823 0 N-CA-C 105.126 -2.176 . . . . 0.0 105.126 171.256 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 66.3 Cg_endo -70.16 132.14 22.09 Favored 'Trans proline' 0 CA--C 1.543 0.932 0 C-N-CA 121.917 1.744 . . . . 0.0 114.393 -169.86 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_endo -76.05 159.05 37.85 Favored 'Trans proline' 0 CA--C 1.542 0.879 0 C-N-CA 123.902 3.068 . . . . 0.0 111.863 178.543 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 21.1 Cg_endo -55.57 -32.78 84.39 Favored 'Trans proline' 0 CA--C 1.538 0.719 0 C-N-CA 123.484 2.789 . . . . 0.0 114.715 -178.155 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 56.0 m80 -76.84 -13.41 60.01 Favored 'General case' 0 N--CA 1.474 0.773 0 N-CA-C 114.659 1.355 . . . . 0.0 114.659 177.779 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.407 HD13 HD21 ' A' ' 16' ' ' LEU . 91.2 mt -115.86 -18.13 10.83 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 124.551 1.14 . . . . 0.0 113.535 179.344 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 58.3 mtpt -53.8 -37.21 63.28 Favored 'General case' 0 N--CA 1.48 1.072 0 CA-C-N 119.992 1.269 . . . . 0.0 111.233 172.907 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 19.6 m -64.16 -42.13 96.87 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 124.628 1.171 . . . . 0.0 111.709 176.007 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 90.6 mm-40 -67.21 -42.91 83.32 Favored 'General case' 0 N--CA 1.466 0.356 0 C-N-CA 123.517 0.727 . . . . 0.0 110.421 178.531 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 66.7 mt -63.2 -45.66 90.7 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-O 118.391 -0.814 . . . . 0.0 112.183 176.927 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 7.2 pt-20 -63.99 -35.64 81.37 Favored 'General case' 0 N--CA 1.474 0.766 0 CA-C-N 120.476 1.489 . . . . 0.0 111.878 177.196 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 69.1 mt -63.13 -44.54 99.48 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.679 0 CA-C-N 119.049 0.841 . . . . 0.0 109.77 175.185 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 86.4 m-20 -61.12 -42.74 99.08 Favored 'General case' 0 CA--C 1.545 0.774 0 O-C-N 121.707 -0.621 . . . . 0.0 110.728 175.665 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 1.053 0 C-N-CA 124.881 1.229 . . . . 0.0 112.403 178.873 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.544 0.727 0 N-CA-C 114.08 1.141 . . . . 0.0 114.08 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 96.2 mt -91.19 -10.11 42.91 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 127.24 2.216 . . . . 0.0 114.78 -177.141 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 9.7 m -78.45 79.22 4.89 Favored 'General case' 0 N--CA 1.477 0.888 0 CA-C-N 119.728 1.149 . . . . 0.0 110.879 -178.805 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.548 HD21 HD13 ' A' ' 75' ' ' LEU . 10.0 tp -75.71 143.26 42.19 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 128.567 2.747 . . . . 0.0 111.875 -177.728 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 10.1 mt-10 -74.91 151.83 38.9 Favored 'General case' 0 N--CA 1.47 0.559 0 O-C-N 120.5 -1.375 . . . . 0.0 112.888 178.409 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 14.8 m -85.36 154.92 3.49 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.943 0 C-N-CA 123.255 0.622 . . . . 0.0 111.659 175.497 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 47.8 t -74.83 138.59 42.66 Favored 'General case' 0 CA--C 1.538 0.519 0 O-C-N 121.704 -0.622 . . . . 0.0 110.883 176.439 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.27 -39.57 74.85 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 124.811 1.244 . . . . 0.0 113.229 -178.422 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 13.5 mm-40 -73.97 -32.9 63.65 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 123.551 0.74 . . . . 0.0 111.351 179.268 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 67.3 t80 -62.75 -27.57 69.37 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 123.89 0.876 . . . . 0.0 111.471 175.844 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 57.9 mm-40 -65.28 -20.01 66.22 Favored 'General case' 0 N--CA 1.476 0.862 0 N-CA-C 112.815 0.672 . . . . 0.0 112.815 175.359 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 7.3 mpt_? -108.71 8.48 26.88 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 126.315 1.846 . . . . 0.0 111.607 176.894 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 58.64 36.12 84.22 Favored Glycine 0 CA--C 1.533 1.179 0 C-N-CA 125.421 1.486 . . . . 0.0 114.127 -179.677 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 4.8 t -130.96 7.81 4.73 Favored 'General case' 0 N--CA 1.477 0.917 0 N-CA-C 114.892 1.442 . . . . 0.0 114.892 -174.944 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 27.8 t -60.2 132.86 55.25 Favored 'General case' 0 CA--C 1.55 0.959 0 O-C-N 120.902 -1.124 . . . . 0.0 110.615 175.972 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 77.9 p -82.66 3.98 26.76 Favored 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 115.457 1.651 . . . . 0.0 115.457 -176.67 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 67.4 mtm-85 -130.23 146.2 60.58 Favored Pre-proline 0 N--CA 1.475 0.805 0 C-N-CA 125.252 1.421 . . . . 0.0 113.311 -176.216 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 95.2 Cg_endo -70.35 167.76 24.3 Favored 'Trans proline' 0 CA--C 1.543 0.958 0 C-N-CA 122.385 2.056 . . . . 0.0 110.021 171.706 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 -54.22 -29.12 45.28 Favored 'General case' 0 N--CA 1.475 0.81 0 N-CA-C 113.538 0.94 . . . . 0.0 113.538 177.158 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 16.2 p -75.52 -8.35 56.51 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 125.59 1.556 . . . . 0.0 114.981 178.642 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 19.3 mt-10 -124.78 -25.53 3.93 Favored 'General case' 0 N--CA 1.478 0.931 0 N-CA-C 116.092 1.886 . . . . 0.0 116.092 -176.012 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 4.3 t -68.92 163.14 25.11 Favored 'General case' 0 CA--C 1.548 0.895 0 N-CA-C 115.215 1.561 . . . . 0.0 115.215 -176.631 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -79.59 -9.99 59.72 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 127.286 2.234 . . . . 0.0 113.236 179.627 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 65.6 m-85 -140.54 174.0 10.95 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 126.411 1.885 . . . . 0.0 110.523 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -81.99 150.78 27.47 Favored 'General case' 0 CA--C 1.546 0.804 0 O-C-N 121.129 -0.982 . . . . 0.0 113.464 -177.742 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 66.5 m170 -123.82 86.52 53.24 Favored Pre-proline 0 CA--C 1.551 0.982 0 C-N-CA 126.043 1.737 . . . . 0.0 110.739 -179.587 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 29.5 Cg_endo -62.18 146.44 95.99 Favored 'Trans proline' 0 CA--C 1.54 0.811 0 C-N-CA 123.6 2.867 . . . . 0.0 114.923 -177.444 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 51.6 p -84.98 -176.05 6.04 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 124.867 1.267 . . . . 0.0 112.386 175.604 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 75.0 mmtt -60.67 -19.51 58.58 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 125.819 1.648 . . . . 0.0 113.553 173.558 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 43.0 m -109.06 -20.58 12.97 Favored 'General case' 0 N--CA 1.478 0.933 0 N-CA-C 114.216 1.191 . . . . 0.0 114.216 179.372 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 87.2 m -61.5 138.46 58.28 Favored 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 113.915 1.08 . . . . 0.0 113.915 -178.638 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 47.8 tt0 -83.57 127.66 33.91 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 125.832 1.653 . . . . 0.0 110.308 178.594 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 15.0 t -123.11 133.49 68.93 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.958 0 C-N-CA 125.666 1.587 . . . . 0.0 109.908 -177.852 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -144.24 129.29 18.57 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 125.114 1.366 . . . . 0.0 111.255 -179.136 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 61.9 t30 43.42 36.54 1.14 Allowed 'General case' 0 CA--C 1.552 1.051 0 C-N-CA 126.82 2.048 . . . . 0.0 116.462 177.94 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 87.41 14.24 64.17 Favored Glycine 0 CA--C 1.536 1.347 0 O-C-N 120.993 -1.067 . . . . 0.0 114.947 179.845 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 71.4 mtt180 -136.86 164.25 28.74 Favored 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 125.823 1.649 . . . . 0.0 111.087 -179.929 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 4.1 m -139.34 142.74 32.64 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.564 0 C-N-CA 127.13 2.172 . . . . 0.0 109.085 -177.926 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 29.1 mt -90.94 127.84 43.12 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.647 0 O-C-N 121.09 -1.006 . . . . 0.0 109.995 -178.51 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -73.38 147.46 44.29 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 123.962 0.905 . . . . 0.0 111.229 177.642 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 15.1 t -70.58 97.06 1.26 Allowed 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 125.655 1.582 . . . . 0.0 113.267 -175.82 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 28.1 p90 -59.66 -37.53 79.01 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 123.428 0.691 . . . . 0.0 110.407 175.179 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 69.7 m-20 -61.43 -36.82 81.42 Favored 'General case' 0 CA--C 1.54 0.574 0 O-C-N 121.645 -0.659 . . . . 0.0 111.632 177.273 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 46.7 p -67.19 -38.53 85.52 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-N 119.733 1.151 . . . . 0.0 111.976 177.304 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 42.1 mt -71.73 -42.97 66.64 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 124.51 1.124 . . . . 0.0 112.261 177.444 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 31.1 mmmt -76.12 -15.6 60.05 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 124.69 1.196 . . . . 0.0 113.7 179.573 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 87.76 42.41 6.07 Favored Glycine 0 CA--C 1.537 1.416 0 C-N-CA 124.519 1.057 . . . . 0.0 114.502 178.085 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 19.4 tpp180 -127.19 -23.43 3.57 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 125.865 1.666 . . . . 0.0 115.241 -176.922 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 8.2 t . . . . . 0 CA--C 1.546 0.8 0 CA-C-N 119.444 1.02 . . . . 0.0 113.142 -176.542 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 9.4 t . . . . . 0 CA--C 1.543 0.706 0 CA-C-O 121.299 0.571 . . . . 0.0 111.436 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 6.8 mtmp? -84.78 3.78 36.03 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 124.077 0.951 . . . . 0.0 113.457 -177.982 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 67.5 m-85 -124.76 152.79 43.37 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 124.207 1.003 . . . . 0.0 112.353 -173.881 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -79.65 116.4 19.83 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 123.712 0.805 . . . . 0.0 112.249 -175.788 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 32.7 m170 -68.99 114.42 23.1 Favored Pre-proline 0 CA--C 1.548 0.902 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 174.649 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 67.8 Cg_exo -47.23 112.99 0.6 Allowed 'Trans proline' 0 CA--C 1.541 0.861 0 C-N-CA 125.011 3.807 . . . . 0.0 116.267 -175.926 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 96.0 Cg_endo -76.0 157.01 38.7 Favored 'Trans proline' 0 CA--C 1.541 0.873 0 C-N-CA 121.74 1.627 . . . . 0.0 110.889 176.406 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_endo -57.41 -31.2 90.55 Favored 'Trans proline' 0 CA--C 1.539 0.734 0 C-N-CA 123.155 2.57 . . . . 0.0 114.839 -176.669 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 61.6 m80 -80.68 -10.84 59.7 Favored 'General case' 0 N--CA 1.475 0.803 0 N-CA-C 114.749 1.388 . . . . 0.0 114.749 178.169 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.548 HD13 HD21 ' A' ' 16' ' ' LEU . 77.3 mt -117.0 -16.96 10.47 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 124.214 1.005 . . . . 0.0 113.179 178.527 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 62.3 mttt -52.99 -35.47 59.29 Favored 'General case' 0 N--CA 1.475 0.825 0 CA-C-N 119.502 1.047 . . . . 0.0 111.58 173.249 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 24.5 m -63.64 -46.05 87.45 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 124.206 1.002 . . . . 0.0 111.295 175.969 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 92.4 mm-40 -65.57 -44.51 86.51 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 123.637 0.775 . . . . 0.0 110.659 177.661 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 87.9 mt -60.75 -46.52 90.13 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 123.833 0.853 . . . . 0.0 111.974 177.305 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -65.91 -35.42 80.58 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-N 119.934 1.243 . . . . 0.0 112.098 177.52 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 64.9 mt -62.6 -43.56 98.6 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.786 0 CA-C-N 119.258 0.935 . . . . 0.0 109.647 175.337 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 83.8 m-20 -61.77 -44.12 97.51 Favored 'General case' 0 CA--C 1.542 0.668 0 O-C-N 121.778 -0.576 . . . . 0.0 110.482 175.307 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.856 0 C-N-CA 124.701 1.143 . . . . 0.0 112.559 179.354 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.473 0.724 0 N-CA-C 113.372 0.878 . . . . 0.0 113.372 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 91.2 mt -88.2 -12.22 44.48 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 127.202 2.201 . . . . 0.0 113.886 -179.119 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 12.9 m -79.59 79.37 6.07 Favored 'General case' 0 N--CA 1.474 0.732 0 CA-C-O 122.487 1.137 . . . . 0.0 110.218 -178.377 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.483 HD21 HD13 ' A' ' 75' ' ' LEU . 11.9 tp -75.61 143.81 42.1 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 128.512 2.725 . . . . 0.0 111.548 -177.357 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 62.5 mt-10 -74.03 150.57 40.57 Favored 'General case' 0 CA--C 1.541 0.614 0 O-C-N 120.765 -1.21 . . . . 0.0 112.362 178.622 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 13.7 m -86.33 153.24 3.44 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.232 0 C-N-CA 123.539 0.736 . . . . 0.0 111.149 174.59 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 41.5 t -72.29 130.15 40.1 Favored 'General case' 0 CA--C 1.543 0.695 0 O-C-N 121.129 -0.982 . . . . 0.0 112.081 178.76 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.2 -28.94 69.73 Favored 'General case' 0 N--CA 1.479 0.992 0 O-C-N 121.287 -0.883 . . . . 0.0 113.09 179.821 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -77.03 -41.4 42.77 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 123.726 0.811 . . . . 0.0 110.142 178.884 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 65.0 t80 -63.54 -34.4 77.72 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 124.331 1.052 . . . . 0.0 111.517 175.907 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 13.6 mm100 -62.65 -14.51 44.33 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 124.03 0.932 . . . . 0.0 113.161 175.081 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 11.8 mtp-105 -121.41 12.67 10.9 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 127.428 2.291 . . . . 0.0 112.197 179.27 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 57.2 35.73 71.8 Favored Glycine 0 CA--C 1.534 1.261 0 C-N-CA 125.259 1.409 . . . . 0.0 114.0 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 7.4 t -131.73 15.6 4.84 Favored 'General case' 0 N--CA 1.476 0.842 0 N-CA-C 114.898 1.444 . . . . 0.0 114.898 -174.958 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 5.9 t -67.83 172.53 5.29 Favored 'General case' 0 CA--C 1.556 1.182 0 CA-C-N 119.137 0.88 . . . . 0.0 111.432 175.295 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 94.3 p -134.79 6.1 3.41 Favored 'General case' 0 N--CA 1.476 0.85 0 N-CA-C 115.55 1.685 . . . . 0.0 115.55 -175.782 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 81.5 mtt180 -133.1 143.34 48.04 Favored Pre-proline 0 N--CA 1.472 0.64 0 C-N-CA 125.53 1.532 . . . . 0.0 111.91 -179.39 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -68.17 165.72 27.54 Favored 'Trans proline' 0 CA--C 1.542 0.913 0 C-N-CA 122.144 1.896 . . . . 0.0 109.919 173.155 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -51.89 -32.7 33.59 Favored 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 113.765 1.024 . . . . 0.0 113.765 178.486 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 17.6 p -71.05 -14.08 62.2 Favored 'General case' 0 N--CA 1.473 0.725 0 C-N-CA 125.906 1.682 . . . . 0.0 115.021 178.481 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 74.3 mm-40 -123.78 -22.85 4.82 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 125.692 1.597 . . . . 0.0 115.23 -174.268 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 4.6 t -65.14 168.18 7.08 Favored 'General case' 0 CA--C 1.548 0.898 0 N-CA-C 115.937 1.829 . . . . 0.0 115.937 -175.527 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -80.41 -18.98 47.27 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 128.075 2.55 . . . . 0.0 113.102 -179.755 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 67.5 m-85 -145.2 178.37 8.12 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 126.625 1.97 . . . . 0.0 110.598 -178.061 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -79.37 151.13 31.15 Favored 'General case' 0 CA--C 1.547 0.864 0 O-C-N 120.812 -1.18 . . . . 0.0 113.404 -178.071 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 59.5 m170 -125.41 87.73 55.24 Favored Pre-proline 0 CA--C 1.549 0.932 0 C-N-CA 126.128 1.771 . . . . 0.0 110.355 179.576 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -64.32 147.32 90.9 Favored 'Trans proline' 0 C--N 1.352 0.754 0 C-N-CA 123.237 2.625 . . . . 0.0 114.379 -177.885 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 60.2 p -84.59 -176.31 6.18 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 124.685 1.194 . . . . 0.0 111.79 174.735 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 47.1 mmtm -61.04 -18.75 59.52 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 125.259 1.424 . . . . 0.0 113.253 173.084 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 42.1 m -109.17 -20.6 12.93 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 125.133 1.373 . . . . 0.0 114.563 -178.9 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 97.0 m -65.45 132.93 50.19 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-N 119.357 0.981 . . . . 0.0 112.659 179.862 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 33.9 mt-30 -77.24 138.43 39.41 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 123.271 0.628 . . . . 0.0 111.011 176.766 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 11.8 t -127.87 147.08 32.58 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.897 0 C-N-CA 125.666 1.586 . . . . 0.0 110.986 -176.895 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 4.3 pt-20 -149.02 117.48 6.51 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 125.188 1.395 . . . . 0.0 114.062 -179.349 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 75.0 m-20 40.66 30.46 0.09 Allowed 'General case' 0 CA--C 1.553 1.073 0 C-N-CA 127.536 2.334 . . . . 0.0 116.986 174.987 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 109.17 5.5 30.41 Favored Glycine 0 CA--C 1.536 1.371 0 C-N-CA 124.656 1.122 . . . . 0.0 114.932 -178.995 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 34.3 mtt180 -133.87 165.41 25.07 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 119.236 1.518 . . . . 0.0 112.508 179.04 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 3.8 m -140.42 145.79 25.39 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.534 0 C-N-CA 127.992 2.517 . . . . 0.0 109.107 -179.417 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 17.8 mt -94.13 131.44 41.01 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 O-C-N 121.003 -1.061 . . . . 0.0 110.201 -178.485 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -77.65 148.21 35.16 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 124.095 0.958 . . . . 0.0 111.659 178.632 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 21.5 t -70.63 98.94 1.58 Allowed 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 124.9 1.28 . . . . 0.0 112.582 -177.409 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 29.5 p90 -60.78 -38.34 84.95 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 123.652 0.781 . . . . 0.0 110.512 175.789 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 60.9 m-20 -59.59 -38.44 81.25 Favored 'General case' 0 CA--C 1.543 0.703 0 O-C-N 121.719 -0.613 . . . . 0.0 110.436 176.66 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 24.7 p -65.49 -41.71 92.98 Favored 'General case' 0 N--CA 1.472 0.632 0 CA-C-N 119.929 1.241 . . . . 0.0 112.164 177.832 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 33.6 mt -68.71 -41.25 79.34 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 124.756 1.222 . . . . 0.0 112.638 177.913 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 14.2 mmmm -77.53 -8.78 58.34 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 124.586 1.155 . . . . 0.0 113.437 178.743 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 78.71 41.12 16.02 Favored Glycine 0 CA--C 1.536 1.369 0 C-N-CA 124.733 1.158 . . . . 0.0 113.632 179.265 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 65.1 ttt-85 -123.64 -22.9 4.86 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 126.85 2.06 . . . . 0.0 114.873 -175.571 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 5.6 t . . . . . 0 CA--C 1.545 0.768 0 CA-C-N 119.24 0.927 . . . . 0.0 112.973 -178.0 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 4.5 t . . . . . 0 CA--C 1.546 0.813 0 CA-C-O 121.542 0.687 . . . . 0.0 112.525 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 32.3 mtmt -84.17 3.11 36.51 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 125.182 1.393 . . . . 0.0 113.868 -177.98 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 87.9 m-85 -125.46 152.87 44.34 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 124.944 1.298 . . . . 0.0 111.935 -175.298 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -76.38 117.42 18.03 Favored 'General case' 0 N--CA 1.465 0.307 0 C-N-CA 123.708 0.803 . . . . 0.0 112.213 -176.471 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 12.9 m170 -72.31 115.7 41.68 Favored Pre-proline 0 CA--C 1.547 0.859 0 N-CA-C 107.962 -1.125 . . . . 0.0 107.962 174.215 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_exo -48.87 115.22 1.56 Allowed 'Trans proline' 0 CA--C 1.542 0.905 0 C-N-CA 124.802 3.668 . . . . 0.0 115.696 -176.104 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 92.2 Cg_endo -78.88 153.65 25.77 Favored 'Trans proline' 0 CA--C 1.544 1.02 0 C-N-CA 121.887 1.725 . . . . 0.0 111.283 177.6 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 86.6 Cg_exo -47.16 -36.99 22.78 Favored 'Trans proline' 0 CA--C 1.537 0.664 0 C-N-CA 124.189 3.26 . . . . 0.0 115.704 179.682 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 69.8 m80 -79.63 -10.35 59.78 Favored 'General case' 0 N--CA 1.473 0.704 0 N-CA-C 115.588 1.699 . . . . 0.0 115.588 -179.643 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.483 HD13 HD21 ' A' ' 16' ' ' LEU . 79.9 mt -119.42 -14.55 9.16 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 124.512 1.125 . . . . 0.0 113.287 177.721 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 23.8 mtpp -54.45 -34.8 62.16 Favored 'General case' 0 N--CA 1.477 0.915 0 CA-C-N 119.451 1.023 . . . . 0.0 111.409 173.363 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 21.7 m -62.92 -45.71 91.2 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 123.877 0.871 . . . . 0.0 111.202 176.068 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 92.6 mm-40 -66.03 -44.99 83.05 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 123.604 0.761 . . . . 0.0 110.954 177.665 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 76.5 mt -60.72 -45.24 94.99 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 123.742 0.817 . . . . 0.0 112.212 177.809 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -66.85 -36.5 82.47 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-N 119.578 1.081 . . . . 0.0 111.886 177.343 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 63.9 mt -62.06 -42.05 93.49 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.754 0 CA-C-N 119.117 0.871 . . . . 0.0 109.797 175.384 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 86.4 m-20 -61.74 -47.12 86.64 Favored 'General case' 0 CA--C 1.543 0.704 0 O-C-N 121.861 -0.525 . . . . 0.0 110.395 175.32 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 1.058 0 C-N-CA 124.595 1.093 . . . . 0.0 113.105 179.355 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.475 0.79 0 N-CA-C 114.113 1.153 . . . . 0.0 114.113 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 90.7 mt -91.72 -12.02 35.18 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 127.22 2.208 . . . . 0.0 114.423 -177.822 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 9.6 m -79.03 74.2 5.56 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 124.678 1.191 . . . . 0.0 110.898 -177.792 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.533 HD21 HD13 ' A' ' 75' ' ' LEU . 9.8 tp -75.7 143.73 41.96 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 126.845 2.058 . . . . 0.0 111.853 -178.047 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 8.2 mt-10 -69.54 150.29 47.28 Favored 'General case' 0 N--CA 1.472 0.67 0 O-C-N 120.766 -1.209 . . . . 0.0 112.308 178.735 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 21.3 m -82.15 148.85 5.01 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 N-CA-C 109.303 -0.628 . . . . 0.0 109.303 173.545 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 49.6 t -66.01 130.92 44.91 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-O 121.757 0.789 . . . . 0.0 111.01 178.124 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 2.8 mpt_? -69.41 -33.75 73.47 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 125.667 1.587 . . . . 0.0 112.192 -177.725 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 14.8 mm-40 -77.9 -34.5 51.42 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 123.676 0.79 . . . . 0.0 110.998 178.36 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 74.6 t80 -62.59 -27.51 69.24 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 124.452 1.101 . . . . 0.0 111.365 175.222 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 54.4 mm-40 -65.03 -19.5 66.03 Favored 'General case' 0 N--CA 1.475 0.825 0 N-CA-C 112.806 0.669 . . . . 0.0 112.806 175.337 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 6.9 mpt_? -111.75 10.2 20.9 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 126.477 1.911 . . . . 0.0 111.56 177.012 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 58.32 36.31 82.83 Favored Glycine 0 CA--C 1.533 1.213 0 C-N-CA 125.463 1.506 . . . . 0.0 114.287 -179.957 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 6.2 t -130.84 11.9 5.2 Favored 'General case' 0 N--CA 1.478 0.963 0 N-CA-C 115.117 1.525 . . . . 0.0 115.117 -175.388 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 36.8 t -61.45 139.11 58.27 Favored 'General case' 0 CA--C 1.551 1.017 0 O-C-N 121.318 -0.864 . . . . 0.0 110.988 176.165 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 78.2 p -89.23 0.67 56.59 Favored 'General case' 0 N--CA 1.472 0.631 0 N-CA-C 115.686 1.735 . . . . 0.0 115.686 -176.755 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 68.0 mtt180 -132.65 145.35 56.79 Favored Pre-proline 0 N--CA 1.475 0.803 0 C-N-CA 125.19 1.396 . . . . 0.0 113.042 -177.131 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -68.94 166.14 27.58 Favored 'Trans proline' 0 CA--C 1.543 0.965 0 C-N-CA 122.39 2.06 . . . . 0.0 110.125 172.878 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -52.23 -32.1 35.21 Favored 'General case' 0 N--CA 1.477 0.89 0 N-CA-C 113.868 1.062 . . . . 0.0 113.868 178.022 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 22.4 p -72.14 -13.71 61.63 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 125.585 1.554 . . . . 0.0 114.941 178.553 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 70.8 mm-40 -125.35 -22.25 4.38 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 125.574 1.55 . . . . 0.0 115.182 -174.623 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . 0.42 ' SG ' ' NZ ' ' A' ' 35' ' ' LYS . 14.3 t -60.03 162.75 5.35 Favored 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 115.37 1.618 . . . . 0.0 115.37 -176.509 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.42 ' NZ ' ' SG ' ' A' ' 34' ' ' CYS . 0.0 OUTLIER -80.42 -13.65 58.95 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 126.748 2.019 . . . . 0.0 112.821 177.959 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 70.3 m-85 -141.61 175.92 9.31 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 126.657 1.983 . . . . 0.0 111.151 -178.76 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -81.57 151.3 27.77 Favored 'General case' 0 CA--C 1.551 1.008 0 O-C-N 120.753 -1.217 . . . . 0.0 113.599 -178.283 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 56.0 m170 -124.67 91.28 49.7 Favored Pre-proline 0 CA--C 1.551 1.001 0 C-N-CA 126.006 1.722 . . . . 0.0 111.168 179.419 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo -66.49 167.05 19.81 Favored 'Trans proline' 0 CA--C 1.542 0.922 0 C-N-CA 123.678 2.919 . . . . 0.0 114.395 -179.237 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 59.7 p -125.04 -174.28 3.01 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 126.116 1.766 . . . . 0.0 111.954 177.401 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 30.9 mmmt -49.48 -26.58 3.49 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 127.31 2.244 . . . . 0.0 116.323 -179.378 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 21.1 m -109.05 -19.07 13.51 Favored 'General case' 0 N--CA 1.481 1.082 0 N-CA-C 114.506 1.299 . . . . 0.0 114.506 -179.389 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 58.3 m -63.49 135.43 56.88 Favored 'General case' 0 CA--C 1.543 0.7 0 CA-C-N 119.359 0.981 . . . . 0.0 113.137 -178.734 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 40.4 tt0 -85.29 127.6 34.38 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 125.519 1.527 . . . . 0.0 110.044 178.716 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 20.1 t -120.45 133.6 66.64 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 C-N-CA 125.523 1.529 . . . . 0.0 109.51 -178.162 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 -143.19 130.44 20.89 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 125.016 1.326 . . . . 0.0 110.864 -179.118 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 45.59 36.65 2.68 Favored 'General case' 0 CA--C 1.555 1.147 0 C-N-CA 126.451 1.9 . . . . 0.0 115.366 178.936 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 81.18 19.94 65.88 Favored Glycine 0 CA--C 1.536 1.387 0 O-C-N 120.956 -1.09 . . . . 0.0 114.579 -179.856 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 63.4 mtt180 -138.69 163.25 32.61 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 125.995 1.718 . . . . 0.0 110.938 -179.16 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 3.3 m -138.17 140.07 40.94 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.501 0 C-N-CA 126.613 1.965 . . . . 0.0 109.381 -177.91 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 54.7 mt -90.32 130.63 39.25 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.662 0 O-C-N 121.544 -0.723 . . . . 0.0 109.528 -178.952 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -74.99 150.56 38.94 Favored 'General case' 0 CA--C 1.551 0.982 0 C-N-CA 123.782 0.833 . . . . 0.0 112.556 178.642 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 2.5 t -68.35 91.51 0.39 Allowed 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 125.614 1.566 . . . . 0.0 110.85 -178.375 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 25.2 p90 -56.48 -36.94 69.69 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 124.167 0.987 . . . . 0.0 111.498 178.996 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 72.7 m-20 -61.82 -33.7 74.6 Favored 'General case' 0 CA--C 1.54 0.592 0 O-C-N 121.878 -0.514 . . . . 0.0 111.597 177.43 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 30.4 t -70.39 -41.21 73.32 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-N 119.678 1.126 . . . . 0.0 110.769 177.254 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 42.0 mt -66.74 -41.11 88.38 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.01 0.924 . . . . 0.0 112.912 176.075 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 32.1 mmmt -81.32 -7.53 59.59 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 125.114 1.365 . . . . 0.0 114.203 -179.302 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 77.61 39.95 23.98 Favored Glycine 0 CA--C 1.537 1.431 0 C-N-CA 124.505 1.05 . . . . 0.0 114.12 178.889 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 50.4 ttp180 -125.98 -16.54 5.57 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 126.758 2.023 . . . . 0.0 114.79 -176.546 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 4.7 t . . . . . 0 CA--C 1.544 0.713 0 CA-C-N 119.448 1.022 . . . . 0.0 113.322 -176.233 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 63.2 m . . . . . 0 CA--C 1.537 0.48 0 N-CA-C 114.506 1.298 . . . . 0.0 114.506 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 19.1 mtmt -80.66 4.0 20.17 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-N 114.916 -1.038 . . . . 0.0 111.459 173.991 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 65.5 m-85 -125.61 144.94 50.36 Favored 'General case' 0 N--CA 1.447 -0.605 0 C-N-CA 126.416 1.886 . . . . 0.0 110.21 -174.24 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -72.81 117.56 14.66 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 123.817 0.847 . . . . 0.0 112.252 -176.017 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 3.8 m-70 -65.4 123.97 85.82 Favored Pre-proline 0 CA--C 1.546 0.801 0 N-CA-C 105.865 -1.902 . . . . 0.0 105.865 170.328 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -70.02 122.87 9.46 Favored 'Trans proline' 0 CA--C 1.544 0.992 0 C-N-CA 121.946 1.764 . . . . 0.0 113.938 -170.932 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 94.5 Cg_endo -77.82 153.29 29.41 Favored 'Trans proline' 0 CA--C 1.543 0.962 0 C-N-CA 123.264 2.643 . . . . 0.0 112.015 179.261 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 80.6 Cg_exo -45.69 -42.9 19.09 Favored 'Trans proline' 0 CA--C 1.538 0.72 0 C-N-CA 124.319 3.346 . . . . 0.0 115.844 179.883 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 17.4 t-80 -70.77 -15.22 62.66 Favored 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 114.938 1.458 . . . . 0.0 114.938 -179.786 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.533 HD13 HD21 ' A' ' 16' ' ' LEU . 81.1 mt -112.55 -18.17 12.46 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 124.562 1.145 . . . . 0.0 112.975 178.622 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 57.4 mtpt -54.09 -35.76 62.45 Favored 'General case' 0 N--CA 1.478 0.941 0 CA-C-N 119.83 1.195 . . . . 0.0 111.593 174.852 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 22.4 m -62.83 -45.63 91.72 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 124.081 0.952 . . . . 0.0 111.374 175.691 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 76.2 mt-30 -64.21 -46.93 81.71 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 123.634 0.774 . . . . 0.0 110.711 177.449 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 92.4 mt -61.42 -45.8 92.77 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 124.205 1.002 . . . . 0.0 112.549 179.244 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 7.5 pt-20 -66.03 -37.01 84.79 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-N 119.91 1.232 . . . . 0.0 111.98 177.972 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 61.9 mt -61.59 -40.74 87.65 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 CA-C-N 119.215 0.916 . . . . 0.0 110.131 176.304 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 79.5 m-20 -67.59 -47.03 70.87 Favored 'General case' 0 CA--C 1.546 0.819 0 O-C-N 121.918 -0.489 . . . . 0.0 110.803 175.477 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.954 0 C-N-CA 125.114 1.34 . . . . 0.0 113.62 -179.278 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.543 0.696 0 N-CA-C 114.743 1.386 . . . . 0.0 114.743 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 83.5 mt -93.12 -18.52 22.49 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 126.362 1.865 . . . . 0.0 114.555 -176.605 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 2.6 m -73.71 75.3 1.56 Allowed 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 124.645 1.178 . . . . 0.0 111.863 -178.847 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -75.65 146.07 40.56 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 128.391 2.676 . . . . 0.0 111.094 -178.456 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 12.0 mt-10 -76.04 153.0 36.76 Favored 'General case' 0 N--CA 1.472 0.667 0 O-C-N 120.215 -1.553 . . . . 0.0 112.835 178.386 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 10.8 m -84.4 154.43 3.63 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.73 0 C-N-CA 122.748 0.419 . . . . 0.0 110.279 173.904 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 48.8 t -71.41 139.18 49.63 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-O 121.23 0.538 . . . . 0.0 110.361 176.609 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 3.8 mpt_? -68.59 -38.39 80.61 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 125.306 1.443 . . . . 0.0 112.452 -177.635 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 17.0 mm-40 -74.63 -33.78 62.64 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 123.918 0.887 . . . . 0.0 110.927 178.489 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 51.1 t80 -64.71 -22.78 67.06 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 123.801 0.841 . . . . 0.0 112.065 175.315 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 76.9 mt-30 -59.12 -22.58 61.09 Favored 'General case' 0 N--CA 1.477 0.882 0 O-C-N 121.568 -0.707 . . . . 0.0 112.872 175.526 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -116.62 14.26 15.41 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 125.741 1.616 . . . . 0.0 111.91 177.24 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 58.36 37.75 88.48 Favored Glycine 0 CA--C 1.534 1.227 0 C-N-CA 125.333 1.444 . . . . 0.0 114.228 -179.61 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 5.5 t -127.73 9.61 6.47 Favored 'General case' 0 N--CA 1.479 1.023 0 N-CA-C 114.632 1.345 . . . . 0.0 114.632 -175.279 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 34.6 t -62.7 134.61 56.57 Favored 'General case' 0 CA--C 1.55 0.947 0 O-C-N 120.927 -1.108 . . . . 0.0 111.021 175.729 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 27.8 m -79.37 2.79 20.34 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 125.69 1.596 . . . . 0.0 115.293 -177.358 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 71.2 mtm-85 -132.62 146.93 63.53 Favored Pre-proline 0 N--CA 1.474 0.775 0 C-N-CA 125.033 1.333 . . . . 0.0 113.733 -174.876 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 95.0 Cg_endo -71.01 166.87 27.75 Favored 'Trans proline' 0 CA--C 1.545 1.047 0 C-N-CA 122.337 2.024 . . . . 0.0 109.792 170.738 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -53.9 -32.4 53.22 Favored 'General case' 0 N--CA 1.477 0.924 0 O-C-N 121.157 -0.965 . . . . 0.0 112.79 177.681 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 26.9 p -71.16 -8.28 52.46 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 125.876 1.671 . . . . 0.0 115.147 178.158 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 20.5 mt-10 -125.14 -25.81 3.77 Favored 'General case' 0 N--CA 1.476 0.854 0 N-CA-C 115.439 1.644 . . . . 0.0 115.439 -177.587 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 4.2 t -70.16 164.23 24.65 Favored 'General case' 0 CA--C 1.548 0.878 0 N-CA-C 115.154 1.539 . . . . 0.0 115.154 -177.01 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 75.0 mmtt -81.31 -10.55 59.55 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 127.272 2.229 . . . . 0.0 113.25 179.949 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 73.7 m-85 -139.15 175.66 9.36 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 126.878 2.071 . . . . 0.0 110.196 179.497 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -86.11 150.13 24.64 Favored 'General case' 0 CA--C 1.546 0.805 0 O-C-N 121.213 -0.93 . . . . 0.0 113.458 -177.655 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 61.5 m170 -122.17 90.62 49.02 Favored Pre-proline 0 CA--C 1.554 1.128 0 C-N-CA 125.573 1.549 . . . . 0.0 111.056 179.222 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 30.8 Cg_endo -62.36 161.35 27.64 Favored 'Trans proline' 0 C--N 1.355 0.878 0 C-N-CA 123.62 2.88 . . . . 0.0 114.878 -178.874 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 52.5 p -113.44 -174.21 2.42 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 125.655 1.582 . . . . 0.0 112.265 177.439 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 58.0 mtmt -52.55 -25.4 10.36 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 126.873 2.069 . . . . 0.0 115.512 178.981 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 42.7 m -109.07 -19.83 13.23 Favored 'General case' 0 N--CA 1.478 0.968 0 N-CA-C 114.827 1.418 . . . . 0.0 114.827 -179.07 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 63.8 m -62.82 133.72 55.16 Favored 'General case' 0 CA--C 1.541 0.611 0 CA-C-N 119.471 1.032 . . . . 0.0 113.419 -179.107 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 35.5 mt-30 -81.92 139.14 34.81 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 123.41 0.684 . . . . 0.0 110.888 175.769 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 12.0 t -131.49 138.71 52.44 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.794 0 C-N-CA 125.413 1.485 . . . . 0.0 110.59 -177.275 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -145.69 132.75 20.33 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 125.093 1.357 . . . . 0.0 111.128 177.879 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 63.1 t30 42.78 37.14 0.97 Allowed 'General case' 0 CA--C 1.552 1.021 0 C-N-CA 126.684 1.994 . . . . 0.0 116.105 177.89 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 84.25 17.18 65.23 Favored Glycine 0 CA--C 1.536 1.402 0 O-C-N 120.998 -1.064 . . . . 0.0 114.848 -179.62 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 64.1 mtt180 -136.48 160.28 39.24 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 125.617 1.567 . . . . 0.0 111.736 -179.546 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 3.2 m -138.79 139.31 41.02 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.491 0 C-N-CA 127.63 2.372 . . . . 0.0 110.392 -176.459 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 59.1 mt -87.19 129.08 39.23 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.78 0 O-C-N 121.118 -0.988 . . . . 0.0 109.716 -179.788 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -75.13 149.87 38.92 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 124.185 0.994 . . . . 0.0 111.74 178.14 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 18.8 t -68.93 99.87 1.12 Allowed 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 124.682 1.193 . . . . 0.0 113.061 -177.045 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 33.2 p90 -61.83 -38.0 86.55 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 115.071 -0.968 . . . . 0.0 110.229 175.064 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 70.0 m-20 -62.22 -44.28 96.93 Favored 'General case' 0 CA--C 1.537 0.452 0 O-C-N 121.755 -0.591 . . . . 0.0 110.612 176.962 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 41.6 t -63.94 -41.79 97.51 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-N 119.631 1.105 . . . . 0.0 111.509 177.516 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 31.3 mt -63.57 -40.53 97.21 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 123.774 0.83 . . . . 0.0 112.875 176.286 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 32.2 mmmt -82.87 -9.07 59.49 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 124.878 1.271 . . . . 0.0 113.845 179.589 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 80.84 38.18 17.01 Favored Glycine 0 CA--C 1.537 1.463 0 C-N-CA 124.722 1.154 . . . . 0.0 114.103 179.571 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 50.3 ttp180 -120.75 -19.47 7.35 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 126.631 1.972 . . . . 0.0 114.83 -176.525 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 4.8 t . . . . . 0 CA--C 1.546 0.796 0 CA-C-N 119.311 0.96 . . . . 0.0 113.562 -177.789 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 7.9 t . . . . . 0 CA--C 1.542 0.67 0 CA-C-O 121.655 0.74 . . . . 0.0 111.465 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 25.7 mtmt -80.46 0.78 32.03 Favored 'General case' 0 N--CA 1.474 0.771 0 N-CA-C 114.007 1.114 . . . . 0.0 114.007 -177.532 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 80.8 m-85 -125.58 154.35 42.36 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 125.127 1.371 . . . . 0.0 111.394 -175.127 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -76.69 113.15 14.02 Favored 'General case' 0 CA--C 1.533 0.312 0 O-C-N 121.654 -0.654 . . . . 0.0 112.265 -176.258 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 8.3 m170 -64.49 127.08 91.9 Favored Pre-proline 0 CA--C 1.545 0.768 0 N-CA-C 106.892 -1.521 . . . . 0.0 106.892 172.48 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 89.7 Cg_endo -72.97 120.73 6.79 Favored 'Trans proline' 0 CA--C 1.546 1.075 0 C-N-CA 122.401 2.067 . . . . 0.0 114.06 -170.757 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 94.3 Cg_endo -77.05 153.41 32.31 Favored 'Trans proline' 0 CA--C 1.544 1.001 0 C-N-CA 123.206 2.604 . . . . 0.0 111.973 178.297 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_exo -46.27 -41.45 22.28 Favored 'Trans proline' 0 CA--C 1.538 0.706 0 C-N-CA 124.156 3.237 . . . . 0.0 115.753 179.449 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 57.3 m80 -72.4 -13.7 61.52 Favored 'General case' 0 N--CA 1.475 0.805 0 N-CA-C 115.181 1.548 . . . . 0.0 115.181 179.605 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 92.1 mt -114.13 -17.21 11.96 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 124.426 1.091 . . . . 0.0 112.949 177.565 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 56.0 mtpt -54.89 -38.91 68.16 Favored 'General case' 0 N--CA 1.478 0.944 0 CA-C-N 119.931 1.241 . . . . 0.0 111.85 174.944 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 4.7 m -63.02 -38.51 91.48 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 123.728 0.811 . . . . 0.0 111.777 176.753 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 92.5 mm-40 -69.95 -49.57 50.49 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 123.175 0.59 . . . . 0.0 109.721 177.638 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 95.4 mt -58.47 -47.04 85.37 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 124.134 0.974 . . . . 0.0 113.056 178.767 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -62.97 -32.25 73.54 Favored 'General case' 0 N--CA 1.475 0.811 0 CA-C-N 119.932 1.242 . . . . 0.0 112.444 178.759 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 57.0 mt -74.73 -42.58 47.63 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.584 0 C-N-CA 123.858 0.863 . . . . 0.0 110.269 175.783 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 26.5 m120 -60.64 -36.17 78.01 Favored 'General case' 0 CA--C 1.543 0.692 0 CA-C-N 119.406 1.003 . . . . 0.0 110.423 174.75 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 1.295 0 C-N-CA 125.18 1.371 . . . . 0.0 113.643 176.56 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 2.5 p90 . . . . . 0 N--CA 1.476 0.857 0 N-CA-C 114.308 1.225 . . . . 0.0 114.308 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 94.8 mt -105.03 -10.13 17.4 Favored 'General case' 0 CA--C 1.539 0.522 0 N-CA-C 116.269 1.952 . . . . 0.0 116.269 -172.263 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 4.0 m -75.01 79.7 2.2 Favored 'General case' 0 N--CA 1.479 1.015 0 CA-C-N 120.474 1.488 . . . . 0.0 112.208 -179.044 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -75.68 144.59 41.53 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 127.066 2.146 . . . . 0.0 112.41 -177.908 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 10.3 mt-10 -74.89 150.96 38.99 Favored 'General case' 0 N--CA 1.474 0.771 0 O-C-N 120.688 -1.258 . . . . 0.0 111.916 176.577 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 15.9 m -82.06 150.89 4.3 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.795 0 N-CA-C 109.816 -0.439 . . . . 0.0 109.816 174.362 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 53.5 t -63.82 130.7 45.23 Favored 'General case' 0 C--O 1.237 0.43 0 CA-C-O 122.552 1.168 . . . . 0.0 111.349 177.671 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 3.3 mpt_? -68.45 -25.3 64.93 Favored 'General case' 0 N--CA 1.465 0.296 0 C-N-CA 124.716 1.207 . . . . 0.0 112.244 -178.582 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -84.21 -37.61 21.6 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 123.125 0.57 . . . . 0.0 110.017 177.303 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 63.5 t80 -62.0 -31.24 71.6 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 124.823 1.249 . . . . 0.0 110.884 174.982 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 12.4 mm100 -62.98 -15.81 57.44 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 123.928 0.891 . . . . 0.0 113.294 175.264 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 6.2 mpt_? -120.32 13.4 11.91 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 126.605 1.962 . . . . 0.0 111.464 177.058 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 57.96 35.82 77.84 Favored Glycine 0 CA--C 1.533 1.197 0 C-N-CA 125.396 1.474 . . . . 0.0 114.375 179.888 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 6.4 t -131.13 11.04 5.0 Favored 'General case' 0 N--CA 1.477 0.91 0 N-CA-C 115.128 1.529 . . . . 0.0 115.128 -175.527 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 44.3 t -60.7 136.57 58.11 Favored 'General case' 0 CA--C 1.548 0.891 0 CA-C-N 119.091 0.86 . . . . 0.0 110.523 176.078 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 80.2 p -93.01 6.37 48.15 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 125.541 1.537 . . . . 0.0 114.394 -178.235 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 57.2 mtm-85 -129.64 151.49 78.14 Favored Pre-proline 0 N--CA 1.474 0.76 0 C-N-CA 125.253 1.421 . . . . 0.0 113.795 -173.946 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 95.1 Cg_endo -74.59 163.88 35.01 Favored 'Trans proline' 0 CA--C 1.542 0.88 0 C-N-CA 122.429 2.086 . . . . 0.0 109.419 172.338 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 -54.62 -28.11 44.29 Favored 'General case' 0 N--CA 1.475 0.821 0 N-CA-C 113.407 0.891 . . . . 0.0 113.407 176.477 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 22.1 p -73.85 -17.43 61.06 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 125.57 1.548 . . . . 0.0 115.126 178.948 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -115.65 -31.08 5.96 Favored 'General case' 0 N--CA 1.478 0.939 0 N-CA-C 114.295 1.22 . . . . 0.0 114.295 -179.277 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 4.7 t -56.77 147.11 23.91 Favored 'General case' 0 CA--C 1.545 0.756 0 CA-C-O 122.735 1.255 . . . . 0.0 113.887 -175.63 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 39.6 mmtm -81.88 4.83 20.92 Favored 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 126.475 1.91 . . . . 0.0 113.145 -177.706 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 75.6 m-85 -143.76 170.18 16.35 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 128.633 2.773 . . . . 0.0 108.631 175.913 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -84.24 153.53 23.55 Favored 'General case' 0 CA--C 1.547 0.863 0 N-CA-C 114.526 1.306 . . . . 0.0 114.526 -177.048 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 65.0 m170 -124.58 90.66 50.61 Favored Pre-proline 0 CA--C 1.55 0.943 0 C-N-CA 126.203 1.801 . . . . 0.0 110.361 178.048 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 34.7 Cg_endo -64.0 148.53 91.56 Favored 'Trans proline' 0 CA--C 1.539 0.754 0 C-N-CA 123.31 2.674 . . . . 0.0 114.483 -177.535 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 52.9 p -86.72 -175.88 5.58 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 125.114 1.366 . . . . 0.0 112.228 175.847 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 58.0 mtmt -60.72 -20.04 60.2 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 125.556 1.542 . . . . 0.0 113.472 173.645 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 49.1 m -109.11 -20.81 12.87 Favored 'General case' 0 N--CA 1.477 0.897 0 N-CA-C 114.436 1.273 . . . . 0.0 114.436 -179.594 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 84.5 m -63.94 134.87 55.89 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 119.498 1.044 . . . . 0.0 113.193 179.878 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 35.7 mt-30 -81.45 142.1 33.27 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 123.181 0.592 . . . . 0.0 111.253 176.669 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 11.8 t -132.34 138.16 52.87 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.865 0 C-N-CA 125.404 1.481 . . . . 0.0 110.573 -177.748 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -146.21 132.66 19.68 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 125.298 1.439 . . . . 0.0 111.391 178.194 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 62.5 t30 41.26 37.94 0.7 Allowed 'General case' 0 CA--C 1.553 1.073 0 C-N-CA 126.99 2.116 . . . . 0.0 116.578 177.16 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 87.77 13.73 64.32 Favored Glycine 0 CA--C 1.535 1.335 0 O-C-N 120.997 -1.064 . . . . 0.0 115.188 179.777 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 56.0 mtt180 -136.56 164.16 28.85 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 125.421 1.488 . . . . 0.0 111.432 179.39 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 5.2 m -134.34 176.81 8.0 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 C-N-CA 129.127 2.971 . . . . 0.0 107.493 179.623 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 59.1 mt -126.71 130.07 71.57 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.833 0 CA-C-N 119.78 1.173 . . . . 0.0 108.786 179.589 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -73.04 147.62 44.89 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 123.758 0.823 . . . . 0.0 111.931 177.873 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 13.9 t -69.75 99.37 1.34 Allowed 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 125.067 1.347 . . . . 0.0 113.35 -176.432 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 26.4 p90 -61.92 -37.94 86.56 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 115.191 -0.913 . . . . 0.0 110.013 174.34 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 70.3 m-20 -61.44 -43.09 99.47 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 123.099 0.559 . . . . 0.0 110.851 177.193 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 44.6 t -64.66 -43.23 94.26 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-N 119.506 1.048 . . . . 0.0 111.566 177.911 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 34.3 mt -65.39 -36.99 85.65 Favored 'General case' 0 CA--C 1.542 0.665 0 N-CA-C 113.378 0.881 . . . . 0.0 113.378 177.124 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 29.7 mmmt -88.17 -5.62 58.32 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 125.197 1.399 . . . . 0.0 114.509 -178.32 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 81.02 39.84 12.48 Favored Glycine 0 CA--C 1.536 1.38 0 C-N-CA 124.506 1.05 . . . . 0.0 114.384 178.221 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 71.9 ttt-85 -123.64 -21.52 5.21 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 126.546 1.939 . . . . 0.0 114.695 -176.63 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 5.5 t . . . . . 0 CA--C 1.545 0.765 0 CA-C-N 119.431 1.014 . . . . 0.0 113.387 -177.396 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 9.0 t . . . . . 0 CA--C 1.544 0.744 0 CA-C-O 121.531 0.681 . . . . 0.0 111.607 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 31.8 mtmt -84.17 2.33 40.21 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 124.62 1.168 . . . . 0.0 113.63 -177.87 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 84.4 m-85 -125.08 154.36 41.5 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 125.384 1.473 . . . . 0.0 111.908 -175.521 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -78.07 114.72 17.22 Favored 'General case' 0 N--CA 1.465 0.318 0 C-N-CA 123.989 0.915 . . . . 0.0 112.155 -176.619 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 11.0 m170 -70.2 115.17 31.73 Favored Pre-proline 0 CA--C 1.546 0.8 0 N-CA-C 108.094 -1.076 . . . . 0.0 108.094 174.654 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 81.1 Cg_exo -48.89 114.07 1.12 Allowed 'Trans proline' 0 CA--C 1.543 0.928 0 C-N-CA 124.621 3.547 . . . . 0.0 116.794 -174.757 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_endo -77.02 155.78 33.9 Favored 'Trans proline' 0 CA--C 1.546 1.114 0 C-N-CA 122.658 2.238 . . . . 0.0 111.479 175.965 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 92.9 Cg_exo -43.58 -45.79 10.44 Favored 'Trans proline' 0 CA--C 1.539 0.73 0 C-N-CA 124.861 3.707 . . . . 0.0 116.531 -179.777 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -73.53 -12.61 60.83 Favored 'General case' 0 N--CA 1.478 0.971 0 N-CA-C 114.676 1.362 . . . . 0.0 114.676 -179.431 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 87.0 mt -112.64 -19.56 12.02 Favored 'General case' 0 N--CA 1.475 0.789 0 CA-C-N 119.458 1.026 . . . . 0.0 113.71 -179.717 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 54.3 mtpt -52.69 -39.66 62.17 Favored 'General case' 0 N--CA 1.48 1.035 0 CA-C-N 119.908 1.231 . . . . 0.0 111.426 174.252 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 24.7 m -63.19 -41.59 99.21 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 124.781 1.232 . . . . 0.0 111.92 176.926 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 16.9 mm100 -68.57 -44.39 74.54 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 123.56 0.744 . . . . 0.0 110.521 179.206 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 81.0 mt -62.31 -46.63 87.89 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 123.376 0.67 . . . . 0.0 112.235 177.769 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -64.21 -29.78 70.87 Favored 'General case' 0 N--CA 1.476 0.854 0 CA-C-N 120.361 1.437 . . . . 0.0 113.106 178.147 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 63.9 mt -71.15 -44.88 73.77 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.69 0 O-C-N 121.354 -0.841 . . . . 0.0 109.242 174.854 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 75.7 m-20 -62.15 -36.72 82.68 Favored 'General case' 0 CA--C 1.542 0.639 0 O-C-N 121.644 -0.66 . . . . 0.0 110.955 175.773 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.93 0 C-N-CA 124.513 1.054 . . . . 0.0 111.494 177.95 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.476 0.858 0 CA-C-O 120.804 0.335 . . . . 0.0 111.29 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 92.5 mt -89.76 -8.45 52.17 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 126.615 1.966 . . . . 0.0 114.268 -179.146 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 18.2 m -81.15 80.52 7.59 Favored 'General case' 0 N--CA 1.475 0.781 0 CA-C-O 122.13 0.966 . . . . 0.0 110.477 -178.625 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -75.77 145.21 40.95 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 128.613 2.765 . . . . 0.0 111.983 -178.232 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 52.8 mt-10 -72.33 150.99 43.02 Favored 'General case' 0 N--CA 1.47 0.564 0 O-C-N 120.487 -1.383 . . . . 0.0 112.615 176.899 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 16.8 m -86.69 156.49 3.3 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.971 0 C-N-CA 123.506 0.723 . . . . 0.0 111.418 174.359 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 49.1 t -77.66 129.69 35.88 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-O 121.607 0.718 . . . . 0.0 110.649 177.238 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 4.2 mpt_? -66.64 -28.99 68.92 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 124.418 1.087 . . . . 0.0 113.247 -177.462 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -78.13 -40.21 38.83 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 123.443 0.697 . . . . 0.0 109.518 177.79 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 64.3 t80 -63.24 -35.07 79.11 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 124.486 1.115 . . . . 0.0 111.298 175.957 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 13.8 mm100 -62.12 -15.31 44.65 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 124.227 1.011 . . . . 0.0 113.38 175.424 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 11.8 mtp-105 -120.76 12.67 11.41 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 127.233 2.213 . . . . 0.0 112.28 179.569 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 57.99 34.69 73.15 Favored Glycine 0 CA--C 1.536 1.354 0 C-N-CA 125.086 1.327 . . . . 0.0 113.9 -179.771 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 7.3 t -129.88 13.36 5.8 Favored 'General case' 0 N--CA 1.475 0.801 0 N-CA-C 114.906 1.447 . . . . 0.0 114.906 -175.196 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 6.5 t -69.53 171.7 8.45 Favored 'General case' 0 CA--C 1.556 1.182 0 O-C-N 121.413 -0.804 . . . . 0.0 110.542 173.823 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 50.7 m -135.45 13.57 3.49 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 125.059 1.344 . . . . 0.0 114.457 -176.796 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 51.0 mtt85 -135.45 145.97 55.81 Favored Pre-proline 0 N--CA 1.47 0.553 0 C-N-CA 125.301 1.44 . . . . 0.0 112.756 -176.349 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_endo -69.69 165.34 31.21 Favored 'Trans proline' 0 CA--C 1.545 1.06 0 C-N-CA 121.943 1.762 . . . . 0.0 109.744 171.323 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -54.6 -30.25 54.09 Favored 'General case' 0 N--CA 1.477 0.91 0 O-C-N 121.124 -0.985 . . . . 0.0 112.678 177.882 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 29.9 p -72.37 -8.43 54.93 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 126.268 1.827 . . . . 0.0 115.135 177.792 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 27.0 mm-40 -124.61 -24.86 4.1 Favored 'General case' 0 N--CA 1.476 0.868 0 N-CA-C 115.53 1.678 . . . . 0.0 115.53 -175.993 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 1.4 t -73.45 170.33 15.34 Favored 'General case' 0 CA--C 1.545 0.753 0 N-CA-C 115.361 1.615 . . . . 0.0 115.361 -175.921 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 13.0 mmmm -85.24 -13.16 50.74 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 126.807 2.043 . . . . 0.0 113.285 -179.377 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 56.7 m-85 -140.02 174.86 10.09 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 126.761 2.025 . . . . 0.0 109.598 179.001 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -83.65 151.04 25.51 Favored 'General case' 0 CA--C 1.545 0.784 0 N-CA-C 114.177 1.177 . . . . 0.0 114.177 -177.034 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 64.2 m170 -121.86 87.27 46.59 Favored Pre-proline 0 CA--C 1.553 1.068 0 C-N-CA 126.158 1.783 . . . . 0.0 110.888 179.572 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 39.5 Cg_endo -64.4 150.54 88.08 Favored 'Trans proline' 0 CA--C 1.54 0.808 0 C-N-CA 123.568 2.845 . . . . 0.0 114.912 -177.797 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 53.4 p -88.01 -174.93 4.9 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 124.945 1.298 . . . . 0.0 111.985 175.578 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 63.0 mttp -62.01 -18.67 61.28 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 125.523 1.529 . . . . 0.0 113.368 173.421 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 25.1 m -109.12 -22.4 12.14 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.917 1.287 . . . . 0.0 114.153 -179.079 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 89.6 m -63.58 138.35 58.47 Favored 'General case' 0 CA--C 1.542 0.651 0 CA-C-N 119.394 0.997 . . . . 0.0 113.175 179.586 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 16.3 mt-30 -80.66 136.2 36.17 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 124.663 1.185 . . . . 0.0 111.466 179.004 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 9.2 t -129.75 136.25 59.49 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.816 0 C-N-CA 124.958 1.303 . . . . 0.0 110.913 -178.084 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -146.99 131.8 18.01 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 125.286 1.435 . . . . 0.0 111.79 178.185 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 62.5 t30 39.46 39.3 0.47 Allowed 'General case' 0 CA--C 1.554 1.106 0 C-N-CA 127.28 2.232 . . . . 0.0 116.863 176.63 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 90.58 11.55 62.11 Favored Glycine 0 CA--C 1.536 1.374 0 O-C-N 121.101 -1.0 . . . . 0.0 115.393 179.465 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 42.1 mtm180 -136.17 164.9 26.98 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 125.53 1.532 . . . . 0.0 112.358 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 5.2 m -137.2 151.21 26.64 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.642 0 C-N-CA 128.12 2.568 . . . . 0.0 109.135 -179.93 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 17.2 mt -100.5 130.68 49.38 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.78 0 O-C-N 121.191 -0.943 . . . . 0.0 110.181 -178.306 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -78.31 149.79 33.41 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 123.946 0.898 . . . . 0.0 111.99 178.637 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 19.2 t -71.79 99.21 2.12 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 125.242 1.417 . . . . 0.0 113.039 -176.362 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 24.3 p90 -60.88 -36.83 80.21 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 123.574 0.75 . . . . 0.0 110.514 174.76 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 73.6 m-20 -61.3 -38.24 86.1 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 123.397 0.679 . . . . 0.0 111.199 177.338 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 31.2 p -64.72 -41.37 96.02 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 119.5 1.045 . . . . 0.0 112.216 178.058 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 38.5 mt -69.7 -40.74 76.13 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 124.575 1.15 . . . . 0.0 112.04 177.613 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 30.9 mmmt -76.31 -11.87 59.98 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 124.464 1.106 . . . . 0.0 113.71 178.482 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 78.5 35.75 31.96 Favored Glycine 0 CA--C 1.537 1.457 0 C-N-CA 124.563 1.078 . . . . 0.0 113.43 -179.508 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 50.8 ttp180 -116.66 -19.85 9.8 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 126.623 1.969 . . . . 0.0 114.378 -176.67 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 5.1 t . . . . . 0 CA--C 1.545 0.784 0 CA-C-N 119.078 0.854 . . . . 0.0 112.949 -177.879 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 4.2 t . . . . . 0 CA--C 1.542 0.647 0 CA-C-O 122.038 0.923 . . . . 0.0 112.518 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 33.8 mtmt -84.88 6.97 22.61 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 125.556 1.542 . . . . 0.0 113.636 -177.399 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 84.8 m-85 -129.14 151.88 49.33 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 125.192 1.397 . . . . 0.0 112.258 -174.589 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -77.2 118.61 19.88 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 123.723 0.809 . . . . 0.0 112.096 -176.992 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 11.2 m170 -71.4 115.91 41.96 Favored Pre-proline 0 CA--C 1.548 0.876 0 N-CA-C 108.045 -1.094 . . . . 0.0 108.045 174.381 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_exo -47.3 112.18 0.5 Allowed 'Trans proline' 0 CA--C 1.543 0.969 0 C-N-CA 125.015 3.81 . . . . 0.0 115.507 -176.231 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -75.68 148.82 33.19 Favored 'Trans proline' 0 CA--C 1.542 0.887 0 C-N-CA 122.052 1.835 . . . . 0.0 110.366 176.866 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_exo -47.32 -37.64 25.1 Favored 'Trans proline' 0 CA--C 1.539 0.748 0 C-N-CA 123.723 2.949 . . . . 0.0 115.193 179.433 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 6.8 t-80 -72.04 -16.94 62.05 Favored 'General case' 0 N--CA 1.472 0.659 0 N-CA-C 115.177 1.547 . . . . 0.0 115.177 179.778 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 90.9 mt -115.22 -15.78 11.6 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 124.735 1.214 . . . . 0.0 112.898 177.791 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 52.9 mtpt -53.98 -34.36 59.58 Favored 'General case' 0 N--CA 1.475 0.78 0 CA-C-N 119.662 1.119 . . . . 0.0 111.384 174.37 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 27.5 m -61.82 -47.13 86.47 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-N 118.723 0.692 . . . . 0.0 111.462 175.381 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 93.3 mm-40 -66.23 -43.56 86.28 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 123.772 0.829 . . . . 0.0 111.316 178.04 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 76.3 mt -62.53 -45.49 92.75 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 123.896 0.879 . . . . 0.0 111.984 178.085 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 5.3 pt-20 -66.11 -36.48 83.27 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-N 119.459 1.027 . . . . 0.0 112.153 177.859 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 51.2 mt -61.11 -39.84 83.75 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 CA-C-N 119.509 1.05 . . . . 0.0 110.386 177.193 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 29.4 m-80 -70.76 -43.5 68.66 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 123.216 0.606 . . . . 0.0 111.4 175.436 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.533 1.179 0 C-N-CA 124.242 0.925 . . . . 0.0 113.71 -179.665 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.542 0.666 0 N-CA-C 113.814 1.042 . . . . 0.0 113.814 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 82.6 mt -91.77 -16.6 26.6 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 127.021 2.128 . . . . 0.0 114.994 -176.998 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 7.0 m -77.41 77.14 3.94 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 124.314 1.046 . . . . 0.0 111.543 -177.096 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.442 HD21 HD13 ' A' ' 75' ' ' LEU . 13.0 tp -75.62 143.76 42.11 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 128.757 2.823 . . . . 0.0 112.007 -178.375 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 10.1 mt-10 -73.32 150.5 41.85 Favored 'General case' 0 N--CA 1.474 0.743 0 O-C-N 120.448 -1.407 . . . . 0.0 112.886 178.788 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 16.0 m -84.48 154.66 3.62 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.838 0 C-N-CA 122.805 0.442 . . . . 0.0 111.673 176.256 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 44.8 t -74.98 131.02 40.35 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-O 121.192 0.52 . . . . 0.0 109.829 175.316 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 4.5 mpt_? -68.29 -37.34 80.55 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 125.623 1.569 . . . . 0.0 112.976 -176.836 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 15.9 mm-40 -76.65 -33.54 58.31 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 123.848 0.859 . . . . 0.0 111.151 179.334 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 78.3 t80 -63.3 -27.79 69.57 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 123.964 0.906 . . . . 0.0 111.287 174.923 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 52.9 mm-40 -63.59 -19.6 64.97 Favored 'General case' 0 N--CA 1.476 0.858 0 N-CA-C 112.855 0.687 . . . . 0.0 112.855 175.307 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 6.7 mpt_? -111.85 10.67 20.76 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 126.404 1.882 . . . . 0.0 111.645 177.008 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 58.05 36.34 80.97 Favored Glycine 0 CA--C 1.534 1.26 0 C-N-CA 125.542 1.544 . . . . 0.0 114.216 -179.879 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 6.1 t -132.54 13.46 4.51 Favored 'General case' 0 N--CA 1.479 0.983 0 N-CA-C 115.143 1.534 . . . . 0.0 115.143 -175.031 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 39.6 t -59.9 131.77 51.88 Favored 'General case' 0 CA--C 1.55 0.967 0 O-C-N 121.379 -0.825 . . . . 0.0 111.157 176.984 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 21.8 m -73.95 1.89 9.81 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 125.985 1.714 . . . . 0.0 115.217 -177.347 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 63.4 mtm-85 -132.49 148.67 70.55 Favored Pre-proline 0 N--CA 1.474 0.75 0 C-N-CA 125.657 1.583 . . . . 0.0 112.867 -175.466 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -67.81 162.21 40.54 Favored 'Trans proline' 0 CA--C 1.542 0.923 0 C-N-CA 121.92 1.747 . . . . 0.0 109.425 171.674 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 17.2 m-20 -53.45 -25.44 16.1 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 125.025 1.33 . . . . 0.0 114.205 -177.437 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 16.8 p -83.84 -12.75 55.12 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 127.342 2.257 . . . . 0.0 115.317 178.855 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 16.2 mt-10 -111.5 -22.77 11.1 Favored 'General case' 0 N--CA 1.478 0.943 0 N-CA-C 115.291 1.589 . . . . 0.0 115.291 -176.835 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 3.8 t -66.92 164.85 16.63 Favored 'General case' 0 CA--C 1.545 0.769 0 N-CA-C 114.059 1.133 . . . . 0.0 114.059 -178.571 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 44.1 mmtm -100.58 6.66 44.22 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 126.541 1.937 . . . . 0.0 113.6 -176.94 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 51.9 m-85 -141.3 167.57 21.86 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 127.64 2.376 . . . . 0.0 108.448 173.503 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -80.08 148.04 31.19 Favored 'General case' 0 CA--C 1.544 0.75 0 O-C-N 120.94 -1.1 . . . . 0.0 113.584 -176.372 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 20.6 m170 -120.27 87.86 40.79 Favored Pre-proline 0 CA--C 1.554 1.097 0 C-N-CA 125.79 1.636 . . . . 0.0 110.563 -179.366 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -59.67 146.08 96.35 Favored 'Trans proline' 0 C--N 1.354 0.863 0 C-N-CA 123.442 2.761 . . . . 0.0 114.871 -178.032 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 48.1 p -82.86 -178.78 7.23 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 124.305 1.042 . . . . 0.0 112.474 175.942 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -59.8 -19.85 53.19 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 125.698 1.599 . . . . 0.0 113.599 173.934 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 51.8 m -109.23 -15.59 14.25 Favored 'General case' 0 N--CA 1.476 0.828 0 N-CA-C 114.888 1.44 . . . . 0.0 114.888 -179.259 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 78.8 m -65.67 159.52 24.76 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-N 119.896 1.225 . . . . 0.0 114.046 179.459 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 41.1 mt-30 -119.37 140.81 49.76 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 125.257 1.423 . . . . 0.0 111.063 178.15 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 1.1 m -131.79 149.87 33.29 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.576 0 C-N-CA 125.118 1.367 . . . . 0.0 112.546 -177.388 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 -144.59 139.13 27.92 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 125.929 1.692 . . . . 0.0 110.455 176.445 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 89.4 m-20 45.54 34.83 1.77 Allowed 'General case' 0 CA--C 1.554 1.124 0 N-CA-C 115.464 1.653 . . . . 0.0 115.464 176.18 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 81.07 19.81 66.41 Favored Glycine 0 CA--C 1.536 1.359 0 C-N-CA 124.243 0.925 . . . . 0.0 114.781 -179.363 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 44.3 mtt180 -137.33 160.83 37.94 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 125.145 1.378 . . . . 0.0 112.311 -179.067 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 3.3 m -137.41 142.63 36.39 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.648 0 C-N-CA 127.817 2.447 . . . . 0.0 109.972 -177.075 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 43.4 mt -91.26 126.34 43.94 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.567 0 O-C-N 121.386 -0.821 . . . . 0.0 109.871 -178.504 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -70.05 146.15 51.19 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 123.954 0.901 . . . . 0.0 111.334 177.689 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 29.4 t -67.08 100.22 0.74 Allowed 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 124.675 1.19 . . . . 0.0 112.244 -178.122 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 32.9 p90 -61.3 -37.8 84.51 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 115.017 -0.992 . . . . 0.0 110.017 175.557 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 70.9 m-20 -61.89 -44.63 96.41 Favored 'General case' 0 CA--C 1.539 0.55 0 O-C-N 121.8 -0.562 . . . . 0.0 110.475 176.746 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 43.3 t -63.57 -46.11 87.36 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 119.748 1.158 . . . . 0.0 111.247 177.763 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 34.4 mt -61.16 -40.75 95.02 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 124.059 0.944 . . . . 0.0 113.42 176.759 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 31.3 mmmt -81.23 -12.88 59.01 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 124.78 1.232 . . . . 0.0 113.746 179.297 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 85.66 38.08 9.07 Favored Glycine 0 CA--C 1.539 1.539 0 C-N-CA 124.681 1.134 . . . . 0.0 114.336 179.438 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 47.8 ttp180 -121.86 -20.76 6.28 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 126.716 2.006 . . . . 0.0 114.764 -176.705 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 5.0 t . . . . . 0 CA--C 1.544 0.742 0 CA-C-N 119.442 1.019 . . . . 0.0 113.349 -177.835 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 7.8 t . . . . . 0 CA--C 1.544 0.733 0 CA-C-O 121.219 0.533 . . . . 0.0 111.272 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 27.0 mtmt -83.47 0.83 44.62 Favored 'General case' 0 N--CA 1.477 0.899 0 N-CA-C 113.731 1.011 . . . . 0.0 113.731 -177.856 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 84.7 m-85 -122.82 154.0 38.81 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 125.203 1.401 . . . . 0.0 111.438 -175.778 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -75.56 112.32 11.78 Favored 'General case' 0 CA--C 1.531 0.242 0 N-CA-C 113.513 0.931 . . . . 0.0 113.513 -175.548 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 12.0 m170 -69.05 117.36 51.04 Favored Pre-proline 0 CA--C 1.545 0.777 0 N-CA-C 105.111 -2.181 . . . . 0.0 105.111 169.972 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -71.41 132.51 20.84 Favored 'Trans proline' 0 CA--C 1.541 0.849 0 C-N-CA 121.821 1.68 . . . . 0.0 114.719 -169.948 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 86.7 Cg_endo -77.16 153.88 32.24 Favored 'Trans proline' 0 CA--C 1.544 0.979 0 C-N-CA 123.39 2.727 . . . . 0.0 111.501 178.18 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 98.6 Cg_exo -44.81 -39.96 14.25 Favored 'Trans proline' 0 CA--C 1.539 0.771 0 C-N-CA 124.561 3.507 . . . . 0.0 116.11 179.902 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 72.7 m80 -73.4 -14.38 61.26 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 115.138 1.533 . . . . 0.0 115.138 179.796 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.442 HD13 HD21 ' A' ' 16' ' ' LEU . 92.8 mt -116.04 -16.29 11.07 Favored 'General case' 0 N--CA 1.474 0.725 0 C-N-CA 124.817 1.247 . . . . 0.0 113.383 179.814 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 61.2 mtpt -54.5 -36.68 64.45 Favored 'General case' 0 N--CA 1.48 1.033 0 CA-C-N 119.572 1.078 . . . . 0.0 111.11 172.569 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 19.6 m -63.97 -42.73 97.16 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 124.644 1.178 . . . . 0.0 111.65 176.211 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 89.9 mm-40 -66.85 -43.73 82.85 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 123.543 0.737 . . . . 0.0 110.51 178.827 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 93.8 mt -63.32 -43.46 97.73 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-O 118.405 -0.807 . . . . 0.0 112.401 177.378 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -65.81 -35.81 81.73 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-N 120.339 1.427 . . . . 0.0 111.827 176.58 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 66.7 mt -62.48 -42.48 95.87 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.845 0 CA-C-N 119.034 0.834 . . . . 0.0 109.677 175.25 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 82.4 m-20 -63.92 -44.49 92.74 Favored 'General case' 0 CA--C 1.544 0.743 0 O-C-N 121.658 -0.651 . . . . 0.0 110.537 174.927 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.865 0 C-N-CA 125.328 1.442 . . . . 0.0 112.452 179.294 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.476 0.867 0 N-CA-C 113.982 1.105 . . . . 0.0 113.982 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 65.4 mt -98.44 -11.92 21.88 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 126.344 1.858 . . . . 0.0 115.454 -175.479 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 4.8 m -77.09 75.66 3.66 Favored 'General case' 0 N--CA 1.478 0.944 0 CA-C-O 122.366 1.079 . . . . 0.0 110.949 -179.788 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.523 HD21 HD13 ' A' ' 75' ' ' LEU . 12.2 tp -75.98 143.24 41.64 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 128.027 2.531 . . . . 0.0 112.455 -177.757 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -68.44 148.78 50.14 Favored 'General case' 0 N--CA 1.474 0.755 0 O-C-N 120.729 -1.232 . . . . 0.0 112.255 177.578 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 20.9 m -82.68 149.95 4.48 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.827 0 C-N-CA 122.927 0.491 . . . . 0.0 110.286 173.142 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . 0.46 ' HB2' ' CE1' ' A' ' 38' ' ' HIS . 48.1 t -67.31 123.4 20.24 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-O 122.352 1.073 . . . . 0.0 111.463 178.071 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 2.7 mpt_? -64.39 -28.74 69.89 Favored 'General case' 0 N--CA 1.467 0.41 0 C-N-CA 124.965 1.306 . . . . 0.0 113.372 -175.903 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 11.5 mm-40 -82.93 -38.87 22.2 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 123.18 0.592 . . . . 0.0 110.138 177.839 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 81.1 t80 -61.65 -31.98 72.12 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 124.669 1.188 . . . . 0.0 111.042 174.772 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 12.6 mm100 -61.56 -16.86 51.81 Favored 'General case' 0 CA--C 1.545 0.771 0 N-CA-C 113.429 0.9 . . . . 0.0 113.429 175.698 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 5.6 mpt_? -121.69 14.04 10.88 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 126.338 1.855 . . . . 0.0 111.727 177.737 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 58.61 36.1 83.9 Favored Glycine 0 CA--C 1.535 1.289 0 C-N-CA 125.16 1.362 . . . . 0.0 114.183 -179.984 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 6.9 t -128.63 16.73 6.42 Favored 'General case' 0 N--CA 1.477 0.896 0 N-CA-C 114.489 1.292 . . . . 0.0 114.489 -176.005 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 9.1 t -67.31 173.98 3.58 Favored 'General case' 0 CA--C 1.558 1.264 0 O-C-N 121.633 -0.667 . . . . 0.0 110.858 173.985 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 90.7 p -136.24 9.43 3.22 Favored 'General case' 0 N--CA 1.477 0.902 0 N-CA-C 115.359 1.614 . . . . 0.0 115.359 -176.241 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 65.6 mtm-85 -132.69 153.61 81.16 Favored Pre-proline 0 N--CA 1.475 0.793 0 C-N-CA 125.941 1.696 . . . . 0.0 112.13 -178.449 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_endo -73.51 161.81 41.45 Favored 'Trans proline' 0 CA--C 1.541 0.827 0 C-N-CA 122.0 1.8 . . . . 0.0 109.109 173.109 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 -53.9 -28.44 36.55 Favored 'General case' 0 N--CA 1.473 0.709 0 N-CA-C 113.241 0.83 . . . . 0.0 113.241 177.69 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 27.2 p -72.1 -20.16 61.69 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 125.933 1.693 . . . . 0.0 115.069 178.887 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -114.84 -30.7 6.35 Favored 'General case' 0 N--CA 1.477 0.892 0 N-CA-C 114.295 1.221 . . . . 0.0 114.295 -178.014 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . 0.433 ' HB3' ' CE1' ' A' ' 38' ' ' HIS . 3.1 t -59.04 158.1 9.11 Favored 'General case' 0 CA--C 1.549 0.905 0 N-CA-C 114.675 1.361 . . . . 0.0 114.675 -175.654 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 36.7 mmtm -86.89 -0.31 56.28 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 126.773 2.029 . . . . 0.0 115.102 -173.095 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 75.3 m-85 -144.29 168.41 20.15 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 127.015 2.126 . . . . 0.0 109.388 175.692 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -73.7 150.69 41.06 Favored 'General case' 0 CA--C 1.548 0.871 0 O-C-N 120.414 -1.428 . . . . 0.0 113.842 -177.052 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . 0.46 ' CE1' ' HB2' ' A' ' 19' ' ' CYS . 7.1 m80 -127.33 84.16 64.15 Favored Pre-proline 0 CA--C 1.55 0.945 0 C-N-CA 125.451 1.5 . . . . 0.0 110.782 -177.415 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 35.2 Cg_endo -63.87 150.44 88.41 Favored 'Trans proline' 0 C--N 1.353 0.779 0 C-N-CA 123.636 2.891 . . . . 0.0 115.146 -177.078 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 54.1 p -89.35 -176.25 5.01 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 125.109 1.363 . . . . 0.0 111.695 174.536 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 60.9 mtpt -59.6 -21.9 61.05 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 125.516 1.526 . . . . 0.0 113.605 174.274 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 40.0 m -109.14 -16.13 14.16 Favored 'General case' 0 N--CA 1.477 0.923 0 N-CA-C 114.716 1.376 . . . . 0.0 114.716 -179.346 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 92.3 m -64.88 136.28 56.68 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-N 119.465 1.03 . . . . 0.0 112.218 179.462 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 42.0 tt0 -81.53 126.3 31.52 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 124.669 1.188 . . . . 0.0 110.502 179.165 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 18.7 t -119.75 134.65 62.59 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.941 0 C-N-CA 125.927 1.691 . . . . 0.0 109.688 -178.37 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -144.06 130.17 19.61 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 125.128 1.371 . . . . 0.0 111.331 -179.057 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 61.9 t30 42.75 37.01 0.93 Allowed 'General case' 0 CA--C 1.553 1.082 0 C-N-CA 126.989 2.115 . . . . 0.0 116.526 177.885 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 88.1 14.35 62.62 Favored Glycine 0 CA--C 1.536 1.35 0 O-C-N 121.103 -0.998 . . . . 0.0 114.929 179.653 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 31.1 mtt180 -138.52 167.56 21.67 Favored 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 126.101 1.76 . . . . 0.0 111.95 -179.57 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 4.4 m -140.03 146.56 24.71 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.571 0 C-N-CA 127.119 2.167 . . . . 0.0 108.911 -179.892 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 26.1 mt -95.72 127.98 47.3 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.814 0 O-C-N 121.108 -0.995 . . . . 0.0 109.611 -179.071 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -73.27 151.66 41.28 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 123.462 0.705 . . . . 0.0 111.683 177.44 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 13.2 t -73.46 98.87 2.85 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 124.421 1.089 . . . . 0.0 113.064 -176.881 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 30.0 p90 -61.66 -38.22 86.95 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 123.942 0.897 . . . . 0.0 110.139 174.843 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 66.1 m-20 -61.08 -42.38 98.39 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 123.011 0.524 . . . . 0.0 110.509 176.978 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 47.6 t -64.4 -42.37 96.14 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-N 119.519 1.054 . . . . 0.0 111.441 177.425 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 31.0 mt -63.73 -40.38 96.59 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 123.763 0.825 . . . . 0.0 112.921 176.399 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 31.4 mmmt -81.35 -9.46 59.74 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 124.763 1.225 . . . . 0.0 114.017 179.486 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 79.41 37.16 24.86 Favored Glycine 0 CA--C 1.536 1.4 0 C-N-CA 124.477 1.037 . . . . 0.0 113.525 -179.644 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 72.8 ttt-85 -117.19 -24.02 7.66 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 127.163 2.185 . . . . 0.0 113.966 -176.826 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 5.8 t . . . . . 0 CA--C 1.544 0.716 0 CA-C-O 121.768 0.794 . . . . 0.0 112.734 -177.92 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 7.4 t . . . . . 0 CA--C 1.543 0.68 0 CA-C-O 121.58 0.705 . . . . 0.0 111.876 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 30.4 mtmt -85.25 1.28 48.92 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 124.578 1.151 . . . . 0.0 113.308 -178.558 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 87.3 m-85 -115.13 147.65 39.98 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 124.191 0.997 . . . . 0.0 111.469 -175.402 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -73.42 112.79 9.82 Favored 'General case' 0 N--CA 1.465 0.287 0 C-N-CA 123.473 0.709 . . . . 0.0 111.9 -176.18 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 12.1 m170 -68.71 114.02 19.74 Favored Pre-proline 0 CA--C 1.547 0.831 0 N-CA-C 107.487 -1.301 . . . . 0.0 107.487 174.285 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 67.7 Cg_exo -47.93 112.56 0.59 Allowed 'Trans proline' 0 CA--C 1.543 0.943 0 C-N-CA 124.842 3.694 . . . . 0.0 117.153 -173.691 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -76.69 153.55 34.03 Favored 'Trans proline' 0 CA--C 1.547 1.149 0 C-N-CA 122.068 1.845 . . . . 0.0 111.734 176.215 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 81.4 Cg_exo -42.27 -49.52 6.02 Favored 'Trans proline' 0 CA--C 1.539 0.73 0 C-N-CA 125.046 3.831 . . . . 0.0 116.823 -179.059 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 1.7 t60 -66.8 -29.94 70.01 Favored 'General case' 0 N--CA 1.478 0.954 0 N-CA-C 113.585 0.957 . . . . 0.0 113.585 -179.393 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.523 HD13 HD21 ' A' ' 16' ' ' LEU . 85.5 mt -93.64 -21.35 19.44 Favored 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 114.026 1.121 . . . . 0.0 114.026 -178.058 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 54.1 mtpt -53.5 -38.87 64.12 Favored 'General case' 0 N--CA 1.48 1.037 0 CA-C-N 120.204 1.366 . . . . 0.0 111.611 175.397 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 29.7 m -62.73 -43.98 97.4 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 124.937 1.295 . . . . 0.0 111.561 175.855 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 94.5 mm-40 -66.21 -43.04 87.86 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 123.622 0.769 . . . . 0.0 110.933 178.33 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 88.1 mt -62.02 -50.44 72.02 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 123.876 0.87 . . . . 0.0 111.554 177.632 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -62.61 -28.85 70.18 Favored 'General case' 0 N--CA 1.476 0.843 0 CA-C-N 120.025 1.284 . . . . 0.0 113.489 178.919 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 61.2 mt -70.23 -43.59 78.53 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.727 0 C-N-CA 123.723 0.809 . . . . 0.0 109.743 174.892 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 24.8 m-80 -66.2 -35.97 81.84 Favored 'General case' 0 CA--C 1.542 0.647 0 O-C-N 121.352 -0.842 . . . . 0.0 110.958 175.453 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.532 1.109 0 C-N-CA 124.487 1.041 . . . . 0.0 112.158 177.247 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.542 0.669 0 N-CA-C 113.473 0.916 . . . . 0.0 113.473 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 95.0 mt -91.67 -14.92 29.28 Favored 'General case' 0 N--CA 1.467 0.376 0 C-N-CA 126.064 1.746 . . . . 0.0 114.429 -177.802 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 12.8 m -75.83 78.93 2.75 Favored 'General case' 0 N--CA 1.475 0.791 0 CA-C-N 119.508 1.049 . . . . 0.0 110.785 -179.208 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.47 HD21 HD13 ' A' ' 75' ' ' LEU . 10.6 tp -75.52 141.42 43.03 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 128.021 2.528 . . . . 0.0 111.985 -176.352 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 53.0 mt-10 -71.77 151.32 43.62 Favored 'General case' 0 N--CA 1.472 0.642 0 O-C-N 120.933 -1.104 . . . . 0.0 112.452 178.623 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 16.9 m -86.71 156.54 3.29 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.904 0 C-N-CA 123.107 0.563 . . . . 0.0 111.201 174.487 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 42.2 t -75.89 132.09 40.09 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-O 121.725 0.774 . . . . 0.0 110.677 176.685 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 3.8 mpt_? -66.62 -28.17 68.28 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 124.641 1.176 . . . . 0.0 113.167 -177.79 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -84.47 -36.13 22.49 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 118.36 0.527 . . . . 0.0 110.415 178.62 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 59.1 t80 -62.69 -31.28 72.14 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 123.686 0.794 . . . . 0.0 110.835 173.565 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 12.2 mm100 -62.48 -17.93 60.7 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 124.028 0.931 . . . . 0.0 113.334 175.387 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 1.7 mpp_? -118.16 13.12 13.73 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 126.417 1.887 . . . . 0.0 111.673 176.159 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 58.76 36.04 84.78 Favored Glycine 0 CA--C 1.533 1.218 0 C-N-CA 125.12 1.343 . . . . 0.0 113.894 -179.572 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 6.4 t -130.08 15.27 5.71 Favored 'General case' 0 N--CA 1.477 0.91 0 N-CA-C 114.827 1.418 . . . . 0.0 114.827 -175.333 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 8.8 t -67.99 169.8 9.39 Favored 'General case' 0 CA--C 1.557 1.212 0 CA-C-N 118.865 0.757 . . . . 0.0 110.454 173.435 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 50.5 m -132.23 13.58 4.65 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 125.302 1.441 . . . . 0.0 114.394 -176.09 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 75.5 mtm-85 -135.8 144.87 50.53 Favored Pre-proline 0 N--CA 1.472 0.63 0 C-N-CA 125.493 1.517 . . . . 0.0 112.337 -177.184 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_endo -69.37 165.72 29.55 Favored 'Trans proline' 0 CA--C 1.544 0.986 0 C-N-CA 121.955 1.77 . . . . 0.0 109.697 171.472 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -54.27 -31.31 53.43 Favored 'General case' 0 N--CA 1.478 0.939 0 O-C-N 121.196 -0.94 . . . . 0.0 112.468 177.554 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 24.6 p -70.15 -10.9 60.25 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 126.496 1.918 . . . . 0.0 115.141 177.47 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 44.6 mm-40 -122.83 -29.91 3.91 Favored 'General case' 0 N--CA 1.476 0.841 0 N-CA-C 115.184 1.55 . . . . 0.0 115.184 -177.003 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 3.4 t -66.99 164.75 17.02 Favored 'General case' 0 CA--C 1.546 0.81 0 N-CA-C 115.123 1.527 . . . . 0.0 115.123 -175.364 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -80.96 -12.31 59.41 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 126.777 2.031 . . . . 0.0 113.433 -179.632 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 60.5 m-85 -139.81 176.55 8.65 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 126.556 1.943 . . . . 0.0 110.173 179.408 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -84.58 148.49 26.44 Favored 'General case' 0 CA--C 1.547 0.845 0 O-C-N 121.134 -0.979 . . . . 0.0 113.361 -177.214 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 66.8 m170 -119.64 87.98 38.2 Favored Pre-proline 0 CA--C 1.55 0.958 0 C-N-CA 125.847 1.659 . . . . 0.0 111.177 179.385 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_endo -62.92 144.41 93.19 Favored 'Trans proline' 0 CA--C 1.539 0.759 0 C-N-CA 123.458 2.772 . . . . 0.0 114.45 -178.323 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 45.1 p -81.78 -175.09 5.39 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 124.438 1.095 . . . . 0.0 111.941 175.233 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 61.2 mtpt -60.12 -21.3 61.38 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 125.359 1.464 . . . . 0.0 113.152 173.198 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 46.1 m -109.27 -21.03 12.74 Favored 'General case' 0 N--CA 1.478 0.951 0 N-CA-C 114.548 1.314 . . . . 0.0 114.548 -179.958 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 81.9 m -61.59 135.6 57.7 Favored 'General case' 0 CA--C 1.544 0.718 0 CA-C-N 119.653 1.115 . . . . 0.0 112.352 179.39 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 38.4 tt0 -79.2 129.46 34.48 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.695 1.198 . . . . 0.0 111.091 179.993 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 13.7 t -122.87 133.45 68.94 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.037 0 C-N-CA 125.692 1.597 . . . . 0.0 110.025 -178.268 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 50.7 mt-10 -145.16 129.05 17.38 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 125.156 1.382 . . . . 0.0 111.813 -178.594 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 61.7 t30 39.66 38.82 0.46 Allowed 'General case' 0 CA--C 1.553 1.08 0 C-N-CA 127.572 2.349 . . . . 0.0 117.273 176.735 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 93.79 9.64 59.63 Favored Glycine 0 CA--C 1.535 1.3 0 O-C-N 120.955 -1.091 . . . . 0.0 115.168 178.961 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 31.7 mtt180 -137.69 170.91 15.24 Favored 'General case' 0 N--CA 1.466 0.331 0 C-N-CA 125.682 1.593 . . . . 0.0 111.827 179.591 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 5.3 m -135.85 171.95 16.38 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.675 0 C-N-CA 128.876 2.87 . . . . 0.0 107.324 177.593 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 38.7 mt -122.29 129.04 75.62 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.941 0 CA-C-N 120.209 1.368 . . . . 0.0 109.099 -179.927 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -73.72 146.08 44.67 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 124.176 0.99 . . . . 0.0 111.636 178.458 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 15.5 t -70.3 100.47 1.72 Allowed 'General case' 0 C--O 1.24 0.584 0 C-N-CA 124.972 1.309 . . . . 0.0 113.133 -176.918 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 31.3 p90 -61.51 -38.57 87.85 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 115.281 -0.872 . . . . 0.0 110.207 175.021 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 73.7 m-20 -61.38 -42.11 98.18 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 123.116 0.566 . . . . 0.0 110.855 177.433 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 48.4 t -64.31 -42.22 96.45 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 119.452 1.024 . . . . 0.0 111.472 177.538 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 29.9 mt -64.94 -40.89 95.71 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 123.636 0.774 . . . . 0.0 112.862 176.397 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 31.4 mmmt -79.51 -10.44 59.8 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 124.703 1.201 . . . . 0.0 113.872 179.087 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 80.25 37.52 21.08 Favored Glycine 0 CA--C 1.537 1.409 0 C-N-CA 124.642 1.115 . . . . 0.0 113.712 -179.932 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 50.5 ttp180 -120.24 -19.82 7.55 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 126.822 2.049 . . . . 0.0 114.507 -176.614 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 6.2 t . . . . . 0 CA--C 1.545 0.774 0 CA-C-N 119.247 0.93 . . . . 0.0 112.603 -178.376 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 8.1 t . . . . . 0 CA--C 1.544 0.737 0 CA-C-O 121.602 0.715 . . . . 0.0 111.866 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 27.4 mtmt -84.12 2.09 41.1 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 124.607 1.163 . . . . 0.0 113.374 -178.588 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 80.6 m-85 -117.65 149.19 41.12 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 124.334 1.053 . . . . 0.0 111.591 -174.763 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -76.09 117.75 18.12 Favored 'General case' 0 N--CA 1.464 0.253 0 C-N-CA 123.516 0.727 . . . . 0.0 111.293 -176.49 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 15.3 m170 -72.25 114.32 28.48 Favored Pre-proline 0 CA--C 1.549 0.907 0 N-CA-C 107.46 -1.311 . . . . 0.0 107.46 174.602 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 63.6 Cg_exo -47.27 115.9 1.55 Allowed 'Trans proline' 0 CA--C 1.543 0.96 0 C-N-CA 124.855 3.703 . . . . 0.0 116.522 -174.433 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -76.3 149.36 31.47 Favored 'Trans proline' 0 CA--C 1.542 0.887 0 C-N-CA 121.906 1.737 . . . . 0.0 110.472 175.955 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 84.6 Cg_exo -47.05 -39.32 25.41 Favored 'Trans proline' 0 CA--C 1.537 0.671 0 C-N-CA 123.868 3.045 . . . . 0.0 115.192 179.547 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 12.6 t-80 -69.8 -17.76 63.42 Favored 'General case' 0 N--CA 1.473 0.698 0 N-CA-C 114.99 1.478 . . . . 0.0 114.99 179.473 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.47 HD13 HD21 ' A' ' 16' ' ' LEU . 84.3 mt -114.19 -16.87 12.0 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 124.64 1.176 . . . . 0.0 112.848 178.742 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 54.2 mtpt -54.65 -36.2 64.3 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-N 119.725 1.148 . . . . 0.0 111.449 174.103 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 25.1 m -63.21 -43.73 97.31 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 123.635 0.774 . . . . 0.0 111.455 176.168 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 16.4 mm100 -67.5 -44.84 77.5 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 123.664 0.786 . . . . 0.0 110.75 178.129 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 81.7 mt -61.74 -48.69 79.57 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 124.2 1.0 . . . . 0.0 112.233 177.921 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -63.85 -35.67 81.39 Favored 'General case' 0 N--CA 1.474 0.741 0 CA-C-N 119.886 1.221 . . . . 0.0 112.733 179.725 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 60.2 mt -64.23 -45.49 96.09 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.763 0 CA-C-N 118.802 0.728 . . . . 0.0 110.062 176.203 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 32.2 m-80 -65.85 -37.88 87.35 Favored 'General case' 0 CA--C 1.542 0.672 0 O-C-N 121.696 -0.627 . . . . 0.0 111.354 175.956 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.846 0 C-N-CA 124.502 1.048 . . . . 0.0 111.981 177.653 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.475 0.781 0 N-CA-C 113.051 0.76 . . . . 0.0 113.051 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 86.8 mt -89.37 -14.65 35.12 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 126.127 1.771 . . . . 0.0 114.375 -178.227 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 6.8 m -78.03 75.86 4.56 Favored 'General case' 0 N--CA 1.477 0.907 0 CA-C-N 119.289 0.95 . . . . 0.0 111.008 -178.958 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.458 HD21 HD13 ' A' ' 75' ' ' LEU . 12.0 tp -75.66 145.88 40.67 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 127.531 2.332 . . . . 0.0 112.374 -178.227 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 15.9 mt-10 -75.24 150.9 38.48 Favored 'General case' 0 N--CA 1.472 0.638 0 O-C-N 120.602 -1.311 . . . . 0.0 112.752 179.29 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 13.0 m -83.52 155.56 3.75 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 C-N-CA 122.787 0.435 . . . . 0.0 111.596 176.29 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 42.6 t -72.89 129.5 38.28 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-O 122.063 0.935 . . . . 0.0 110.608 176.046 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 3.9 mpt_? -67.82 -27.82 67.05 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 124.925 1.29 . . . . 0.0 113.211 -177.542 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 15.8 mm-40 -84.13 -36.38 22.97 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 123.297 0.639 . . . . 0.0 110.11 178.423 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 72.7 t80 -63.27 -30.93 71.98 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 124.214 1.005 . . . . 0.0 110.917 174.19 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 12.6 mm100 -62.17 -16.03 50.16 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 123.886 0.874 . . . . 0.0 113.045 174.899 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 6.5 mpt_? -119.4 12.84 12.56 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 126.72 2.008 . . . . 0.0 111.622 176.684 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 58.22 36.12 81.18 Favored Glycine 0 CA--C 1.534 1.249 0 C-N-CA 125.479 1.514 . . . . 0.0 114.565 179.742 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 6.4 t -132.07 12.25 4.69 Favored 'General case' 0 N--CA 1.478 0.962 0 N-CA-C 115.202 1.556 . . . . 0.0 115.202 -175.384 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 31.0 t -61.03 131.84 51.91 Favored 'General case' 0 CA--C 1.548 0.897 0 O-C-N 121.175 -0.953 . . . . 0.0 110.783 176.53 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 75.4 p -83.18 6.67 18.52 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 125.94 1.696 . . . . 0.0 114.645 -178.04 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 75.3 mtm-85 -127.38 152.87 76.97 Favored Pre-proline 0 N--CA 1.473 0.685 0 C-N-CA 125.851 1.661 . . . . 0.0 113.476 -175.69 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo -72.66 160.61 46.03 Favored 'Trans proline' 0 CA--C 1.54 0.79 0 C-N-CA 122.098 1.865 . . . . 0.0 109.053 172.461 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 16.7 m-20 -55.3 -22.12 17.46 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 124.759 1.223 . . . . 0.0 113.822 -178.71 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 14.9 p -83.55 -22.08 32.48 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 127.306 2.242 . . . . 0.0 115.5 179.296 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -101.51 -31.9 10.65 Favored 'General case' 0 N--CA 1.477 0.883 0 CA-C-N 119.742 1.155 . . . . 0.0 113.839 -177.519 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 4.3 t -56.67 150.31 16.07 Favored 'General case' 0 CA--C 1.545 0.763 0 N-CA-C 115.007 1.484 . . . . 0.0 115.007 -174.105 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 13.4 mptt -81.9 -2.24 50.58 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 127.046 2.139 . . . . 0.0 113.134 -177.241 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 63.8 m-85 -138.79 169.8 17.14 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 127.461 2.304 . . . . 0.0 109.587 174.622 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -80.37 149.06 30.36 Favored 'General case' 0 CA--C 1.547 0.857 0 N-CA-C 114.382 1.253 . . . . 0.0 114.382 -175.948 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 21.2 m170 -121.07 86.78 42.88 Favored Pre-proline 0 CA--C 1.556 1.178 0 C-N-CA 125.99 1.716 . . . . 0.0 111.173 -179.179 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 35.2 Cg_endo -65.25 150.01 87.93 Favored 'Trans proline' 0 CA--C 1.539 0.771 0 C-N-CA 123.279 2.653 . . . . 0.0 114.671 -178.8 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 46.1 p -88.4 -175.34 4.96 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 124.476 1.11 . . . . 0.0 111.536 174.19 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 62.8 mttp -61.21 -18.53 58.72 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 125.379 1.471 . . . . 0.0 113.388 173.221 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 47.8 m -109.19 -20.99 12.78 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 125.078 1.351 . . . . 0.0 114.645 -178.783 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 71.6 m -63.58 137.55 58.16 Favored 'General case' 0 CA--C 1.543 0.701 0 CA-C-N 119.304 0.956 . . . . 0.0 113.32 -179.883 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 4.3 tm0? -82.88 134.28 35.09 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 124.774 1.23 . . . . 0.0 111.257 178.817 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -139.07 145.06 28.11 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.677 0 C-N-CA 125.251 1.42 . . . . 0.0 112.259 179.775 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -147.27 140.6 25.36 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 126.019 1.727 . . . . 0.0 110.911 176.802 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 61.1 t30 41.4 38.13 0.78 Allowed 'General case' 0 CA--C 1.553 1.073 0 C-N-CA 126.585 1.954 . . . . 0.0 116.166 177.53 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 84.53 16.65 65.76 Favored Glycine 0 CA--C 1.537 1.424 0 O-C-N 121.091 -1.006 . . . . 0.0 115.358 -179.938 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 55.5 mtt85 -136.92 160.87 37.6 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 124.913 1.285 . . . . 0.0 112.043 -179.945 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 5.8 m -135.89 150.1 28.24 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.698 0 C-N-CA 128.034 2.533 . . . . 0.0 109.847 -177.512 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 40.4 mt -98.84 127.63 51.25 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.75 0 O-C-N 121.28 -0.887 . . . . 0.0 109.992 -179.055 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -73.44 147.43 44.2 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 124.268 1.027 . . . . 0.0 111.716 177.6 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 17.9 t -69.26 100.08 1.26 Allowed 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 124.93 1.292 . . . . 0.0 112.784 -177.392 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 30.2 p90 -61.57 -38.47 87.63 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 115.23 -0.895 . . . . 0.0 110.163 175.183 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 71.1 m-20 -61.47 -42.69 99.17 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 123.127 0.571 . . . . 0.0 110.761 177.29 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 47.6 t -64.11 -42.32 96.93 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-N 119.491 1.041 . . . . 0.0 111.574 177.669 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 28.6 mt -65.46 -40.57 93.35 Favored 'General case' 0 CA--C 1.543 0.674 0 O-C-N 121.436 -0.79 . . . . 0.0 112.881 176.625 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 31.3 mmmt -79.84 -11.31 59.83 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 124.679 1.191 . . . . 0.0 113.928 179.167 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 82.17 37.79 14.53 Favored Glycine 0 CA--C 1.537 1.409 0 C-N-CA 124.577 1.085 . . . . 0.0 113.959 179.76 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 50.5 ttp180 -121.23 -18.29 7.44 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 126.652 1.981 . . . . 0.0 114.518 -176.646 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 6.0 t . . . . . 0 CA--C 1.545 0.765 0 CA-C-N 119.298 0.954 . . . . 0.0 112.747 -178.331 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 8.4 t . . . . . 0 CA--C 1.545 0.754 0 CA-C-O 121.716 0.77 . . . . 0.0 112.28 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 36.1 mtmt -85.02 5.63 28.6 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 125.324 1.45 . . . . 0.0 113.612 -177.281 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 84.4 m-85 -126.57 155.34 42.6 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 124.87 1.268 . . . . 0.0 112.061 -175.532 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -76.99 114.94 16.34 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 123.679 0.792 . . . . 0.0 112.267 -176.598 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 10.7 m170 -71.5 113.62 21.2 Favored Pre-proline 0 CA--C 1.546 0.807 0 N-CA-C 107.605 -1.257 . . . . 0.0 107.605 173.539 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 89.3 Cg_exo -50.1 111.36 0.51 Allowed 'Trans proline' 0 CA--C 1.542 0.901 0 C-N-CA 124.801 3.667 . . . . 0.0 117.226 -173.871 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 97.1 Cg_endo -76.34 152.97 35.2 Favored 'Trans proline' 0 CA--C 1.547 1.15 0 C-N-CA 122.109 1.873 . . . . 0.0 111.109 175.254 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 91.6 Cg_exo -43.95 -44.92 11.87 Favored 'Trans proline' 0 CA--C 1.538 0.717 0 C-N-CA 124.755 3.637 . . . . 0.0 116.308 -179.51 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 25.6 m170 -74.76 -5.82 45.45 Favored 'General case' 0 N--CA 1.478 0.95 0 N-CA-C 115.111 1.523 . . . . 0.0 115.111 -179.523 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.458 HD13 HD21 ' A' ' 16' ' ' LEU . 95.5 mt -116.16 -21.24 9.49 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 124.852 1.261 . . . . 0.0 113.122 177.198 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 57.4 mtpt -54.09 -35.46 62.13 Favored 'General case' 0 N--CA 1.477 0.922 0 CA-C-N 119.752 1.16 . . . . 0.0 111.439 175.304 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 23.0 m -63.62 -46.82 83.98 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 124.798 1.239 . . . . 0.0 111.416 174.902 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 75.1 mt-30 -62.51 -44.98 95.03 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.64 0.776 . . . . 0.0 110.884 177.708 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 82.2 mt -61.77 -50.18 73.41 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 124.205 1.002 . . . . 0.0 111.861 177.998 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 7.5 pt-20 -63.6 -35.16 79.59 Favored 'General case' 0 N--CA 1.474 0.726 0 CA-C-N 119.838 1.199 . . . . 0.0 112.895 179.279 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 60.4 mt -60.62 -41.21 87.18 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.795 0 CA-C-N 119.269 0.941 . . . . 0.0 110.063 176.369 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 12.7 t-20 -69.67 -45.0 69.36 Favored 'General case' 0 CA--C 1.545 0.783 0 O-C-N 121.827 -0.545 . . . . 0.0 110.595 175.316 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 1.273 0 C-N-CA 125.171 1.367 . . . . 0.0 113.357 177.726 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.474 0.772 0 N-CA-C 113.818 1.044 . . . . 0.0 113.818 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 87.1 mt -88.81 -8.9 53.54 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 127.26 2.224 . . . . 0.0 113.797 -179.418 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 4.1 m -77.43 76.94 3.97 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-O 122.738 1.256 . . . . 0.0 110.366 -179.632 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -75.65 142.26 42.62 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 128.428 2.691 . . . . 0.0 111.716 -177.139 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 51.8 mt-10 -70.89 149.86 46.33 Favored 'General case' 0 N--CA 1.471 0.612 0 O-C-N 120.718 -1.239 . . . . 0.0 112.08 176.927 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 16.5 m -84.1 155.2 3.66 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.921 0 C-N-CA 123.163 0.585 . . . . 0.0 111.191 174.555 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 42.3 t -74.76 133.56 41.96 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-O 121.861 0.839 . . . . 0.0 110.841 176.861 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 3.4 mpt_? -67.95 -26.96 66.21 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 124.994 1.317 . . . . 0.0 113.437 -177.562 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 7.8 mm-40 -87.86 -32.9 18.75 Favored 'General case' 0 N--CA 1.465 0.32 0 C-N-CA 123.053 0.541 . . . . 0.0 110.701 178.427 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 64.2 t80 -64.15 -31.69 72.98 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 123.513 0.725 . . . . 0.0 110.212 172.93 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 12.0 mm100 -61.61 -24.21 66.54 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 123.669 0.788 . . . . 0.0 112.541 174.382 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 28.0 mtm105 -103.48 -2.36 26.98 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 125.967 1.707 . . . . 0.0 112.575 177.649 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 72.58 35.86 59.02 Favored Glycine 0 CA--C 1.533 1.191 0 C-N-CA 126.223 1.868 . . . . 0.0 113.983 179.927 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 5.3 t -137.15 10.62 3.03 Favored 'General case' 0 N--CA 1.48 1.053 0 N-CA-C 116.122 1.897 . . . . 0.0 116.122 -175.033 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 28.9 t -60.77 131.73 51.61 Favored 'General case' 0 CA--C 1.55 0.971 0 CA-C-N 119.723 1.147 . . . . 0.0 111.518 177.545 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 29.0 m -80.16 5.14 15.26 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 125.811 1.644 . . . . 0.0 114.894 -177.581 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 79.1 mtm-85 -129.69 145.22 56.12 Favored Pre-proline 0 N--CA 1.475 0.798 0 C-N-CA 125.243 1.417 . . . . 0.0 113.491 -175.28 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 93.5 Cg_endo -70.22 166.79 27.01 Favored 'Trans proline' 0 CA--C 1.543 0.959 0 C-N-CA 122.251 1.967 . . . . 0.0 109.803 171.382 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 7.1 p-10 -54.61 -28.76 48.83 Favored 'General case' 0 N--CA 1.475 0.821 0 O-C-N 121.031 -1.043 . . . . 0.0 113.507 177.088 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 35.0 p -75.52 -9.25 58.42 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 125.472 1.509 . . . . 0.0 114.995 178.874 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 25.5 mm-40 -122.12 -25.16 4.96 Favored 'General case' 0 N--CA 1.477 0.901 0 N-CA-C 115.763 1.764 . . . . 0.0 115.763 -175.748 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 4.3 t -71.02 164.55 25.33 Favored 'General case' 0 CA--C 1.545 0.788 0 N-CA-C 115.181 1.549 . . . . 0.0 115.181 -175.164 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -83.33 -13.29 55.37 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 126.888 2.075 . . . . 0.0 113.428 -179.805 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 59.5 m-85 -136.76 171.79 13.98 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 127.093 2.157 . . . . 0.0 110.105 179.068 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -81.26 151.96 27.85 Favored 'General case' 0 CA--C 1.545 0.757 0 N-CA-C 114.555 1.317 . . . . 0.0 114.555 -176.15 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 67.7 m170 -124.25 85.32 55.3 Favored Pre-proline 0 CA--C 1.553 1.072 0 C-N-CA 126.315 1.846 . . . . 0.0 110.638 -179.788 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_endo -63.42 151.71 83.62 Favored 'Trans proline' 0 C--N 1.352 0.762 0 C-N-CA 123.606 2.871 . . . . 0.0 115.166 -177.43 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 59.6 p -84.77 -176.31 6.16 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 124.785 1.234 . . . . 0.0 111.93 174.492 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 67.7 mttm -63.24 -18.34 63.43 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 125.477 1.511 . . . . 0.0 113.407 173.686 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 70.8 p -109.26 -21.23 12.65 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 125.368 1.467 . . . . 0.0 114.696 -178.92 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 84.0 m -63.68 138.89 58.68 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 119.463 1.029 . . . . 0.0 113.581 179.522 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 24.3 mt-30 -78.79 136.82 37.47 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 124.808 1.243 . . . . 0.0 111.449 178.242 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 11.2 t -130.23 135.4 60.88 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.687 0 C-N-CA 124.789 1.235 . . . . 0.0 110.478 -179.484 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -145.91 132.72 20.06 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 125.149 1.379 . . . . 0.0 111.202 178.236 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 63.2 t30 41.16 38.39 0.73 Allowed 'General case' 0 CA--C 1.552 1.038 0 C-N-CA 126.951 2.1 . . . . 0.0 116.419 177.622 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 87.26 14.99 63.11 Favored Glycine 0 CA--C 1.536 1.377 0 O-C-N 121.071 -1.018 . . . . 0.0 115.136 179.892 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 30.0 mtt180 -137.01 163.75 30.0 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 125.452 1.501 . . . . 0.0 112.702 -179.664 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 6.2 m -137.6 141.35 39.51 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.562 0 C-N-CA 127.87 2.468 . . . . 0.0 109.91 -179.243 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 49.8 mt -90.2 142.29 13.14 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.964 0 O-C-N 121.092 -1.005 . . . . 0.0 108.991 178.591 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -90.8 152.28 20.85 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 123.54 0.736 . . . . 0.0 112.693 -179.718 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 3.7 t -70.29 88.87 0.64 Allowed 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.997 1.719 . . . . 0.0 111.398 -177.061 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 28.9 p90 -57.7 -36.86 72.55 Favored 'General case' 0 N--CA 1.469 0.508 0 O-C-N 121.341 -0.849 . . . . 0.0 111.934 179.374 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 66.8 m-20 -59.48 -30.79 68.79 Favored 'General case' 0 CA--C 1.542 0.648 0 O-C-N 121.807 -0.558 . . . . 0.0 111.66 177.269 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 47.9 t -71.28 -41.46 69.99 Favored 'General case' 0 N--CA 1.469 0.513 0 O-C-N 120.744 -1.223 . . . . 0.0 111.104 177.054 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 48.3 mt -66.94 -40.25 87.53 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 123.912 0.885 . . . . 0.0 112.49 175.731 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 14.2 mmmm -78.48 -8.4 58.49 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 125.078 1.351 . . . . 0.0 114.591 -179.381 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 76.05 49.59 8.47 Favored Glycine 0 CA--C 1.534 1.219 0 CA-C-N 118.786 0.721 . . . . 0.0 112.26 -179.222 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.13 -21.8 1.19 Allowed 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 125.981 1.713 . . . . 0.0 115.588 -174.843 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 7.4 t . . . . . 0 CA--C 1.546 0.816 0 N-CA-C 114.362 1.245 . . . . 0.0 114.362 -174.159 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 59.0 m . . . . . 0 CA--C 1.537 0.471 0 CA-C-O 121.84 0.829 . . . . 0.0 111.138 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 35.2 mtmt -115.51 15.65 16.66 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 125.788 1.635 . . . . 0.0 111.144 176.457 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 68.7 m-85 -139.03 150.43 45.79 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 127.714 2.405 . . . . 0.0 111.381 -174.683 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -73.63 122.06 21.69 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 124.598 1.159 . . . . 0.0 112.874 -178.406 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 4.0 m170 -72.92 117.59 61.06 Favored Pre-proline 0 CA--C 1.547 0.83 0 N-CA-C 107.609 -1.256 . . . . 0.0 107.609 171.455 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 90.1 Cg_exo -48.89 111.47 0.48 Allowed 'Trans proline' 0 CA--C 1.545 1.045 0 C-N-CA 124.475 3.45 . . . . 0.0 116.238 -176.301 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 68.1 Cg_endo -74.53 154.1 44.68 Favored 'Trans proline' 0 CA--C 1.542 0.893 0 C-N-CA 122.391 2.061 . . . . 0.0 111.048 176.38 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -54.95 -34.66 87.21 Favored 'Trans proline' 0 CA--C 1.536 0.59 0 C-N-CA 123.532 2.821 . . . . 0.0 114.682 -177.413 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 19.4 t-80 -75.66 -13.44 60.33 Favored 'General case' 0 N--CA 1.474 0.734 0 N-CA-C 114.519 1.303 . . . . 0.0 114.519 178.308 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 87.7 mt -115.55 -14.6 11.5 Favored 'General case' 0 N--CA 1.474 0.769 0 N-CA-C 113.948 1.092 . . . . 0.0 113.948 178.461 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 56.0 mtpt -54.55 -32.71 58.88 Favored 'General case' 0 N--CA 1.475 0.78 0 CA-C-N 119.728 1.149 . . . . 0.0 110.638 173.103 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 17.4 m -62.89 -42.98 99.97 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 124.648 1.179 . . . . 0.0 111.585 175.208 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 -66.65 -47.23 73.19 Favored 'General case' 0 CA--C 1.536 0.438 0 O-C-N 121.419 -0.801 . . . . 0.0 110.093 176.663 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 44.3 mt -61.92 -39.15 91.03 Favored 'General case' 0 N--CA 1.471 0.584 0 N-CA-C 113.183 0.809 . . . . 0.0 113.183 178.287 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 17.7 mm-40 -53.49 -54.29 39.28 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 124.733 1.213 . . . . 0.0 110.443 174.485 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 69.5 mt -68.45 -37.52 77.93 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.402 0 C-N-CA 126.032 1.733 . . . . 0.0 111.197 -176.186 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 72.8 m-20 -63.13 -44.26 96.09 Favored 'General case' 0 CA--C 1.542 0.66 0 O-C-N 121.623 -0.673 . . . . 0.0 110.294 173.081 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.913 0 C-N-CA 124.431 1.015 . . . . 0.0 112.421 179.326 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.475 0.798 0 N-CA-C 112.785 0.661 . . . . 0.0 112.785 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 85.7 mt -95.06 -20.34 19.4 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 127.269 2.228 . . . . 0.0 114.081 -177.649 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 4.5 m -73.19 73.69 1.26 Allowed 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 125.251 1.42 . . . . 0.0 112.029 -178.957 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.545 HD21 HD13 ' A' ' 75' ' ' LEU . 10.2 tp -75.67 145.25 41.12 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 127.137 2.175 . . . . 0.0 112.098 -178.751 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 11.2 mt-10 -72.95 152.19 41.51 Favored 'General case' 0 N--CA 1.471 0.588 0 O-C-N 120.589 -1.319 . . . . 0.0 112.865 179.146 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 18.0 m -85.21 156.18 3.49 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.852 0 C-N-CA 123.333 0.653 . . . . 0.0 111.446 175.559 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 42.6 t -75.69 128.06 34.39 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-O 121.61 0.719 . . . . 0.0 110.44 176.741 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 4.3 mpt_? -66.82 -27.64 67.72 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 124.384 1.073 . . . . 0.0 113.141 -177.658 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -78.92 -40.75 31.27 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.457 0.703 . . . . 0.0 109.518 177.803 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 63.8 t80 -62.79 -35.28 79.36 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 124.752 1.221 . . . . 0.0 111.2 175.745 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 50.3 mm-40 -62.04 -15.92 48.12 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 124.408 1.083 . . . . 0.0 113.406 175.248 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 12.0 mtp-105 -120.82 12.71 11.37 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 127.06 2.144 . . . . 0.0 112.266 -179.852 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 58.06 34.62 73.37 Favored Glycine 0 CA--C 1.535 1.285 0 C-N-CA 125.061 1.315 . . . . 0.0 113.845 -179.791 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 7.6 t -129.87 14.1 5.82 Favored 'General case' 0 N--CA 1.475 0.796 0 N-CA-C 114.597 1.332 . . . . 0.0 114.597 -175.342 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 6.8 t -68.57 173.35 5.14 Favored 'General case' 0 CA--C 1.556 1.176 0 O-C-N 121.409 -0.807 . . . . 0.0 110.837 174.133 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 91.6 p -139.4 9.34 2.47 Favored 'General case' 0 N--CA 1.477 0.878 0 N-CA-C 115.097 1.517 . . . . 0.0 115.097 -176.825 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 48.3 mtt85 -130.86 145.47 57.85 Favored Pre-proline 0 N--CA 1.47 0.569 0 C-N-CA 125.596 1.558 . . . . 0.0 112.116 -177.589 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -69.05 166.44 26.72 Favored 'Trans proline' 0 CA--C 1.543 0.958 0 C-N-CA 121.962 1.775 . . . . 0.0 109.735 171.973 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -54.24 -29.79 47.88 Favored 'General case' 0 N--CA 1.476 0.862 0 O-C-N 121.129 -0.982 . . . . 0.0 113.054 176.946 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 31.7 p -73.1 -7.63 52.17 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 125.991 1.717 . . . . 0.0 115.004 178.317 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 21.8 mt-10 -127.39 -24.33 3.37 Favored 'General case' 0 N--CA 1.476 0.838 0 N-CA-C 116.059 1.874 . . . . 0.0 116.059 -176.167 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 1.1 t -71.71 164.64 25.59 Favored 'General case' 0 CA--C 1.543 0.691 0 N-CA-C 115.415 1.635 . . . . 0.0 115.415 -176.538 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -81.62 -10.81 59.33 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 126.591 1.956 . . . . 0.0 113.717 -178.598 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 63.1 m-85 -140.06 174.0 10.96 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 126.549 1.939 . . . . 0.0 110.336 179.507 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -80.11 150.02 30.4 Favored 'General case' 0 CA--C 1.548 0.871 0 N-CA-C 113.349 0.87 . . . . 0.0 113.349 -176.957 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 65.8 m170 -123.42 86.14 52.19 Favored Pre-proline 0 CA--C 1.553 1.092 0 C-N-CA 126.049 1.74 . . . . 0.0 110.965 -179.327 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_endo -63.82 152.64 79.75 Favored 'Trans proline' 0 CA--C 1.541 0.842 0 C-N-CA 123.704 2.936 . . . . 0.0 114.998 -177.894 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 39.2 p -92.32 -174.44 3.72 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 124.99 1.316 . . . . 0.0 112.096 175.563 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -62.09 -17.02 56.32 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 125.693 1.597 . . . . 0.0 113.559 173.31 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 61.2 m -109.07 -25.71 10.54 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 124.719 1.208 . . . . 0.0 114.081 -179.744 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 75.2 m -60.56 129.52 41.98 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 123.861 0.864 . . . . 0.0 113.137 -179.618 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 33.9 mt-30 -77.05 141.62 40.21 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 123.161 0.584 . . . . 0.0 110.978 176.115 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 14.5 t -129.48 139.59 51.3 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 C-N-CA 125.438 1.495 . . . . 0.0 110.604 -177.695 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 74.1 mm-40 -145.32 129.35 17.49 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 125.213 1.405 . . . . 0.0 111.49 179.943 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 63.3 t30 42.88 37.23 1.03 Allowed 'General case' 0 CA--C 1.555 1.138 0 N-CA-C 116.298 1.962 . . . . 0.0 116.298 176.684 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 85.58 17.18 62.49 Favored Glycine 0 CA--C 1.536 1.399 0 O-C-N 120.975 -1.078 . . . . 0.0 114.813 -179.407 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 60.8 mtt180 -138.72 162.01 35.75 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 125.842 1.657 . . . . 0.0 111.472 -179.1 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 4.9 m -138.35 142.25 35.7 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.626 0 C-N-CA 126.949 2.1 . . . . 0.0 109.938 -177.869 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 31.8 mt -90.36 129.28 41.46 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.766 0 O-C-N 121.289 -0.882 . . . . 0.0 110.337 -178.048 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -75.53 149.24 38.43 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 124.16 0.984 . . . . 0.0 111.733 177.868 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 15.2 t -69.45 99.52 1.25 Allowed 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 124.876 1.27 . . . . 0.0 112.985 -176.696 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 32.1 p90 -61.66 -38.56 88.19 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 115.165 -0.925 . . . . 0.0 110.154 175.108 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 69.9 m-20 -61.26 -41.78 97.52 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 123.17 0.588 . . . . 0.0 111.033 177.187 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 48.2 t -64.63 -41.65 96.03 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-N 119.48 1.036 . . . . 0.0 111.462 177.678 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 31.2 mt -66.5 -41.63 88.6 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 123.804 0.841 . . . . 0.0 112.882 176.504 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 31.4 mmmt -77.77 -10.97 59.82 Favored 'General case' 0 N--CA 1.478 0.966 0 C-N-CA 124.668 1.187 . . . . 0.0 113.71 179.158 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 81.14 38.39 15.44 Favored Glycine 0 CA--C 1.537 1.412 0 C-N-CA 124.605 1.098 . . . . 0.0 113.803 179.644 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 50.9 ttp180 -121.97 -20.78 6.22 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 126.551 1.94 . . . . 0.0 114.555 -176.592 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 5.4 t . . . . . 0 CA--C 1.544 0.728 0 CA-C-N 119.318 0.963 . . . . 0.0 112.973 -178.286 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 7.4 t . . . . . 0 CA--C 1.545 0.751 0 CA-C-O 121.625 0.726 . . . . 0.0 112.167 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 30.4 mtmt -84.64 4.49 32.15 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 125.07 1.348 . . . . 0.0 114.089 -177.374 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 86.8 m-85 -127.24 155.71 43.03 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 124.823 1.249 . . . . 0.0 112.173 -175.304 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -77.31 114.43 16.12 Favored 'General case' 0 N--CA 1.467 0.412 0 C-N-CA 123.699 0.799 . . . . 0.0 112.079 -177.306 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 9.3 m170 -69.57 115.16 30.09 Favored Pre-proline 0 CA--C 1.546 0.805 0 N-CA-C 107.741 -1.207 . . . . 0.0 107.741 173.849 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 92.9 Cg_exo -49.71 114.1 1.22 Allowed 'Trans proline' 0 CA--C 1.543 0.967 0 C-N-CA 124.554 3.503 . . . . 0.0 116.238 -174.887 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -77.42 149.76 27.81 Favored 'Trans proline' 0 CA--C 1.542 0.923 0 C-N-CA 122.114 1.876 . . . . 0.0 110.435 175.876 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 88.5 Cg_exo -46.87 -39.47 24.48 Favored 'Trans proline' 0 CA--C 1.539 0.739 0 C-N-CA 123.895 3.064 . . . . 0.0 115.437 -179.968 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 12.7 t-80 -70.71 -17.78 62.82 Favored 'General case' 0 N--CA 1.472 0.666 0 N-CA-C 115.08 1.511 . . . . 0.0 115.08 179.774 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.545 HD13 HD21 ' A' ' 16' ' ' LEU . 76.3 mt -113.32 -16.36 12.51 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 124.597 1.159 . . . . 0.0 113.009 178.143 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 53.6 mtpt -54.72 -34.73 62.82 Favored 'General case' 0 N--CA 1.478 0.964 0 CA-C-N 119.742 1.156 . . . . 0.0 111.533 174.365 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 23.0 m -63.75 -43.72 95.62 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 123.461 0.705 . . . . 0.0 111.329 175.805 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 91.1 mm-40 -67.22 -45.7 76.03 Favored 'General case' 0 N--CA 1.469 0.514 0 O-C-N 121.458 -0.776 . . . . 0.0 111.002 177.598 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 81.8 mt -61.82 -49.86 74.59 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 124.376 1.07 . . . . 0.0 112.285 178.467 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.35 -35.84 82.2 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-N 119.541 1.064 . . . . 0.0 112.735 -179.598 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 59.4 mt -62.58 -44.29 99.24 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.785 0 CA-C-N 118.759 0.709 . . . . 0.0 109.851 174.582 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 13.3 t-20 -63.98 -39.8 94.94 Favored 'General case' 0 CA--C 1.546 0.814 0 O-C-N 121.677 -0.639 . . . . 0.0 110.5 175.78 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.532 1.115 0 C-N-CA 124.858 1.218 . . . . 0.0 112.259 176.564 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.475 0.808 0 N-CA-C 112.923 0.712 . . . . 0.0 112.923 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 83.9 mt -85.13 -13.89 48.75 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 126.816 2.046 . . . . 0.0 114.017 -178.714 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 11.1 m -77.97 79.17 4.44 Favored 'General case' 0 N--CA 1.475 0.821 0 CA-C-O 122.442 1.115 . . . . 0.0 110.398 -178.538 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -75.64 140.78 42.76 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 128.492 2.717 . . . . 0.0 111.363 -177.612 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 14.5 mt-10 -74.47 151.49 39.56 Favored 'General case' 0 N--CA 1.472 0.664 0 O-C-N 120.49 -1.381 . . . . 0.0 112.179 177.917 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 13.9 m -83.46 155.77 3.76 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.765 0 C-N-CA 122.848 0.459 . . . . 0.0 110.605 175.372 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 40.5 t -75.0 130.12 38.82 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-O 121.646 0.736 . . . . 0.0 110.648 177.096 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 3.5 mpt_? -67.59 -28.68 67.97 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 124.355 1.062 . . . . 0.0 113.207 -177.32 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -82.26 -33.06 29.34 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 118.262 0.483 . . . . 0.0 110.831 178.436 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 72.9 t80 -64.96 -35.92 82.72 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 123.702 0.801 . . . . 0.0 109.657 172.938 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 60.2 mm-40 -65.01 -18.6 65.44 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 124.132 0.973 . . . . 0.0 112.591 173.786 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 47.9 mtp180 -106.67 3.26 26.59 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 126.481 1.912 . . . . 0.0 112.494 178.523 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 62.61 34.04 88.38 Favored Glycine 0 CA--C 1.537 1.417 0 C-N-CA 125.197 1.379 . . . . 0.0 113.606 -178.077 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 5.3 t -138.12 16.09 2.82 Favored 'General case' 0 N--CA 1.478 0.937 0 N-CA-C 115.464 1.653 . . . . 0.0 115.464 -174.854 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 7.5 t -64.71 168.79 5.69 Favored 'General case' 0 CA--C 1.558 1.277 0 CA-C-N 119.275 0.943 . . . . 0.0 111.441 175.647 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 50.7 m -128.95 7.2 5.54 Favored 'General case' 0 N--CA 1.48 1.046 0 N-CA-C 115.562 1.69 . . . . 0.0 115.562 -175.289 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 87.9 mtt180 -137.07 145.68 51.4 Favored Pre-proline 0 N--CA 1.474 0.748 0 C-N-CA 125.527 1.531 . . . . 0.0 111.921 -178.874 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 74.6 Cg_endo -69.26 167.66 23.13 Favored 'Trans proline' 0 CA--C 1.544 1.005 0 C-N-CA 122.231 1.954 . . . . 0.0 110.141 172.49 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -54.38 -31.19 54.24 Favored 'General case' 0 N--CA 1.48 1.038 0 O-C-N 121.079 -1.013 . . . . 0.0 112.492 177.543 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 23.5 p -71.33 -6.94 43.73 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 126.318 1.847 . . . . 0.0 114.982 177.206 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 29.4 mt-10 -132.56 -21.44 2.24 Favored 'General case' 0 N--CA 1.476 0.836 0 N-CA-C 116.342 1.979 . . . . 0.0 116.342 -176.27 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 3.7 t -72.19 169.87 15.23 Favored 'General case' 0 CA--C 1.552 1.037 0 CA-C-N 119.935 1.243 . . . . 0.0 114.214 -177.977 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 56.0 mtmt -88.26 -10.66 48.91 Favored 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 126.518 1.927 . . . . 0.0 114.081 -178.516 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 66.7 m-85 -139.33 171.63 13.99 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 127.301 2.24 . . . . 0.0 109.389 177.02 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -82.38 150.86 26.91 Favored 'General case' 0 CA--C 1.546 0.809 0 N-CA-C 114.644 1.349 . . . . 0.0 114.644 -175.894 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 57.4 m170 -122.88 88.28 50.52 Favored Pre-proline 0 CA--C 1.552 1.028 0 C-N-CA 126.017 1.727 . . . . 0.0 110.577 179.073 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 26.5 Cg_endo -61.79 148.06 93.92 Favored 'Trans proline' 0 C--N 1.352 0.731 0 C-N-CA 123.148 2.565 . . . . 0.0 114.569 -178.315 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 59.7 p -82.48 -178.92 7.24 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 124.405 1.082 . . . . 0.0 111.908 175.055 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 31.2 mmmt -61.43 -17.36 53.98 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 125.445 1.498 . . . . 0.0 113.352 173.383 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 50.5 m -109.2 -17.94 13.73 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 125.016 1.326 . . . . 0.0 114.535 -178.686 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 83.5 m -69.27 154.14 42.52 Favored 'General case' 0 CA--C 1.543 0.676 0 CA-C-N 119.704 1.138 . . . . 0.0 112.682 177.833 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 39.0 mt-30 -110.13 141.21 43.33 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 124.483 1.113 . . . . 0.0 111.466 178.807 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -133.38 148.34 30.97 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.558 0 C-N-CA 125.054 1.342 . . . . 0.0 112.632 -177.48 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -146.01 140.79 27.09 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 125.934 1.694 . . . . 0.0 110.524 177.015 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 7.3 t-20 46.51 30.7 1.14 Allowed 'General case' 0 CA--C 1.553 1.069 0 C-N-CA 126.083 1.753 . . . . 0.0 115.245 179.207 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 82.09 22.81 58.54 Favored Glycine 0 CA--C 1.537 1.425 0 O-C-N 121.044 -1.035 . . . . 0.0 114.19 -178.253 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 53.2 mtt85 -138.13 160.64 38.87 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 125.249 1.42 . . . . 0.0 112.088 -178.446 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 4.4 m -136.78 138.59 46.01 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.514 0 C-N-CA 127.733 2.413 . . . . 0.0 109.886 -176.99 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 20.6 mt -88.48 129.77 39.09 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.558 0 O-C-N 121.306 -0.871 . . . . 0.0 109.63 -179.033 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -75.39 147.2 40.21 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 123.84 0.856 . . . . 0.0 111.067 178.054 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 11.8 t -69.23 98.79 1.07 Allowed 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 124.489 1.115 . . . . 0.0 112.538 -177.094 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 30.8 p90 -60.91 -38.18 84.82 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.104 175.645 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 70.1 m-20 -62.14 -36.65 82.44 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 123.571 0.748 . . . . 0.0 111.695 177.098 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 29.6 t -66.67 -42.12 87.07 Favored 'General case' 0 CA--C 1.539 0.558 0 CA-C-N 119.613 1.097 . . . . 0.0 111.146 176.461 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 31.8 mt -67.75 -39.89 84.17 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 123.82 0.848 . . . . 0.0 112.836 176.573 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . 0.444 ' HA ' ' HE2' ' A' ' 58' ' ' LYS . 10.0 mmpt? -80.82 -7.55 59.45 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 125.034 1.334 . . . . 0.0 114.161 -179.397 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 78.26 39.45 22.86 Favored Glycine 0 CA--C 1.536 1.366 0 C-N-CA 124.428 1.013 . . . . 0.0 113.837 179.021 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 34.7 ttm105 -120.73 -27.42 5.07 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 126.805 2.042 . . . . 0.0 113.755 -177.17 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 7.2 t . . . . . 0 CA--C 1.544 0.741 0 CA-C-N 118.991 0.814 . . . . 0.0 112.229 -178.293 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 4.2 t . . . . . 0 CA--C 1.545 0.771 0 CA-C-O 121.271 0.557 . . . . 0.0 111.159 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 32.5 mtmt -117.55 2.7 12.4 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 125.723 1.609 . . . . 0.0 113.533 -177.304 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 88.4 m-85 -123.45 151.74 42.37 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 125.95 1.7 . . . . 0.0 110.461 -176.987 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -75.08 115.42 14.69 Favored 'General case' 0 N--CA 1.467 0.396 0 O-C-N 121.595 -0.69 . . . . 0.0 112.017 -176.331 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 14.4 m170 -70.53 114.0 22.77 Favored Pre-proline 0 CA--C 1.547 0.857 0 N-CA-C 108.199 -1.038 . . . . 0.0 108.199 175.161 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 66.4 Cg_exo -46.96 109.53 0.22 Allowed 'Trans proline' 0 CA--C 1.544 1.01 0 C-N-CA 125.074 3.849 . . . . 0.0 117.143 -174.168 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_endo -77.59 151.59 28.89 Favored 'Trans proline' 0 CA--C 1.544 1.013 0 C-N-CA 122.815 2.343 . . . . 0.0 111.35 176.462 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_exo -47.26 -40.67 27.94 Favored 'Trans proline' 0 CA--C 1.539 0.769 0 C-N-CA 123.916 3.077 . . . . 0.0 115.496 179.059 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 8.3 m-70 -70.64 -15.79 62.76 Favored 'General case' 0 N--CA 1.476 0.866 0 N-CA-C 114.87 1.433 . . . . 0.0 114.87 178.98 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 85.7 mt -116.42 -15.21 10.94 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 124.116 0.966 . . . . 0.0 113.562 178.956 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 54.9 mtpt -55.73 -32.32 63.26 Favored 'General case' 0 N--CA 1.475 0.808 0 CA-C-N 119.736 1.153 . . . . 0.0 110.527 172.944 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 21.5 m -62.82 -45.45 92.57 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 124.206 1.002 . . . . 0.0 111.227 174.811 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 77.6 mt-30 -64.94 -46.54 81.17 Favored 'General case' 0 CA--C 1.54 0.57 0 O-C-N 121.39 -0.819 . . . . 0.0 110.518 176.636 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 85.1 mt -61.92 -39.8 93.3 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 124.33 1.052 . . . . 0.0 112.711 178.164 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 20.1 mm-40 -55.71 -53.64 54.13 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 124.89 1.276 . . . . 0.0 110.428 174.975 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 62.3 mt -67.68 -38.63 80.71 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.428 0 C-N-CA 125.711 1.605 . . . . 0.0 111.074 -175.97 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 54.7 m-20 -62.32 -43.46 98.76 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 123.157 0.583 . . . . 0.0 110.394 172.65 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.527 0.832 0 C-N-CA 124.209 0.909 . . . . 0.0 111.81 178.558 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.476 0.875 0 N-CA-C 114.687 1.366 . . . . 0.0 114.687 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 67.8 mt -86.09 -10.32 55.12 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 126.72 2.008 . . . . 0.0 114.091 -177.463 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 3.6 m -75.76 76.24 2.72 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 124.752 1.221 . . . . 0.0 110.922 -178.698 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.433 HD21 HD13 ' A' ' 75' ' ' LEU . 13.7 tp -75.43 140.76 43.1 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 127.684 2.394 . . . . 0.0 111.51 -177.099 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 47.1 mp0 -67.53 150.88 48.26 Favored 'General case' 0 CA--C 1.543 0.683 0 O-C-N 120.569 -1.332 . . . . 0.0 111.977 178.396 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 21.2 m -87.08 149.58 4.06 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.075 0 C-N-CA 122.915 0.486 . . . . 0.0 111.054 174.588 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . 0.434 ' SG ' ' NZ ' ' A' ' 35' ' ' LYS . 46.9 t -70.89 134.72 47.5 Favored 'General case' 0 CA--C 1.538 0.493 0 O-C-N 121.621 -0.675 . . . . 0.0 110.782 177.035 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 3.7 mpt_? -71.75 -33.39 68.62 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 125.521 1.528 . . . . 0.0 112.721 -178.09 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 34.9 mt-10 -73.91 -38.0 64.46 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 123.731 0.812 . . . . 0.0 110.498 178.539 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 76.8 t80 -63.15 -28.7 70.24 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 124.804 1.242 . . . . 0.0 111.922 177.237 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 53.4 mm-40 -64.04 -19.97 65.59 Favored 'General case' 0 N--CA 1.477 0.9 0 N-CA-C 112.982 0.734 . . . . 0.0 112.982 175.978 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 6.8 mpt_? -110.8 9.36 22.59 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 125.987 1.715 . . . . 0.0 111.865 177.732 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 58.47 35.05 77.92 Favored Glycine 0 CA--C 1.533 1.186 0 C-N-CA 125.065 1.317 . . . . 0.0 114.094 -179.831 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 6.4 t -129.24 8.81 5.58 Favored 'General case' 0 N--CA 1.478 0.959 0 N-CA-C 114.51 1.3 . . . . 0.0 114.51 -175.76 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 12.4 t -60.34 136.66 58.11 Favored 'General case' 0 CA--C 1.55 0.962 0 C-N-CA 123.555 0.742 . . . . 0.0 111.305 177.61 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 33.1 m -80.6 -1.96 44.36 Favored 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 115.984 1.846 . . . . 0.0 115.984 -176.302 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 23.1 mtm-85 -134.21 151.71 76.94 Favored Pre-proline 0 N--CA 1.479 0.991 0 C-N-CA 124.971 1.308 . . . . 0.0 113.277 -174.702 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 89.7 Cg_endo -71.22 167.7 25.45 Favored 'Trans proline' 0 CA--C 1.544 0.983 0 C-N-CA 122.553 2.169 . . . . 0.0 109.924 172.306 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -53.16 -28.52 26.69 Favored 'General case' 0 N--CA 1.475 0.808 0 N-CA-C 114.518 1.303 . . . . 0.0 114.518 178.776 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 12.4 p -75.99 -14.81 60.23 Favored 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 115.024 1.49 . . . . 0.0 115.024 179.057 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -121.42 -18.39 7.31 Favored 'General case' 0 N--CA 1.476 0.843 0 N-CA-C 116.711 2.115 . . . . 0.0 116.711 -173.122 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 2.9 t -72.81 172.23 11.2 Favored 'General case' 0 CA--C 1.55 0.966 0 N-CA-C 116.349 1.981 . . . . 0.0 116.349 -176.763 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.434 ' NZ ' ' SG ' ' A' ' 19' ' ' CYS . 7.0 ptpp? -75.2 -22.69 57.82 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 129.543 3.137 . . . . 0.0 115.274 -178.347 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 11.5 m-85 -144.08 176.36 9.36 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 126.678 1.991 . . . . 0.0 110.268 -176.632 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -77.26 147.57 36.23 Favored 'General case' 0 CA--C 1.548 0.894 0 O-C-N 121.137 -0.977 . . . . 0.0 113.428 -176.577 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 55.0 m170 -120.68 87.36 41.85 Favored Pre-proline 0 CA--C 1.552 1.037 0 C-N-CA 125.843 1.657 . . . . 0.0 110.623 179.854 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_endo -61.57 146.57 96.8 Favored 'Trans proline' 0 CA--C 1.539 0.768 0 C-N-CA 123.552 2.835 . . . . 0.0 115.014 -177.683 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 53.6 p -84.64 -174.7 5.42 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 125.148 1.379 . . . . 0.0 112.266 175.714 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -60.75 -22.12 63.71 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 125.712 1.605 . . . . 0.0 113.67 174.355 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 66.7 p -109.16 -19.75 13.23 Favored 'General case' 0 N--CA 1.478 0.94 0 N-CA-C 114.413 1.264 . . . . 0.0 114.413 179.444 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 98.4 m -60.51 129.87 43.77 Favored 'General case' 0 CA--C 1.542 0.667 0 CA-C-N 119.723 1.147 . . . . 0.0 112.54 179.296 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 48.6 tt0 -83.46 133.76 34.89 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 124.815 1.246 . . . . 0.0 110.395 178.904 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 21.5 t -116.9 141.94 32.9 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.929 0 C-N-CA 125.525 1.53 . . . . 0.0 109.939 -177.719 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 74.5 mm-40 -142.63 125.67 16.29 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 125.239 1.416 . . . . 0.0 111.303 -179.175 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 63.6 t30 42.17 38.16 1.06 Allowed 'General case' 0 CA--C 1.555 1.152 0 N-CA-C 116.708 2.114 . . . . 0.0 116.708 175.718 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 88.62 14.9 60.74 Favored Glycine 0 CA--C 1.536 1.398 0 O-C-N 120.869 -1.144 . . . . 0.0 115.082 -179.656 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 48.3 mtt-85 -139.82 168.48 19.73 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 126.341 1.857 . . . . 0.0 112.099 -178.988 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 3.5 m -139.85 138.17 38.6 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.539 0 C-N-CA 126.947 2.099 . . . . 0.0 109.491 179.636 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 70.8 mt -86.21 135.66 24.57 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.783 0 O-C-N 120.992 -1.068 . . . . 0.0 109.451 179.955 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -80.75 150.08 29.4 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 123.66 0.784 . . . . 0.0 112.454 178.687 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 7.5 t -70.09 94.16 0.86 Allowed 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 126.183 1.793 . . . . 0.0 110.135 -179.479 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 29.5 p90 -56.41 -37.66 70.48 Favored 'General case' 0 N--CA 1.471 0.587 0 O-C-N 121.069 -1.019 . . . . 0.0 112.118 -179.738 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 -60.45 -29.16 68.85 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 123.452 0.701 . . . . 0.0 112.276 177.623 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 47.8 p -71.14 -37.87 72.27 Favored 'General case' 0 N--CA 1.471 0.58 0 O-C-N 121.079 -1.013 . . . . 0.0 111.757 177.035 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 69.8 mt -74.16 -42.82 59.32 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.416 1.086 . . . . 0.0 111.876 176.74 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 31.2 mmmt -74.13 -11.96 60.45 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 124.766 1.227 . . . . 0.0 113.795 179.836 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 80.48 41.22 11.65 Favored Glycine 0 CA--C 1.536 1.355 0 C-N-CA 124.449 1.023 . . . . 0.0 114.052 178.462 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 48.4 ttp180 -127.06 -18.65 4.55 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 126.264 1.826 . . . . 0.0 114.834 -176.694 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 8.4 t . . . . . 0 CA--C 1.548 0.87 0 CA-C-N 119.286 0.948 . . . . 0.0 112.538 -179.818 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 3.8 m . . . . . 0 CA--C 1.54 0.583 0 N-CA-C 113.495 0.924 . . . . 0.0 113.495 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 22.6 mtmt -78.29 6.94 7.19 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 123.152 0.581 . . . . 0.0 111.918 173.485 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 58.0 m-85 -127.55 150.85 49.51 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 126.698 1.999 . . . . 0.0 111.214 -174.149 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -79.17 126.89 31.33 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 124.048 0.939 . . . . 0.0 113.285 -175.445 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 38.1 m170 -75.5 115.49 46.15 Favored Pre-proline 0 CA--C 1.548 0.872 0 N-CA-C 106.717 -1.586 . . . . 0.0 106.717 170.496 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 81.7 Cg_exo -53.2 122.52 11.31 Favored 'Trans proline' 0 CA--C 1.543 0.955 0 C-N-CA 123.659 2.906 . . . . 0.0 115.146 -175.552 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_endo -77.91 155.03 30.2 Favored 'Trans proline' 0 CA--C 1.542 0.908 0 C-N-CA 122.226 1.951 . . . . 0.0 111.119 177.5 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 80.4 Cg_exo -45.32 -37.12 13.68 Favored 'Trans proline' 0 CA--C 1.538 0.724 0 C-N-CA 124.306 3.337 . . . . 0.0 115.848 179.214 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 76.4 m80 -78.66 -13.21 59.94 Favored 'General case' 0 N--CA 1.474 0.729 0 N-CA-C 115.336 1.606 . . . . 0.0 115.336 -179.898 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.433 HD13 HD21 ' A' ' 16' ' ' LEU . 50.8 mt -118.7 -9.64 10.16 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.617 1.167 . . . . 0.0 113.252 177.732 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 56.3 mtpt -55.84 -39.2 71.08 Favored 'General case' 0 N--CA 1.481 1.096 0 CA-C-N 120.293 1.406 . . . . 0.0 110.098 171.209 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 20.4 m -62.63 -41.44 99.02 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 124.423 1.089 . . . . 0.0 111.463 175.026 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 47.2 tp60 -66.2 -42.34 88.94 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 124.311 1.044 . . . . 0.0 110.929 178.185 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 27.6 mt -67.74 -42.3 82.07 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-O 118.516 -0.754 . . . . 0.0 112.597 178.054 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 3.1 pt-20 -64.01 -36.83 85.28 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-N 119.869 1.213 . . . . 0.0 111.056 175.665 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 64.2 mt -63.06 -42.91 98.43 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.721 0 CA-C-N 118.97 0.805 . . . . 0.0 109.812 175.332 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 60.0 m-20 -60.97 -48.14 83.2 Favored 'General case' 0 CA--C 1.545 0.783 0 CA-C-N 118.495 0.589 . . . . 0.0 110.28 175.724 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.471 0.991 0 C-N-CA 124.955 1.265 . . . . 0.0 112.51 179.076 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.544 0.738 0 N-CA-C 112.992 0.738 . . . . 0.0 112.992 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 71.3 mt -98.08 -18.3 18.61 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 126.536 1.934 . . . . 0.0 114.659 -177.119 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 6.5 m -77.19 77.76 3.73 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 124.508 1.123 . . . . 0.0 110.68 -178.01 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -75.7 143.43 42.13 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 129.022 2.929 . . . . 0.0 111.843 -177.758 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 52.3 mt-10 -71.08 151.29 44.67 Favored 'General case' 0 N--CA 1.472 0.651 0 O-C-N 120.695 -1.253 . . . . 0.0 112.386 177.212 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 15.7 m -84.11 155.79 3.66 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.03 0 C-N-CA 123.277 0.631 . . . . 0.0 111.286 174.04 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 52.8 t -75.59 133.34 40.95 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-O 121.852 0.834 . . . . 0.0 111.199 176.924 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 3.1 mpt_? -69.59 -26.62 64.54 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 124.716 1.207 . . . . 0.0 112.91 -178.876 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -82.79 -36.54 25.53 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 122.966 0.506 . . . . 0.0 109.906 177.353 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 61.3 t80 -65.27 -34.41 78.27 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 124.245 1.018 . . . . 0.0 110.344 175.161 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 12.0 mm100 -63.11 -14.2 45.62 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 124.527 1.131 . . . . 0.0 112.86 173.791 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 81.9 mtt85 -119.16 10.17 11.99 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 127.091 2.156 . . . . 0.0 112.083 -179.845 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 57.34 35.14 70.01 Favored Glycine 0 CA--C 1.534 1.26 0 C-N-CA 125.528 1.537 . . . . 0.0 114.304 -179.637 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 4.8 t -134.65 6.08 3.45 Favored 'General case' 0 N--CA 1.477 0.91 0 N-CA-C 115.205 1.557 . . . . 0.0 115.205 -174.604 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 17.6 t -58.82 128.65 38.28 Favored 'General case' 0 CA--C 1.547 0.835 0 O-C-N 120.938 -1.101 . . . . 0.0 111.037 177.374 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 78.5 p -83.92 6.55 21.31 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 125.616 1.567 . . . . 0.0 114.346 -178.371 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 61.6 mtm-85 -131.35 145.22 56.7 Favored Pre-proline 0 N--CA 1.471 0.618 0 C-N-CA 125.421 1.488 . . . . 0.0 113.979 -172.991 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 98.1 Cg_endo -70.29 166.19 29.08 Favored 'Trans proline' 0 CA--C 1.544 1.001 0 C-N-CA 122.225 1.95 . . . . 0.0 109.816 171.074 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -54.28 -29.23 46.44 Favored 'General case' 0 N--CA 1.476 0.843 0 O-C-N 121.142 -0.973 . . . . 0.0 113.423 176.692 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 30.6 p -73.82 -13.22 60.9 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 125.873 1.669 . . . . 0.0 115.092 178.9 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 29.9 mm-40 -115.94 -29.85 6.23 Favored 'General case' 0 N--CA 1.478 0.926 0 N-CA-C 115.182 1.549 . . . . 0.0 115.182 -177.073 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 4.1 t -65.12 166.5 9.48 Favored 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 115.499 1.666 . . . . 0.0 115.499 -173.883 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.36 -13.03 47.67 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 127.391 2.277 . . . . 0.0 112.524 -179.324 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 57.8 m-85 -137.67 175.97 9.12 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 126.383 1.873 . . . . 0.0 110.237 -179.296 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -83.55 150.89 25.67 Favored 'General case' 0 CA--C 1.544 0.726 0 N-CA-C 113.725 1.009 . . . . 0.0 113.725 -177.487 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 66.0 m170 -122.19 85.85 46.99 Favored Pre-proline 0 CA--C 1.55 0.975 0 C-N-CA 126.116 1.766 . . . . 0.0 111.001 -179.624 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_endo -63.09 144.93 93.52 Favored 'Trans proline' 0 C--N 1.351 0.709 0 C-N-CA 123.402 2.735 . . . . 0.0 114.694 -177.841 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 59.9 p -82.83 -175.76 5.96 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 124.608 1.163 . . . . 0.0 111.906 174.909 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 75.2 mmtt -61.1 -19.91 62.02 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 125.497 1.519 . . . . 0.0 113.481 173.524 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 68.6 p -109.17 -18.22 13.67 Favored 'General case' 0 N--CA 1.477 0.884 0 N-CA-C 114.863 1.431 . . . . 0.0 114.863 -179.594 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 91.2 m -62.74 139.66 58.69 Favored 'General case' 0 CA--C 1.543 0.694 0 CA-C-N 119.576 1.08 . . . . 0.0 113.723 -179.61 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 47.2 tp60 -80.76 130.03 34.85 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 125.422 1.489 . . . . 0.0 110.371 178.235 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 9.9 t -126.52 137.2 58.53 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.022 0 C-N-CA 125.324 1.45 . . . . 0.0 110.509 -178.012 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -147.07 130.89 17.04 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 125.293 1.437 . . . . 0.0 111.745 178.512 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 62.2 t30 40.12 38.85 0.55 Allowed 'General case' 0 CA--C 1.553 1.065 0 C-N-CA 127.211 2.204 . . . . 0.0 116.758 176.802 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 90.12 11.54 62.96 Favored Glycine 0 CA--C 1.537 1.42 0 O-C-N 121.016 -1.053 . . . . 0.0 115.299 179.41 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 44.7 mtm180 -135.91 164.36 28.13 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 125.622 1.569 . . . . 0.0 112.038 179.78 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 8.2 m -139.29 149.19 23.09 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.573 0 C-N-CA 127.581 2.352 . . . . 0.0 109.413 -179.628 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 40.2 mt -97.54 129.42 47.69 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.913 0 O-C-N 121.018 -1.051 . . . . 0.0 110.651 -177.527 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -74.58 145.76 43.1 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 124.125 0.97 . . . . 0.0 111.406 177.206 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 13.2 t -69.47 99.61 1.27 Allowed 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 124.828 1.251 . . . . 0.0 113.175 -176.683 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 41.3 p90 -61.89 -38.92 90.15 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 115.157 -0.929 . . . . 0.0 110.29 175.299 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 65.9 m-20 -60.79 -41.3 95.3 Favored 'General case' 0 CA--C 1.54 0.577 0 O-C-N 121.787 -0.571 . . . . 0.0 110.836 176.78 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 43.8 t -65.09 -41.76 94.72 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-N 119.548 1.067 . . . . 0.0 111.347 177.269 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 31.1 mt -65.41 -41.9 93.13 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 124.009 0.923 . . . . 0.0 112.923 176.492 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 31.4 mmmt -78.33 -12.59 60.01 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 124.948 1.299 . . . . 0.0 113.753 179.325 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 84.03 39.27 9.45 Favored Glycine 0 CA--C 1.536 1.395 0 C-N-CA 124.639 1.114 . . . . 0.0 114.078 179.281 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 50.4 tpt85 -123.09 -23.3 4.97 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 126.44 1.896 . . . . 0.0 114.879 -177.075 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 6.5 t . . . . . 0 CA--C 1.543 0.709 0 CA-C-N 119.437 1.017 . . . . 0.0 112.895 -176.829 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 8.0 t . . . . . 0 CA--C 1.546 0.801 0 CA-C-O 121.482 0.658 . . . . 0.0 112.219 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 26.1 mtmt -90.12 4.08 51.46 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 124.42 1.088 . . . . 0.0 113.365 -179.297 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 85.3 m-85 -120.91 148.85 43.5 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 122.052 0.93 . . . . 0.0 112.375 -174.409 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -73.01 114.27 10.97 Favored 'General case' 0 N--CA 1.464 0.271 0 C-N-CA 123.896 0.878 . . . . 0.0 111.566 -176.879 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 13.2 m170 -71.37 114.61 29.34 Favored Pre-proline 0 CA--C 1.548 0.87 0 N-CA-C 107.382 -1.34 . . . . 0.0 107.382 174.557 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 65.9 Cg_exo -48.74 116.45 2.14 Favored 'Trans proline' 0 CA--C 1.542 0.921 0 C-N-CA 124.611 3.54 . . . . 0.0 116.975 -174.096 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -75.99 149.36 32.71 Favored 'Trans proline' 0 CA--C 1.545 1.044 0 C-N-CA 122.265 1.977 . . . . 0.0 110.518 174.937 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_exo -46.16 -41.04 21.79 Favored 'Trans proline' 0 CA--C 1.537 0.674 0 C-N-CA 124.068 3.179 . . . . 0.0 115.685 -179.789 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 13.8 t-80 -69.38 -17.28 63.66 Favored 'General case' 0 N--CA 1.474 0.765 0 N-CA-C 114.984 1.476 . . . . 0.0 114.984 179.761 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 93.2 mt -112.85 -16.95 12.63 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 124.367 1.067 . . . . 0.0 113.029 178.197 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 54.7 mtpt -54.56 -37.43 65.45 Favored 'General case' 0 N--CA 1.478 0.973 0 CA-C-N 119.791 1.178 . . . . 0.0 111.623 174.798 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 21.9 m -62.24 -41.76 98.72 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 123.731 0.812 . . . . 0.0 111.495 176.469 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 16.5 mm100 -69.67 -45.33 68.6 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 123.734 0.814 . . . . 0.0 110.898 178.324 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 89.4 mt -62.69 -46.2 89.25 Favored 'General case' 0 N--CA 1.466 0.345 0 C-N-CA 124.077 0.951 . . . . 0.0 112.423 178.738 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -64.91 -36.94 85.98 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-N 119.651 1.114 . . . . 0.0 112.28 178.97 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 63.7 mt -65.21 -45.43 93.82 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.707 0 CA-C-N 118.803 0.729 . . . . 0.0 110.064 176.176 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 24.5 m-80 -64.01 -38.82 92.48 Favored 'General case' 0 CA--C 1.54 0.587 0 O-C-N 121.627 -0.67 . . . . 0.0 111.456 176.645 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.907 0 C-N-CA 123.948 0.785 . . . . 0.0 111.959 177.977 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 1.8 p90 . . . . . 0 N--CA 1.474 0.73 0 N-CA-C 114.468 1.284 . . . . 0.0 114.468 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 88.4 mt -95.84 -18.19 20.56 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 125.688 1.595 . . . . 0.0 114.766 -175.849 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 2.5 m -75.44 77.35 2.49 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 124.454 1.102 . . . . 0.0 111.898 -178.604 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -75.86 144.63 41.1 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 127.178 2.191 . . . . 0.0 111.534 -179.822 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 11.5 mt-10 -73.57 151.11 41.03 Favored 'General case' 0 N--CA 1.472 0.668 0 O-C-N 120.563 -1.336 . . . . 0.0 111.402 176.014 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 12.3 m -82.82 145.88 7.85 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.789 0 N-CA-C 108.543 -0.91 . . . . 0.0 108.543 173.237 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 42.0 t -60.21 127.52 32.25 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-O 121.687 0.756 . . . . 0.0 111.213 179.643 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.439 ' H ' ' HD2' ' A' ' 20' ' ' ARG . 3.6 mpt_? -60.06 -31.69 70.23 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 124.976 1.311 . . . . 0.0 112.94 -176.585 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 28.9 mm-40 -81.44 -34.86 31.23 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 123.343 0.657 . . . . 0.0 110.777 177.782 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 51.3 t80 -63.99 -24.92 67.9 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 124.364 1.066 . . . . 0.0 111.383 173.942 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 80.7 mt-30 -58.86 -23.9 61.45 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 123.533 0.733 . . . . 0.0 112.919 176.003 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -117.24 13.06 14.56 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 125.508 1.523 . . . . 0.0 111.943 176.895 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 62.06 37.5 94.55 Favored Glycine 0 CA--C 1.533 1.204 0 C-N-CA 125.014 1.293 . . . . 0.0 113.986 -178.937 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 7.2 t -127.24 18.46 7.03 Favored 'General case' 0 N--CA 1.479 1.001 0 N-CA-C 114.688 1.366 . . . . 0.0 114.688 -176.28 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 14.5 t -67.32 172.04 5.26 Favored 'General case' 0 CA--C 1.558 1.279 0 O-C-N 121.572 -0.705 . . . . 0.0 110.319 172.733 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 90.4 p -132.26 8.48 4.33 Favored 'General case' 0 N--CA 1.477 0.897 0 N-CA-C 115.088 1.514 . . . . 0.0 115.088 -176.001 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 62.3 mtm-85 -133.23 146.84 62.64 Favored Pre-proline 0 N--CA 1.471 0.62 0 C-N-CA 125.557 1.543 . . . . 0.0 112.424 -178.098 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 77.6 Cg_endo -69.28 166.74 25.96 Favored 'Trans proline' 0 CA--C 1.543 0.963 0 C-N-CA 121.95 1.767 . . . . 0.0 109.61 171.352 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -53.9 -30.98 48.49 Favored 'General case' 0 N--CA 1.477 0.879 0 O-C-N 121.034 -1.041 . . . . 0.0 112.91 176.781 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 40.5 p -72.94 -6.52 45.79 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 125.93 1.692 . . . . 0.0 115.015 178.637 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 18.5 mt-10 -128.08 -24.17 3.2 Favored 'General case' 0 N--CA 1.477 0.907 0 N-CA-C 115.333 1.605 . . . . 0.0 115.333 -177.773 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 3.1 t -70.18 166.28 20.3 Favored 'General case' 0 CA--C 1.546 0.791 0 N-CA-C 114.979 1.474 . . . . 0.0 114.979 -176.556 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 13.2 mmmm -83.37 -11.42 57.64 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 127.057 2.143 . . . . 0.0 113.1 179.557 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 77.0 m-85 -140.43 173.79 11.16 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 126.417 1.887 . . . . 0.0 110.763 -178.125 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -80.17 152.94 28.93 Favored 'General case' 0 CA--C 1.545 0.778 0 O-C-N 121.224 -0.923 . . . . 0.0 113.224 -178.642 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 61.3 m170 -127.04 90.16 50.13 Favored Pre-proline 0 CA--C 1.552 1.039 0 C-N-CA 125.718 1.607 . . . . 0.0 110.307 179.398 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 33.9 Cg_endo -63.19 165.76 16.31 Favored 'Trans proline' 0 CA--C 1.541 0.85 0 C-N-CA 123.685 2.923 . . . . 0.0 114.903 -178.223 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 85.7 p -128.1 -174.22 3.15 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 126.385 1.874 . . . . 0.0 112.687 178.928 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 61.9 pttt -38.53 -37.51 0.32 Allowed 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 128.823 2.849 . . . . 0.0 117.902 -178.216 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 33.1 p -109.19 -16.4 14.09 Favored 'General case' 0 N--CA 1.476 0.842 0 N-CA-C 115.028 1.492 . . . . 0.0 115.028 -177.898 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 80.4 m -61.21 128.3 35.73 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 124.319 1.048 . . . . 0.0 113.33 -177.764 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 44.6 tt0 -81.71 128.96 34.53 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 125.329 1.452 . . . . 0.0 110.008 178.105 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 17.6 t -122.42 134.07 66.74 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.918 0 C-N-CA 125.489 1.515 . . . . 0.0 109.663 -178.226 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -142.92 130.83 21.64 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 125.142 1.377 . . . . 0.0 110.703 -179.576 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 46.1 36.14 2.95 Favored 'General case' 0 CA--C 1.555 1.148 0 C-N-CA 126.177 1.791 . . . . 0.0 115.169 179.47 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 80.54 19.41 68.62 Favored Glycine 0 CA--C 1.537 1.429 0 O-C-N 120.969 -1.082 . . . . 0.0 114.66 -179.592 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 45.3 mtt180 -137.14 161.25 36.66 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 125.901 1.68 . . . . 0.0 111.179 -179.292 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 3.0 m -138.17 137.75 43.96 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.512 0 C-N-CA 127.143 2.177 . . . . 0.0 109.647 -176.877 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 75.8 mt -87.67 131.04 36.37 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.743 0 O-C-N 121.083 -1.011 . . . . 0.0 109.294 179.273 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -73.84 149.27 41.71 Favored 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 123.91 0.884 . . . . 0.0 111.926 177.694 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 8.0 t -67.38 95.64 0.46 Allowed 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 125.19 1.396 . . . . 0.0 111.681 -177.909 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 22.2 p90 -58.16 -36.63 73.3 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 123.673 0.789 . . . . 0.0 111.176 177.817 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 73.1 m-20 -61.02 -34.89 75.55 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 123.099 0.56 . . . . 0.0 111.863 177.137 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 25.3 p -68.51 -41.61 79.74 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-N 119.019 0.827 . . . . 0.0 111.666 177.4 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 38.5 mt -71.5 -40.24 70.32 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 125.183 1.393 . . . . 0.0 113.187 178.165 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . 0.428 ' HA ' ' HE2' ' A' ' 58' ' ' LYS . 11.3 mmpt? -83.46 -10.23 58.5 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 124.794 1.238 . . . . 0.0 114.122 -179.21 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 82.02 39.19 11.88 Favored Glycine 0 CA--C 1.536 1.396 0 C-N-CA 124.319 0.961 . . . . 0.0 114.725 177.773 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 6.9 tpm_? -124.41 -9.78 7.47 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 126.186 1.794 . . . . 0.0 113.863 -178.272 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 CA--C 1.544 0.712 0 CA-C-N 119.22 0.918 . . . . 0.0 112.544 -177.349 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 38.9 m . . . . . 0 CA--C 1.54 0.592 0 N-CA-C 113.696 0.998 . . . . 0.0 113.696 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 24.6 mtmt -88.81 7.79 32.29 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 123.817 0.847 . . . . 0.0 111.682 173.375 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 63.7 m-85 -127.14 148.72 50.16 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 125.818 1.647 . . . . 0.0 111.641 -172.488 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -74.17 117.19 15.69 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 124.168 0.987 . . . . 0.0 113.06 -175.951 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 6.3 m170 -65.21 129.96 94.62 Favored Pre-proline 0 CA--C 1.547 0.835 0 N-CA-C 106.612 -1.625 . . . . 0.0 106.612 170.776 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 83.3 Cg_endo -72.11 120.6 6.91 Favored 'Trans proline' 0 CA--C 1.545 1.057 0 C-N-CA 122.562 2.175 . . . . 0.0 113.142 -172.338 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -75.66 150.85 35.92 Favored 'Trans proline' 0 CA--C 1.541 0.87 0 C-N-CA 122.884 2.39 . . . . 0.0 111.063 178.021 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 84.9 Cg_exo -47.23 -39.01 26.64 Favored 'Trans proline' 0 CA--C 1.537 0.668 0 C-N-CA 123.863 3.042 . . . . 0.0 115.257 179.592 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 7.5 t-80 -69.36 -17.72 63.72 Favored 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 115.057 1.503 . . . . 0.0 115.057 179.452 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 93.4 mt -114.55 -15.61 11.99 Favored 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 124.854 1.262 . . . . 0.0 112.953 178.224 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 57.0 mtpt -54.89 -35.4 64.07 Favored 'General case' 0 N--CA 1.477 0.876 0 CA-C-N 119.736 1.153 . . . . 0.0 111.149 173.591 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 15.3 m -63.3 -41.23 98.94 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 123.902 0.881 . . . . 0.0 111.699 175.917 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 91.0 mm-40 -70.4 -44.44 67.98 Favored 'General case' 0 N--CA 1.468 0.452 0 O-C-N 121.268 -0.895 . . . . 0.0 111.05 177.281 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 95.5 mt -62.5 -40.48 96.86 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 123.748 0.819 . . . . 0.0 111.529 177.629 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 8.2 mm-40 -52.02 -56.12 16.28 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 124.884 1.274 . . . . 0.0 110.639 174.331 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 72.9 mt -68.79 -45.66 80.62 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.25 0 C-N-CA 125.798 1.639 . . . . 0.0 111.977 -173.781 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 38.5 m-80 -64.25 -34.64 78.57 Favored 'General case' 0 CA--C 1.542 0.645 0 CA-C-N 119.069 0.85 . . . . 0.0 111.501 175.878 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.886 0 C-N-CA 123.684 0.659 . . . . 0.0 111.663 176.738 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.542 0.662 0 N-CA-C 113.376 0.88 . . . . 0.0 113.376 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 94.7 mt -91.93 -17.52 25.06 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 126.061 1.744 . . . . 0.0 114.762 -177.32 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 17.1 m -78.49 74.7 5.02 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 124.567 1.147 . . . . 0.0 111.534 -177.717 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.5 HD21 HD13 ' A' ' 75' ' ' LEU . 10.4 tp -75.8 147.63 39.05 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 127.399 2.28 . . . . 0.0 112.039 -178.647 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 9.5 mt-10 -73.46 150.84 41.35 Favored 'General case' 0 N--CA 1.473 0.684 0 O-C-N 120.54 -1.35 . . . . 0.0 113.095 179.351 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 17.9 m -82.67 153.25 3.93 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.768 0 C-N-CA 122.833 0.453 . . . . 0.0 111.212 175.201 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 48.2 t -74.29 135.43 42.6 Favored 'General case' 0 CA--C 1.539 0.526 0 N-CA-C 109.766 -0.457 . . . . 0.0 109.766 174.911 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 5.3 mpt_? -71.99 -41.21 67.93 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 125.203 1.401 . . . . 0.0 112.856 -177.087 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 17.1 mm-40 -72.69 -33.72 66.7 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 124.414 1.086 . . . . 0.0 111.773 179.969 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 83.5 t80 -62.18 -26.62 68.44 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 124.093 0.957 . . . . 0.0 111.759 175.29 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 77.4 mm-40 -60.61 -20.92 61.96 Favored 'General case' 0 N--CA 1.478 0.926 0 N-CA-C 113.637 0.977 . . . . 0.0 113.637 176.79 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -117.06 13.72 14.85 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 125.693 1.597 . . . . 0.0 112.106 177.083 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 59.14 36.8 90.2 Favored Glycine 0 CA--C 1.533 1.203 0 C-N-CA 125.092 1.329 . . . . 0.0 114.145 -179.78 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 7.2 t -127.54 13.18 7.0 Favored 'General case' 0 N--CA 1.479 1.01 0 N-CA-C 114.48 1.289 . . . . 0.0 114.48 -175.941 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 27.9 t -62.96 137.6 58.31 Favored 'General case' 0 CA--C 1.551 1.004 0 O-C-N 121.435 -0.79 . . . . 0.0 111.749 177.283 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 32.7 m -77.46 -2.99 38.14 Favored 'General case' 0 N--CA 1.475 0.814 0 N-CA-C 115.604 1.705 . . . . 0.0 115.604 -177.501 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 87.3 mtt180 -135.25 148.23 65.49 Favored Pre-proline 0 N--CA 1.475 0.797 0 C-N-CA 125.687 1.595 . . . . 0.0 112.561 -176.825 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -68.96 166.09 27.77 Favored 'Trans proline' 0 CA--C 1.543 0.959 0 C-N-CA 122.241 1.961 . . . . 0.0 110.132 173.348 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 7.4 p-10 -53.51 -28.66 32.34 Favored 'General case' 0 N--CA 1.475 0.792 0 N-CA-C 114.18 1.178 . . . . 0.0 114.18 178.817 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 12.6 p -77.94 -8.91 58.76 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 125.809 1.644 . . . . 0.0 115.02 178.452 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 39.5 mm-40 -124.9 -19.97 5.1 Favored 'General case' 0 N--CA 1.477 0.895 0 N-CA-C 116.315 1.968 . . . . 0.0 116.315 -172.908 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 4.7 t -69.73 170.13 11.53 Favored 'General case' 0 CA--C 1.551 1.011 0 N-CA-C 114.988 1.477 . . . . 0.0 114.988 -177.05 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -89.15 -6.99 56.56 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 127.877 2.471 . . . . 0.0 113.785 -179.762 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 56.2 m-85 -140.41 169.73 17.12 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 126.23 1.812 . . . . 0.0 110.507 178.328 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -78.61 145.93 34.43 Favored 'General case' 0 CA--C 1.548 0.866 0 O-C-N 121.12 -0.987 . . . . 0.0 113.3 -176.753 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 21.4 m170 -120.38 89.23 43.56 Favored Pre-proline 0 CA--C 1.555 1.141 0 C-N-CA 126.047 1.739 . . . . 0.0 110.535 -178.386 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -67.2 173.24 8.84 Favored 'Trans proline' 0 CA--C 1.542 0.924 0 C-N-CA 123.789 2.993 . . . . 0.0 114.943 -178.651 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 73.8 p -129.28 -178.9 4.85 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 126.089 1.756 . . . . 0.0 111.234 175.212 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 29.9 mtpp -49.89 -31.73 12.86 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 126.42 1.888 . . . . 0.0 115.203 -179.884 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 17.5 m -92.76 -25.63 18.09 Favored 'General case' 0 N--CA 1.477 0.913 0 N-CA-C 114.324 1.231 . . . . 0.0 114.324 -178.619 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 59.2 m -63.16 143.06 58.12 Favored 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 114.615 1.339 . . . . 0.0 114.615 -176.793 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 22.2 mt-30 -85.04 132.33 34.34 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 124.944 1.298 . . . . 0.0 110.844 176.689 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 12.8 t -129.11 135.28 62.36 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.731 0 C-N-CA 124.919 1.288 . . . . 0.0 110.677 -178.454 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -146.31 131.88 18.79 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 125.057 1.343 . . . . 0.0 111.234 178.218 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 63.0 t30 41.98 37.71 0.89 Allowed 'General case' 0 CA--C 1.553 1.076 0 C-N-CA 126.835 2.054 . . . . 0.0 116.379 177.405 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 85.78 16.17 64.1 Favored Glycine 0 CA--C 1.536 1.386 0 O-C-N 120.944 -1.098 . . . . 0.0 114.987 -179.751 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 66.5 mtt180 -136.02 161.15 36.47 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 125.6 1.56 . . . . 0.0 111.388 -179.633 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 3.1 m -139.21 144.24 29.64 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.62 0 C-N-CA 127.433 2.293 . . . . 0.0 109.562 -176.965 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 8.7 mt -94.81 126.72 47.18 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.764 0 O-C-N 121.385 -0.822 . . . . 0.0 110.811 -176.746 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -71.15 147.53 48.27 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 124.311 1.045 . . . . 0.0 112.032 178.186 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 23.7 t -70.27 99.87 1.61 Allowed 'General case' 0 C--O 1.24 0.563 0 C-N-CA 125.06 1.344 . . . . 0.0 112.301 -177.894 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 41.0 p90 -61.68 -38.18 86.84 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 115.413 -0.812 . . . . 0.0 110.316 175.531 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 62.2 m-20 -60.72 -44.33 96.77 Favored 'General case' 0 CA--C 1.539 0.545 0 O-C-N 121.856 -0.527 . . . . 0.0 110.444 176.402 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 37.7 t -64.48 -42.91 95.59 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 119.761 1.164 . . . . 0.0 111.447 177.51 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 30.7 mt -62.13 -40.46 96.0 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 124.179 0.992 . . . . 0.0 113.049 176.625 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 31.2 mmmt -83.19 -9.46 59.15 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 124.99 1.316 . . . . 0.0 113.856 179.266 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 81.82 38.36 14.04 Favored Glycine 0 CA--C 1.536 1.402 0 C-N-CA 124.642 1.115 . . . . 0.0 114.269 179.281 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 19.7 tpp180 -120.46 -22.4 6.47 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 126.568 1.947 . . . . 0.0 114.67 -176.893 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 5.4 t . . . . . 0 CA--C 1.546 0.789 0 CA-C-N 119.277 0.944 . . . . 0.0 113.372 -177.391 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 7.0 t . . . . . 0 CA--C 1.544 0.734 0 CA-C-O 121.691 0.758 . . . . 0.0 112.276 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 32.2 mtmt -84.8 8.15 18.26 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 124.742 1.217 . . . . 0.0 114.137 -176.971 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 89.0 m-85 -128.61 157.74 40.43 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 125.696 1.598 . . . . 0.0 111.488 -177.066 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -79.5 114.02 18.11 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 124.122 0.969 . . . . 0.0 112.289 -177.015 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 10.4 m170 -68.62 119.17 66.97 Favored Pre-proline 0 CA--C 1.545 0.764 0 N-CA-C 105.7 -1.963 . . . . 0.0 105.7 170.966 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -71.46 128.86 14.99 Favored 'Trans proline' 0 CA--C 1.542 0.906 0 C-N-CA 121.865 1.71 . . . . 0.0 114.556 -169.906 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 97.6 Cg_endo -78.69 155.22 27.3 Favored 'Trans proline' 0 CA--C 1.543 0.929 0 C-N-CA 123.403 2.735 . . . . 0.0 112.116 178.751 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 82.9 Cg_exo -45.97 -39.81 19.91 Favored 'Trans proline' 0 CA--C 1.54 0.782 0 C-N-CA 124.454 3.436 . . . . 0.0 115.976 179.385 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 18.3 m-70 -71.48 -15.71 62.33 Favored 'General case' 0 N--CA 1.477 0.89 0 N-CA-C 114.965 1.468 . . . . 0.0 114.965 179.356 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.5 HD13 HD21 ' A' ' 16' ' ' LEU . 78.6 mt -115.36 -18.06 11.13 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 124.468 1.107 . . . . 0.0 113.109 -179.776 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 59.2 mtpt -54.56 -38.23 66.41 Favored 'General case' 0 N--CA 1.476 0.849 0 CA-C-N 119.661 1.119 . . . . 0.0 111.328 173.872 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 25.0 m -62.58 -42.66 99.69 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 124.115 0.966 . . . . 0.0 111.673 176.235 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 89.4 mm-40 -67.25 -44.58 79.05 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 123.739 0.815 . . . . 0.0 110.807 178.323 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 93.2 mt -62.24 -46.54 88.41 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 123.992 0.917 . . . . 0.0 112.341 178.417 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -65.14 -30.48 71.41 Favored 'General case' 0 N--CA 1.476 0.838 0 CA-C-N 120.044 1.293 . . . . 0.0 113.191 178.863 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 64.1 mt -71.73 -43.49 70.04 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.757 0 O-C-N 121.367 -0.833 . . . . 0.0 109.583 175.744 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 22.8 m-80 -64.96 -33.72 76.7 Favored 'General case' 0 CA--C 1.542 0.654 0 O-C-N 121.683 -0.636 . . . . 0.0 111.289 174.826 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.848 0 C-N-CA 124.518 1.056 . . . . 0.0 111.414 177.193 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 74.9 mtm . . . . . 0 CA--C 1.538 0.49 0 N-CA-C 113.67 0.989 . . . . 0.0 113.67 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -49.48 -22.73 1.29 Allowed 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 127.397 2.279 . . . . 0.0 116.449 -178.582 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 31.2 m -133.76 19.67 1.32 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.875 0 C-N-CA 125.841 1.656 . . . . 0.0 112.635 -178.547 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 72.7 p -149.42 -22.25 0.28 Allowed 'General case' 0 N--CA 1.477 0.883 0 N-CA-C 116.527 2.047 . . . . 0.0 116.527 -177.572 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 19.2 t -139.39 -32.15 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.236 0 CA-C-N 119.816 1.189 . . . . 0.0 113.255 -178.865 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 22.9 p -129.81 107.26 16.86 Favored Pre-proline 0 N--CA 1.478 0.949 0 C-N-CA 124.714 1.206 . . . . 0.0 111.939 -178.367 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 83.0 Cg_endo -74.36 -13.28 23.0 Favored 'Trans proline' 0 CA--C 1.539 0.762 0 C-N-CA 123.144 2.562 . . . . 0.0 114.592 -178.659 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 18.1 tt -75.41 41.67 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.554 1.128 0 C-N-CA 127.453 2.301 . . . . 0.0 112.428 178.152 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 19.0 ptt-85 -62.21 -16.32 52.51 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 126.341 1.856 . . . . 0.0 115.732 -178.905 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 1.4 p30 -150.98 172.76 15.19 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 124.965 1.306 . . . . 0.0 112.681 178.13 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 29.6 p -135.49 30.79 3.17 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 126.588 1.955 . . . . 0.0 111.613 -178.798 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 8.7 ptpp? -47.37 -32.58 5.03 Favored 'General case' 0 N--CA 1.482 1.162 0 N-CA-C 116.208 1.929 . . . . 0.0 116.208 -175.4 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -94.27 -20.72 19.54 Favored 'General case' 0 CA--C 1.541 0.624 0 N-CA-C 113.936 1.087 . . . . 0.0 113.936 -178.876 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 81.8 mt -95.06 -22.25 18.03 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 125.894 1.677 . . . . 0.0 114.344 -177.174 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 4.6 m -73.53 74.67 1.46 Allowed 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 125.035 1.334 . . . . 0.0 111.206 -179.238 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.545 HD21 HD13 ' A' ' 75' ' ' LEU . 8.5 tp -75.65 142.66 42.53 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 127.234 2.213 . . . . 0.0 111.64 -177.62 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 12.8 mt-10 -72.17 152.15 42.46 Favored 'General case' 0 N--CA 1.47 0.548 0 O-C-N 120.684 -1.26 . . . . 0.0 112.796 179.613 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 14.9 m -84.01 153.44 3.72 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.811 0 C-N-CA 122.737 0.415 . . . . 0.0 110.483 175.093 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 34.9 t -73.48 134.01 43.79 Favored 'General case' 0 CA--C 1.539 0.528 0 N-CA-C 109.724 -0.472 . . . . 0.0 109.724 175.77 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 5.7 mpt_? -68.99 -43.18 75.39 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 124.898 1.279 . . . . 0.0 112.675 -176.958 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 12.8 mm-40 -70.41 -34.49 72.58 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 124.461 1.105 . . . . 0.0 111.947 -179.549 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 78.3 t80 -61.92 -27.0 68.51 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 124.145 0.978 . . . . 0.0 111.753 175.553 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 71.7 mm-40 -61.86 -21.5 64.72 Favored 'General case' 0 N--CA 1.478 0.93 0 N-CA-C 113.734 1.013 . . . . 0.0 113.734 177.185 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -118.62 13.66 13.41 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 125.521 1.528 . . . . 0.0 112.054 177.375 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 59.83 37.11 92.03 Favored Glycine 0 CA--C 1.533 1.165 0 C-N-CA 124.821 1.2 . . . . 0.0 113.933 -179.207 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 6.1 t -124.93 16.26 8.57 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 124.563 1.145 . . . . 0.0 113.66 -176.446 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 12.4 t -66.0 169.96 6.15 Favored 'General case' 0 CA--C 1.558 1.26 0 C-N-CA 124.245 1.018 . . . . 0.0 111.048 173.978 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 94.5 p -128.82 4.01 5.42 Favored 'General case' 0 N--CA 1.477 0.918 0 N-CA-C 115.673 1.731 . . . . 0.0 115.673 -175.646 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 53.1 mtt-85 -133.39 147.29 64.26 Favored Pre-proline 0 N--CA 1.474 0.744 0 C-N-CA 126.12 1.768 . . . . 0.0 111.027 179.403 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 93.5 Cg_endo -72.64 167.73 26.35 Favored 'Trans proline' 0 CA--C 1.541 0.836 0 C-N-CA 122.251 1.968 . . . . 0.0 109.929 175.42 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -53.91 -30.12 44.89 Favored 'General case' 0 N--CA 1.474 0.766 0 O-C-N 121.32 -0.863 . . . . 0.0 112.936 176.329 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 28.1 p -73.95 -10.21 59.41 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 125.536 1.534 . . . . 0.0 115.059 178.427 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -135.25 -13.4 2.08 Favored 'General case' 0 N--CA 1.478 0.952 0 N-CA-C 116.818 2.155 . . . . 0.0 116.818 -176.132 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 5.1 t -70.62 162.3 29.18 Favored 'General case' 0 CA--C 1.552 1.024 0 CA-C-N 120.553 1.524 . . . . 0.0 113.709 -178.969 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -77.01 -12.19 59.9 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 126.78 2.032 . . . . 0.0 114.106 -179.814 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 62.0 m-85 -137.92 172.87 12.3 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 126.191 1.797 . . . . 0.0 110.571 179.287 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -80.67 149.94 29.58 Favored 'General case' 0 CA--C 1.549 0.915 0 O-C-N 121.147 -0.97 . . . . 0.0 113.097 -177.311 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 65.3 m170 -124.81 89.9 51.78 Favored Pre-proline 0 CA--C 1.552 1.021 0 C-N-CA 125.828 1.651 . . . . 0.0 111.243 -179.097 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 31.1 Cg_endo -62.08 143.05 94.38 Favored 'Trans proline' 0 CA--C 1.542 0.907 0 C-N-CA 123.11 2.54 . . . . 0.0 112.729 179.542 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 45.8 p -80.13 -84.94 0.09 Allowed 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 124.799 1.24 . . . . 0.0 113.678 -178.732 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 35.7 mtmm -144.49 -55.87 0.35 Allowed 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 126.979 2.112 . . . . 0.0 111.579 -179.054 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 35.3 m -76.27 -17.95 59.22 Favored 'General case' 0 N--CA 1.477 0.914 0 N-CA-C 113.234 0.828 . . . . 0.0 113.234 178.184 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 73.9 m -57.34 124.19 18.02 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 124.801 1.24 . . . . 0.0 112.341 179.942 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 56.8 tt0 -87.67 134.85 33.58 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 124.869 1.267 . . . . 0.0 110.566 179.169 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 1.6 m -124.3 148.32 28.57 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.599 0 C-N-CA 125.315 1.446 . . . . 0.0 110.937 179.85 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 70.9 mm-40 -141.32 133.57 28.02 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 125.302 1.441 . . . . 0.0 110.152 179.312 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 63.1 t30 44.23 35.8 1.36 Allowed 'General case' 0 CA--C 1.555 1.144 0 N-CA-C 116.002 1.853 . . . . 0.0 116.002 177.963 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 83.9 20.14 60.06 Favored Glycine 0 CA--C 1.538 1.512 0 O-C-N 120.914 -1.116 . . . . 0.0 114.823 -179.246 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 43.1 mtt180 -139.34 163.46 32.43 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 125.703 1.601 . . . . 0.0 111.843 -178.69 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 2.9 m -137.29 135.13 47.27 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.692 0 C-N-CA 126.942 2.097 . . . . 0.0 110.276 -177.719 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 78.4 mt -83.9 125.85 40.18 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.546 0 O-C-N 121.541 -0.724 . . . . 0.0 109.855 -179.202 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -70.72 143.66 51.21 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 123.8 0.84 . . . . 0.0 110.447 176.358 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 17.2 t -65.08 98.86 0.32 Allowed 'General case' 0 C--O 1.239 0.536 0 C-N-CA 124.494 1.117 . . . . 0.0 113.091 -176.921 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 33.4 p90 -62.37 -37.36 85.42 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 115.188 -0.915 . . . . 0.0 109.971 175.391 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 70.7 m-20 -61.46 -43.61 98.56 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 118.522 0.601 . . . . 0.0 110.394 176.339 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 40.2 t -64.88 -43.32 93.3 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 119.773 1.169 . . . . 0.0 111.488 177.336 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 25.8 mt -64.64 -42.73 95.26 Favored 'General case' 0 CA--C 1.543 0.699 0 N-CA-C 113.555 0.946 . . . . 0.0 113.555 177.246 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 31.0 mmmt -80.59 -18.63 47.68 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 124.713 1.205 . . . . 0.0 113.836 -179.427 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 96.21 41.32 3.76 Favored Glycine 0 CA--C 1.537 1.454 0 C-N-CA 124.582 1.087 . . . . 0.0 114.943 177.911 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 50.5 tpt85 -126.75 -22.3 3.91 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 126.247 1.819 . . . . 0.0 115.213 -177.343 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 5.0 t -65.13 141.9 58.54 Favored 'General case' 0 CA--C 1.545 0.775 0 CA-C-N 119.997 1.271 . . . . 0.0 113.714 -175.737 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 80.4 p -152.65 8.83 0.45 Allowed 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 126.798 2.039 . . . . 0.0 113.177 -179.892 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 77.7 mtm-85 -69.93 162.99 26.98 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 126.2 1.8 . . . . 0.0 113.861 -178.641 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -119.39 -1.77 10.7 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 125.845 1.658 . . . . 0.0 112.312 176.181 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 16.3 m120 -143.35 36.75 1.35 Allowed 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 128.058 2.543 . . . . 0.0 109.973 179.305 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 9.1 t -52.54 126.54 19.86 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 125.217 1.407 . . . . 0.0 111.409 -178.442 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 23.6 mtmt -82.43 1.03 39.43 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 123.922 0.889 . . . . 0.0 113.242 -178.645 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 76.4 m-85 -120.37 150.01 41.43 Favored 'General case' 0 C--N 1.326 -0.429 0 C-N-CA 124.581 1.152 . . . . 0.0 111.611 -174.413 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -75.09 111.66 10.54 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 123.411 0.685 . . . . 0.0 111.99 -176.323 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 11.5 m170 -65.26 119.83 62.49 Favored Pre-proline 0 CA--C 1.545 0.787 0 N-CA-C 105.212 -2.144 . . . . 0.0 105.212 171.413 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -69.06 125.18 12.18 Favored 'Trans proline' 0 CA--C 1.543 0.94 0 C-N-CA 122.028 1.819 . . . . 0.0 114.528 -169.803 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 90.3 Cg_endo -78.02 154.87 29.7 Favored 'Trans proline' 0 CA--C 1.542 0.882 0 C-N-CA 123.403 2.735 . . . . 0.0 111.734 178.851 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 81.2 Cg_exo -47.47 -41.74 29.09 Favored 'Trans proline' 0 CA--C 1.538 0.723 0 C-N-CA 123.905 3.07 . . . . 0.0 115.176 179.287 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 6.4 t60 -65.35 -22.82 66.86 Favored 'General case' 0 N--CA 1.476 0.843 0 N-CA-C 114.437 1.273 . . . . 0.0 114.437 179.267 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.545 HD13 HD21 ' A' ' 16' ' ' LEU . 67.7 mt -111.11 -17.89 13.13 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 124.332 1.053 . . . . 0.0 113.027 -179.608 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 25.5 mtpp -55.96 -38.55 70.51 Favored 'General case' 0 N--CA 1.475 0.816 0 CA-C-N 120.144 1.338 . . . . 0.0 110.882 173.678 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 24.0 m -59.27 -43.3 92.51 Favored 'General case' 0 N--CA 1.474 0.734 0 CA-C-N 118.621 0.646 . . . . 0.0 110.933 176.62 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 17.4 mm100 -67.71 -47.88 68.1 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 123.537 0.735 . . . . 0.0 111.101 177.647 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 88.4 mt -60.76 -40.82 93.93 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 124.168 0.987 . . . . 0.0 112.618 178.462 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -55.34 -52.75 62.49 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 124.416 1.087 . . . . 0.0 110.6 175.226 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 73.3 mt -69.61 -37.94 75.45 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.436 0 C-N-CA 125.81 1.644 . . . . 0.0 111.386 -176.27 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 93.1 m-20 -63.82 -40.64 97.09 Favored 'General case' 0 CA--C 1.543 0.675 0 O-C-N 121.586 -0.696 . . . . 0.0 110.372 173.87 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -67.27 -48.68 57.28 Favored Glycine 0 CA--C 1.529 0.918 0 C-N-CA 124.139 0.876 . . . . 0.0 111.679 177.657 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 71.5 mtp180 -54.8 -31.56 59.16 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 124.709 1.204 . . . . 0.0 112.716 176.517 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 54.7 t30 -70.08 -9.18 54.59 Favored 'General case' 0 CA--C 1.552 1.045 0 N-CA-C 114.085 1.143 . . . . 0.0 114.085 176.891 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 11.1 t-20 -130.73 -34.73 1.5 Allowed 'General case' 0 CA--C 1.543 0.686 0 N-CA-C 114.628 1.344 . . . . 0.0 114.628 -179.331 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 8.2 mp -57.91 -22.15 47.06 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 124.534 1.134 . . . . 0.0 113.567 178.339 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 32.1 pt -66.17 -9.23 8.25 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 C-N-CA 126.481 1.912 . . . . 0.0 114.451 176.534 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 37.0 tt0 -141.17 133.29 27.87 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 124.546 1.139 . . . . 0.0 111.725 -179.422 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -154.27 152.67 30.57 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 125.395 1.478 . . . . 0.0 110.578 178.921 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 55.7 tptt -137.11 -22.34 1.18 Allowed 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 125.764 1.625 . . . . 0.0 113.754 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 34.0 t-20 . . . . . 0 CA--C 1.542 0.657 0 C-N-CA 124.985 1.314 . . . . 0.0 111.109 179.423 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.5 ptt? . . . . . 0 CA--C 1.544 0.748 0 N-CA-C 114.068 1.136 . . . . 0.0 114.068 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -151.37 166.64 30.38 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 125.921 1.689 . . . . 0.0 111.929 -179.996 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 35.8 m -128.75 -0.3 3.12 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.245 0 C-N-CA 125.194 1.398 . . . . 0.0 114.033 -179.475 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 11.8 t -155.82 163.48 39.76 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 125.718 1.607 . . . . 0.0 110.95 178.29 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 8.8 p -154.08 -23.52 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.48 1.047 0 C-N-CA 124.987 1.315 . . . . 0.0 113.926 -179.687 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 36.4 p -66.41 149.08 98.3 Favored Pre-proline 0 N--CA 1.476 0.831 0 N-CA-C 113.984 1.105 . . . . 0.0 113.984 -179.003 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 64.3 Cg_endo -75.94 -177.46 3.65 Favored 'Trans proline' 0 CA--C 1.546 1.114 0 C-N-CA 123.554 2.836 . . . . 0.0 110.774 174.314 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 9.6 tp -57.32 152.81 2.7 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.861 0 C-N-CA 124.387 1.075 . . . . 0.0 111.635 176.171 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 1.9 mpt_? -126.32 151.5 47.46 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 124.786 1.234 . . . . 0.0 112.386 -178.418 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -80.71 -7.62 59.4 Favored 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 124.813 1.245 . . . . 0.0 112.853 176.92 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 44.8 p -67.62 8.92 0.3 Allowed 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 127.774 2.43 . . . . 0.0 115.662 -179.155 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 38.1 ttpt -46.32 -42.7 15.07 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 125.695 1.598 . . . . 0.0 114.157 -179.175 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -77.22 -21.67 53.48 Favored 'General case' 0 N--CA 1.474 0.734 0 N-CA-C 113.865 1.061 . . . . 0.0 113.865 179.011 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 78.3 mt -95.53 -18.69 20.42 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 126.489 1.916 . . . . 0.0 114.199 -178.328 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 7.2 m -78.41 79.4 4.85 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 125.082 1.353 . . . . 0.0 110.762 -178.138 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -76.55 144.4 39.71 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 128.196 2.598 . . . . 0.0 111.075 -177.569 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 9.2 mt-10 -73.74 150.83 40.89 Favored 'General case' 0 N--CA 1.472 0.665 0 O-C-N 120.788 -1.195 . . . . 0.0 111.659 175.789 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 16.3 m -81.14 149.05 5.09 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.783 0 N-CA-C 109.404 -0.591 . . . . 0.0 109.404 173.568 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 42.4 t -63.9 126.86 29.02 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-O 121.98 0.895 . . . . 0.0 111.244 179.08 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 3.3 mpt_? -63.7 -26.02 68.47 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 124.743 1.217 . . . . 0.0 113.151 -177.317 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 13.9 mm-40 -82.8 -37.77 24.04 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-O 121.136 0.493 . . . . 0.0 109.785 177.017 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 61.2 t80 -62.67 -30.37 71.33 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 124.759 1.224 . . . . 0.0 111.076 174.677 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 79.5 mt-30 -59.48 -21.41 60.07 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.667 0.787 . . . . 0.0 112.869 175.088 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 3.5 mpt_? -118.33 14.47 13.82 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 126.171 1.788 . . . . 0.0 111.842 178.009 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 58.48 36.38 84.29 Favored Glycine 0 CA--C 1.534 1.251 0 C-N-CA 125.225 1.393 . . . . 0.0 114.194 -179.992 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 6.7 t -128.49 16.63 6.5 Favored 'General case' 0 N--CA 1.476 0.87 0 N-CA-C 114.727 1.38 . . . . 0.0 114.727 -175.85 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 10.2 t -68.06 172.05 6.12 Favored 'General case' 0 CA--C 1.559 1.289 0 O-C-N 121.542 -0.724 . . . . 0.0 110.487 173.104 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 51.1 m -133.98 11.88 3.95 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 125.332 1.453 . . . . 0.0 114.764 -176.114 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 70.2 mtm-85 -134.85 146.38 58.56 Favored Pre-proline 0 N--CA 1.476 0.843 0 C-N-CA 125.281 1.433 . . . . 0.0 112.625 -176.906 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -68.68 166.15 27.04 Favored 'Trans proline' 0 CA--C 1.542 0.885 0 C-N-CA 122.154 1.903 . . . . 0.0 109.96 172.457 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 -54.24 -27.75 36.8 Favored 'General case' 0 N--CA 1.474 0.764 0 N-CA-C 113.725 1.009 . . . . 0.0 113.725 177.762 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 11.7 p -76.82 -11.88 59.89 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 125.491 1.516 . . . . 0.0 114.953 178.588 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 51.2 mm-40 -119.59 -27.26 5.55 Favored 'General case' 0 N--CA 1.476 0.869 0 N-CA-C 116.063 1.875 . . . . 0.0 116.063 -174.468 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 3.3 t -67.93 163.77 21.34 Favored 'General case' 0 CA--C 1.548 0.872 0 N-CA-C 115.773 1.768 . . . . 0.0 115.773 -175.033 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.61 -11.94 59.99 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 127.881 2.472 . . . . 0.0 112.659 -179.989 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 75.6 m-85 -143.07 172.99 11.96 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 126.711 2.004 . . . . 0.0 110.138 179.957 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -79.32 152.56 30.41 Favored 'General case' 0 CA--C 1.547 0.848 0 N-CA-C 114.291 1.219 . . . . 0.0 114.291 -177.787 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 63.3 m170 -126.43 89.6 51.84 Favored Pre-proline 0 CA--C 1.551 0.99 0 C-N-CA 126.138 1.775 . . . . 0.0 109.637 178.21 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 33.6 Cg_endo -63.48 148.08 92.8 Favored 'Trans proline' 0 CA--C 1.539 0.775 0 C-N-CA 123.052 2.501 . . . . 0.0 114.648 -177.367 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 58.2 p -87.29 -173.47 4.41 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 125.445 1.498 . . . . 0.0 112.245 176.061 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 67.9 mttm -62.42 -19.38 63.41 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 125.704 1.602 . . . . 0.0 113.478 173.828 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 61.1 p -109.11 -24.04 11.36 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 125.062 1.345 . . . . 0.0 114.326 -179.965 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 82.6 m -60.98 129.13 39.85 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-N 119.329 0.968 . . . . 0.0 112.902 179.839 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 67.1 tp60 -81.41 135.1 35.64 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 124.171 0.988 . . . . 0.0 110.411 177.628 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 15.0 t -117.48 144.68 24.73 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.819 0 C-N-CA 125.693 1.597 . . . . 0.0 109.299 -179.823 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 50.3 mt-10 -146.16 124.43 12.26 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 125.698 1.599 . . . . 0.0 110.404 179.5 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 62.9 t30 43.64 36.94 1.35 Allowed 'General case' 0 CA--C 1.554 1.133 0 N-CA-C 116.357 1.984 . . . . 0.0 116.357 178.043 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 86.49 16.96 61.17 Favored Glycine 0 CA--C 1.537 1.457 0 O-C-N 120.929 -1.107 . . . . 0.0 114.875 -179.873 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 62.8 mtt180 -138.24 163.73 31.01 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 126.373 1.869 . . . . 0.0 110.807 -179.536 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 5.1 m -139.63 144.2 29.12 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.506 0 C-N-CA 126.994 2.118 . . . . 0.0 109.323 -177.918 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 60.4 mt -94.06 132.82 37.1 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.729 0 O-C-N 121.146 -0.971 . . . . 0.0 110.112 -177.925 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -74.43 148.99 40.64 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 124.156 0.982 . . . . 0.0 112.465 178.344 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 7.8 t -69.2 95.72 0.78 Allowed 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 125.025 1.33 . . . . 0.0 109.981 179.531 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 27.2 p90 -58.01 -36.32 72.51 Favored 'General case' 0 N--CA 1.467 0.385 0 C-N-CA 123.439 0.695 . . . . 0.0 111.417 179.373 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 74.5 m-20 -58.5 -36.23 73.46 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.439 0.696 . . . . 0.0 111.447 177.144 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 47.7 t -70.87 -38.22 73.09 Favored 'General case' 0 CA--C 1.54 0.583 0 O-C-N 121.149 -0.969 . . . . 0.0 111.642 178.251 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 50.0 mt -69.26 -42.66 75.29 Favored 'General case' 0 N--CA 1.474 0.732 0 O-C-N 121.316 -0.865 . . . . 0.0 112.352 175.205 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 31.3 mmmt -75.56 -9.94 59.02 Favored 'General case' 0 N--CA 1.478 0.925 0 C-N-CA 125.038 1.335 . . . . 0.0 113.844 -179.992 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 78.44 37.06 28.55 Favored Glycine 0 CA--C 1.536 1.346 0 C-N-CA 124.414 1.007 . . . . 0.0 113.82 179.519 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 51.1 ttp180 -119.86 -22.55 6.74 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 126.852 2.061 . . . . 0.0 114.256 -177.016 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 3.7 t -68.38 140.49 55.84 Favored 'General case' 0 CA--C 1.545 0.771 0 CA-C-O 122.245 1.021 . . . . 0.0 113.604 -177.639 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 82.0 p -150.1 9.21 0.66 Allowed 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 128.088 2.555 . . . . 0.0 111.526 177.131 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 27.8 ttm105 -76.57 164.66 25.71 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 128.732 2.813 . . . . 0.0 111.892 -178.833 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -133.04 10.63 4.21 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 124.736 1.215 . . . . 0.0 113.36 -179.632 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 37.4 p-10 -144.38 30.09 1.26 Allowed 'General case' 0 CA--C 1.549 0.906 0 C-N-CA 125.579 1.551 . . . . 0.0 113.483 -178.463 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 86.2 m -49.88 143.67 7.42 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 124.842 1.257 . . . . 0.0 113.684 -179.246 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 43.0 mtmt -93.42 9.15 37.67 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 124.698 1.199 . . . . 0.0 111.16 173.188 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 70.1 m-85 -129.91 149.27 51.71 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 126.797 2.039 . . . . 0.0 111.351 -173.602 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -74.74 117.1 16.19 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 124.312 1.045 . . . . 0.0 112.901 -176.046 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 1.8 m-70 -67.67 121.58 79.91 Favored Pre-proline 0 CA--C 1.544 0.726 0 CA-C-O 118.194 -0.908 . . . . 0.0 108.829 173.994 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 67.6 Cg_exo -45.68 107.7 0.12 Allowed 'Trans proline' 0 CA--C 1.543 0.969 0 C-N-CA 124.894 3.729 . . . . 0.0 115.392 -178.649 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 98.4 Cg_endo -76.34 155.25 36.79 Favored 'Trans proline' 0 CA--C 1.541 0.857 0 C-N-CA 121.515 1.476 . . . . 0.0 110.606 176.362 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_endo -56.19 -29.68 76.57 Favored 'Trans proline' 0 CA--C 1.54 0.816 0 C-N-CA 123.169 2.579 . . . . 0.0 114.839 -177.664 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 11.8 m-70 -80.15 -14.44 58.47 Favored 'General case' 0 N--CA 1.476 0.853 0 N-CA-C 114.598 1.333 . . . . 0.0 114.598 177.238 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 73.6 mt -116.18 -15.84 11.04 Favored 'General case' 0 N--CA 1.476 0.833 0 CA-C-N 119.394 0.997 . . . . 0.0 113.353 179.63 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 67.2 mttt -52.5 -37.43 57.37 Favored 'General case' 0 N--CA 1.476 0.873 0 CA-C-N 119.76 1.163 . . . . 0.0 111.186 173.273 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 19.4 m -63.37 -44.25 95.29 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 123.722 0.809 . . . . 0.0 111.21 176.431 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 18.5 mm100 -67.93 -42.93 80.28 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 124.067 0.947 . . . . 0.0 111.546 178.636 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 80.5 mt -61.47 -47.59 84.96 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 123.846 0.858 . . . . 0.0 110.996 177.284 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 3.8 pt-20 -64.54 -37.2 86.74 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 119.651 1.114 . . . . 0.0 112.232 177.615 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 60.7 mt -62.9 -46.66 95.78 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.691 0 CA-C-N 119.395 0.998 . . . . 0.0 110.051 177.216 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 16.1 t-20 -63.35 -41.01 98.83 Favored 'General case' 0 CA--C 1.545 0.767 0 CA-C-N 118.598 0.635 . . . . 0.0 111.091 177.585 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -62.7 -48.51 80.79 Favored Glycine 0 CA--C 1.534 1.258 0 O-C-N 121.421 -0.799 . . . . 0.0 111.924 176.942 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 61.0 mtp180 -58.69 -43.71 90.05 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 125.281 1.432 . . . . 0.0 111.069 176.352 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 57.2 t30 -61.54 -5.15 1.64 Allowed 'General case' 0 CA--C 1.552 1.052 0 C-N-CA 125.572 1.549 . . . . 0.0 114.15 175.65 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 62.2 m-80 -125.24 10.9 8.09 Favored 'General case' 0 CA--C 1.552 1.057 0 C-N-CA 126.517 1.927 . . . . 0.0 112.013 177.176 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 49.1 tp -122.56 -22.35 5.45 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 126.944 2.098 . . . . 0.0 112.315 179.069 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 3.1 pt -37.62 100.79 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.478 0.957 0 C-N-CA 129.032 2.933 . . . . 0.0 114.204 176.218 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 85.4 mt-30 -63.3 -16.03 59.09 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 124.888 1.275 . . . . 0.0 113.447 179.316 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 23.5 mp0 -56.81 -27.04 59.31 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 125.937 1.695 . . . . 0.0 112.652 177.5 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 59.6 mtpt -70.51 -19.84 62.88 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 124.825 1.25 . . . . 0.0 113.36 176.807 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 35.0 p30 . . . . . 0 CA--C 1.54 0.593 0 C-N-CA 125.849 1.66 . . . . 0.0 111.211 -179.815 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.1 ptp . . . . . 0 CA--C 1.545 0.751 0 N-CA-C 114.058 1.132 . . . . 0.0 114.058 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -148.72 166.1 29.4 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 125.768 1.627 . . . . 0.0 112.177 -179.872 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 29.9 m -140.34 165.87 20.42 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.027 0 C-N-CA 126.163 1.785 . . . . 0.0 111.467 179.669 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 63.2 m -138.92 160.45 39.72 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 125.273 1.429 . . . . 0.0 112.047 -179.445 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 40.3 t -64.08 145.1 14.05 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.976 0 C-N-CA 124.835 1.254 . . . . 0.0 110.896 178.841 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 11.8 p -62.18 154.38 70.51 Favored Pre-proline 0 N--CA 1.477 0.893 0 C-N-CA 125.274 1.43 . . . . 0.0 113.246 178.572 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 69.4 Cg_endo -68.43 159.76 52.04 Favored 'Trans proline' 0 CA--C 1.542 0.913 0 C-N-CA 123.103 2.536 . . . . 0.0 113.013 179.904 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 45.7 pt -135.51 22.71 0.98 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.143 0 C-N-CA 125.954 1.702 . . . . 0.0 112.712 -178.736 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 85.8 mmt-85 -135.68 34.34 2.93 Favored 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 126.35 1.86 . . . . 0.0 112.28 -177.645 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -52.64 -27.61 17.89 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 125.638 1.575 . . . . 0.0 114.15 -179.187 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 26.7 p -65.09 -3.72 4.02 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 125.482 1.513 . . . . 0.0 114.809 177.436 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 76.1 tttt -43.76 -46.51 7.68 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 126.838 2.055 . . . . 0.0 113.357 176.256 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -79.32 -20.43 47.93 Favored 'General case' 0 N--CA 1.474 0.771 0 N-CA-C 114.224 1.194 . . . . 0.0 114.224 -179.331 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 96.2 mt -91.3 -9.93 43.22 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 127.233 2.213 . . . . 0.0 114.954 -176.542 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 7.5 m -78.28 79.18 4.73 Favored 'General case' 0 N--CA 1.475 0.818 0 CA-C-O 122.336 1.065 . . . . 0.0 110.705 -179.175 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.407 HD21 HD13 ' A' ' 75' ' ' LEU . 12.4 tp -75.79 142.0 42.4 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 128.81 2.844 . . . . 0.0 112.023 -177.6 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -70.29 150.17 46.64 Favored 'General case' 0 N--CA 1.475 0.786 0 O-C-N 120.46 -1.4 . . . . 0.0 112.137 177.083 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 27.2 m -84.86 151.97 3.72 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.88 0 N-CA-C 109.676 -0.49 . . . . 0.0 109.676 172.104 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 51.3 t -67.54 125.78 27.25 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-O 121.804 0.812 . . . . 0.0 111.434 178.209 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 3.0 mpt_? -63.91 -26.21 68.49 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 124.763 1.225 . . . . 0.0 112.954 -178.158 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 11.1 mm-40 -81.79 -38.4 25.64 Favored 'General case' 0 CA--C 1.538 0.492 0 N-CA-C 109.662 -0.496 . . . . 0.0 109.662 176.877 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 59.7 t80 -63.84 -33.41 75.62 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 124.782 1.233 . . . . 0.0 110.969 175.093 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 84.7 mt-30 -59.31 -24.07 62.99 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 123.701 0.801 . . . . 0.0 112.396 174.277 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 72.9 mtt85 -114.95 12.49 16.81 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 126.453 1.901 . . . . 0.0 112.582 -175.582 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 58.19 34.95 75.51 Favored Glycine 0 CA--C 1.534 1.231 0 C-N-CA 125.256 1.407 . . . . 0.0 113.927 -179.828 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 6.7 t -131.89 14.67 4.8 Favored 'General case' 0 N--CA 1.474 0.762 0 N-CA-C 114.942 1.46 . . . . 0.0 114.942 -175.169 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 8.8 t -67.69 172.54 5.12 Favored 'General case' 0 CA--C 1.557 1.214 0 O-C-N 121.366 -0.834 . . . . 0.0 110.689 173.822 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 89.9 p -140.48 10.69 2.29 Favored 'General case' 0 N--CA 1.477 0.905 0 N-CA-C 115.349 1.611 . . . . 0.0 115.349 -176.309 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 59.0 mtm-85 -131.72 147.08 64.58 Favored Pre-proline 0 N--CA 1.474 0.731 0 C-N-CA 125.522 1.529 . . . . 0.0 112.405 -178.074 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -68.52 165.96 27.39 Favored 'Trans proline' 0 CA--C 1.542 0.889 0 C-N-CA 121.943 1.762 . . . . 0.0 109.633 171.82 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 7.1 p-10 -53.31 -31.8 45.8 Favored 'General case' 0 N--CA 1.473 0.724 0 O-C-N 121.268 -0.895 . . . . 0.0 113.244 177.826 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 22.7 p -72.76 -9.36 58.56 Favored 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 115.136 1.532 . . . . 0.0 115.136 178.468 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 19.8 mt-10 -122.47 -25.41 4.77 Favored 'General case' 0 N--CA 1.477 0.882 0 N-CA-C 115.9 1.815 . . . . 0.0 115.9 -176.421 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 3.0 t -69.68 164.02 24.37 Favored 'General case' 0 CA--C 1.547 0.829 0 N-CA-C 115.195 1.554 . . . . 0.0 115.195 -176.614 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -79.51 -11.14 59.9 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 127.186 2.194 . . . . 0.0 113.764 -179.495 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 65.9 m-85 -141.67 175.55 9.61 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 126.393 1.877 . . . . 0.0 110.673 -179.446 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -79.58 149.97 31.21 Favored 'General case' 0 CA--C 1.547 0.85 0 O-C-N 120.986 -1.071 . . . . 0.0 113.253 -178.078 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 65.2 m170 -123.88 91.99 49.0 Favored Pre-proline 0 CA--C 1.55 0.962 0 C-N-CA 125.785 1.634 . . . . 0.0 110.412 178.859 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_endo -63.0 162.3 26.41 Favored 'Trans proline' 0 CA--C 1.54 0.81 0 C-N-CA 123.356 2.704 . . . . 0.0 114.155 -179.224 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 84.6 p -131.6 -172.26 2.81 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 125.858 1.663 . . . . 0.0 112.531 178.84 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 60.4 pttt -27.14 -48.84 0.04 OUTLIER 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 129.345 3.058 . . . . 0.0 118.425 -175.997 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 5.5 p -109.66 -12.11 14.68 Favored 'General case' 0 N--CA 1.475 0.806 0 N-CA-C 115.697 1.74 . . . . 0.0 115.697 -176.286 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 66.7 m -57.9 128.63 38.04 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 124.546 1.138 . . . . 0.0 113.977 -176.835 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 44.4 tt0 -81.0 125.72 30.5 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 125.575 1.55 . . . . 0.0 110.215 178.333 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 23.2 t -119.67 133.43 66.47 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.976 0 C-N-CA 125.861 1.665 . . . . 0.0 109.608 -178.222 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -144.74 131.39 19.99 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 124.859 1.264 . . . . 0.0 111.504 -179.205 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 62.6 t30 41.41 38.01 0.76 Allowed 'General case' 0 CA--C 1.552 1.043 0 C-N-CA 127.277 2.231 . . . . 0.0 116.714 177.475 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 88.25 15.41 60.63 Favored Glycine 0 CA--C 1.535 1.324 0 O-C-N 120.979 -1.076 . . . . 0.0 114.975 179.536 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 31.6 mtt180 -139.43 168.3 20.13 Favored 'General case' 0 N--CA 1.467 0.4 0 C-N-CA 126.209 1.804 . . . . 0.0 112.185 -179.355 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 2.2 m -141.31 140.31 31.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 C-N-CA 127.737 2.415 . . . . 0.0 108.79 -178.914 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 47.2 mt -89.23 126.19 42.23 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.608 0 O-C-N 121.098 -1.001 . . . . 0.0 109.727 -179.336 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -71.66 146.83 48.02 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 124.071 0.948 . . . . 0.0 111.436 177.303 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 14.7 t -69.1 99.1 1.06 Allowed 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 124.752 1.221 . . . . 0.0 113.03 -177.072 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 28.1 p90 -61.18 -37.73 83.97 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 115.263 -0.88 . . . . 0.0 109.939 174.746 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 75.3 m-20 -62.25 -43.54 98.6 Favored 'General case' 0 CA--C 1.538 0.501 0 O-C-N 121.776 -0.578 . . . . 0.0 110.665 177.293 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 46.6 t -63.83 -44.14 94.13 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 119.633 1.106 . . . . 0.0 111.3 177.313 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 43.7 mt -62.8 -42.24 99.63 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 124.082 0.953 . . . . 0.0 113.294 176.85 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 31.4 mmmt -80.61 -12.65 59.48 Favored 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 124.904 1.281 . . . . 0.0 113.839 179.876 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 85.99 38.42 8.61 Favored Glycine 0 CA--C 1.538 1.485 0 C-N-CA 124.6 1.095 . . . . 0.0 114.274 179.225 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 49.2 ttp180 -122.07 -20.39 6.29 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 126.721 2.008 . . . . 0.0 114.808 -176.825 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 5.6 t -70.14 145.51 51.5 Favored 'General case' 0 CA--C 1.546 0.808 0 CA-C-N 119.393 0.997 . . . . 0.0 113.187 -178.187 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 85.9 p -155.65 8.53 0.26 Allowed 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 126.849 2.06 . . . . 0.0 113.106 179.24 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 67.3 mtm-85 -69.99 161.69 29.54 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 126.434 1.893 . . . . 0.0 113.797 -178.184 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -120.75 0.84 10.45 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 125.757 1.623 . . . . 0.0 112.263 175.834 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 23.1 m120 -142.41 34.93 1.48 Allowed 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 128.628 2.771 . . . . 0.0 109.692 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 8.9 t -56.98 130.51 46.35 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 126.052 1.741 . . . . 0.0 111.396 -178.39 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 17.1 mtmt -83.94 0.26 48.59 Favored 'General case' 0 N--CA 1.476 0.838 0 N-CA-C 113.715 1.006 . . . . 0.0 113.715 -178.843 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 72.2 m-85 -120.96 152.07 38.96 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 122.216 1.008 . . . . 0.0 112.231 -173.21 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -75.61 113.37 12.97 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 123.547 0.739 . . . . 0.0 111.766 -176.656 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 15.4 m170 -68.09 116.4 38.58 Favored Pre-proline 0 CA--C 1.546 0.823 0 N-CA-C 105.126 -2.176 . . . . 0.0 105.126 171.256 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 66.3 Cg_endo -70.16 132.14 22.09 Favored 'Trans proline' 0 CA--C 1.543 0.932 0 C-N-CA 121.917 1.744 . . . . 0.0 114.393 -169.86 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_endo -76.05 159.05 37.85 Favored 'Trans proline' 0 CA--C 1.542 0.879 0 C-N-CA 123.902 3.068 . . . . 0.0 111.863 178.543 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 21.1 Cg_endo -55.57 -32.78 84.39 Favored 'Trans proline' 0 CA--C 1.538 0.719 0 C-N-CA 123.484 2.789 . . . . 0.0 114.715 -178.155 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 56.0 m80 -76.84 -13.41 60.01 Favored 'General case' 0 N--CA 1.474 0.773 0 N-CA-C 114.659 1.355 . . . . 0.0 114.659 177.779 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.407 HD13 HD21 ' A' ' 16' ' ' LEU . 91.2 mt -115.86 -18.13 10.83 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 124.551 1.14 . . . . 0.0 113.535 179.344 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 58.3 mtpt -53.8 -37.21 63.28 Favored 'General case' 0 N--CA 1.48 1.072 0 CA-C-N 119.992 1.269 . . . . 0.0 111.233 172.907 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 19.6 m -64.16 -42.13 96.87 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 124.628 1.171 . . . . 0.0 111.709 176.007 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 90.6 mm-40 -67.21 -42.91 83.32 Favored 'General case' 0 N--CA 1.466 0.356 0 C-N-CA 123.517 0.727 . . . . 0.0 110.421 178.531 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 66.7 mt -63.2 -45.66 90.7 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-O 118.391 -0.814 . . . . 0.0 112.183 176.927 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 7.2 pt-20 -63.99 -35.64 81.37 Favored 'General case' 0 N--CA 1.474 0.766 0 CA-C-N 120.476 1.489 . . . . 0.0 111.878 177.196 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 69.1 mt -63.13 -44.54 99.48 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.679 0 CA-C-N 119.049 0.841 . . . . 0.0 109.77 175.185 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 86.4 m-20 -61.12 -42.74 99.08 Favored 'General case' 0 CA--C 1.545 0.774 0 O-C-N 121.707 -0.621 . . . . 0.0 110.728 175.665 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -63.37 -46.95 91.56 Favored Glycine 0 CA--C 1.531 1.053 0 C-N-CA 124.881 1.229 . . . . 0.0 112.403 178.873 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 85.6 mtt-85 -57.61 -40.05 78.28 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 124.589 1.156 . . . . 0.0 111.171 175.856 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 34.1 m-80 -71.71 -2.99 19.34 Favored 'General case' 0 CA--C 1.551 1.003 0 C-N-CA 124.854 1.262 . . . . 0.0 114.165 176.069 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 40.0 t30 -117.51 -35.42 3.99 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 124.945 1.298 . . . . 0.0 112.529 178.228 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 32.1 tp -55.57 -32.31 62.92 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 125.693 1.597 . . . . 0.0 112.611 177.735 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 29.9 pt -62.44 -15.05 14.02 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.722 0 C-N-CA 126.885 2.074 . . . . 0.0 114.434 177.099 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 51.0 tp60 -56.32 -26.62 52.91 Favored 'General case' 0 N--CA 1.473 0.722 0 CA-C-N 119.372 0.987 . . . . 0.0 112.644 178.232 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 40.7 mt-30 -61.38 -15.29 34.99 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 125.391 1.477 . . . . 0.0 113.78 175.933 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 29.7 mtpp -125.66 20.44 7.85 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 126.667 1.987 . . . . 0.0 112.704 -178.73 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 8.1 p30 . . . . . 0 CA--C 1.547 0.841 0 C-N-CA 124.786 1.234 . . . . 0.0 113.767 -179.98 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 13.9 tpt . . . . . 0 CA--C 1.543 0.7 0 N-CA-C 112.786 0.661 . . . . 0.0 112.786 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -55.45 -24.03 28.62 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 125.619 1.568 . . . . 0.0 114.396 179.79 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 26.9 m -61.22 -14.25 9.9 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.972 0 C-N-CA 125.484 1.514 . . . . 0.0 113.904 176.716 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 28.4 m -67.38 -9.33 40.38 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 125.43 1.492 . . . . 0.0 114.531 178.862 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 9.7 p -146.06 157.78 11.95 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.849 0 C-N-CA 125.499 1.52 . . . . 0.0 111.336 -179.582 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 13.2 p -66.56 151.42 96.36 Favored Pre-proline 0 N--CA 1.476 0.848 0 C-N-CA 124.618 1.167 . . . . 0.0 112.398 178.271 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -71.29 154.91 61.23 Favored 'Trans proline' 0 CA--C 1.541 0.846 0 C-N-CA 123.033 2.488 . . . . 0.0 112.939 -179.846 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 18.7 tt -151.35 -22.05 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.479 0.986 0 C-N-CA 124.873 1.269 . . . . 0.0 113.983 178.752 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 12.3 ttp180 -52.67 -27.59 18.01 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 124.912 1.285 . . . . 0.0 114.229 -179.072 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 10.3 p-10 -65.43 -18.7 65.52 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 126.085 1.754 . . . . 0.0 114.746 176.464 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 56.0 p -133.85 -9.81 2.72 Favored 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 124.676 1.19 . . . . 0.0 114.003 176.426 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 75.5 tttt -48.12 -46.52 34.21 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 125.732 1.613 . . . . 0.0 112.066 175.828 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -73.22 -23.15 60.34 Favored 'General case' 0 CA--C 1.544 0.727 0 N-CA-C 114.08 1.141 . . . . 0.0 114.08 -179.966 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 96.2 mt -91.19 -10.11 42.91 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 127.24 2.216 . . . . 0.0 114.78 -177.141 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 9.7 m -78.45 79.22 4.89 Favored 'General case' 0 N--CA 1.477 0.888 0 CA-C-N 119.728 1.149 . . . . 0.0 110.879 -178.805 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.548 HD21 HD13 ' A' ' 75' ' ' LEU . 10.0 tp -75.71 143.26 42.19 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 128.567 2.747 . . . . 0.0 111.875 -177.728 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 10.1 mt-10 -74.91 151.83 38.9 Favored 'General case' 0 N--CA 1.47 0.559 0 O-C-N 120.5 -1.375 . . . . 0.0 112.888 178.409 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 14.8 m -85.36 154.92 3.49 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.943 0 C-N-CA 123.255 0.622 . . . . 0.0 111.659 175.497 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 47.8 t -74.83 138.59 42.66 Favored 'General case' 0 CA--C 1.538 0.519 0 O-C-N 121.704 -0.622 . . . . 0.0 110.883 176.439 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.27 -39.57 74.85 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 124.811 1.244 . . . . 0.0 113.229 -178.422 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 13.5 mm-40 -73.97 -32.9 63.65 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 123.551 0.74 . . . . 0.0 111.351 179.268 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 67.3 t80 -62.75 -27.57 69.37 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 123.89 0.876 . . . . 0.0 111.471 175.844 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 57.9 mm-40 -65.28 -20.01 66.22 Favored 'General case' 0 N--CA 1.476 0.862 0 N-CA-C 112.815 0.672 . . . . 0.0 112.815 175.359 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 7.3 mpt_? -108.71 8.48 26.88 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 126.315 1.846 . . . . 0.0 111.607 176.894 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 58.64 36.12 84.22 Favored Glycine 0 CA--C 1.533 1.179 0 C-N-CA 125.421 1.486 . . . . 0.0 114.127 -179.677 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 4.8 t -130.96 7.81 4.73 Favored 'General case' 0 N--CA 1.477 0.917 0 N-CA-C 114.892 1.442 . . . . 0.0 114.892 -174.944 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 27.8 t -60.2 132.86 55.25 Favored 'General case' 0 CA--C 1.55 0.959 0 O-C-N 120.902 -1.124 . . . . 0.0 110.615 175.972 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 77.9 p -82.66 3.98 26.76 Favored 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 115.457 1.651 . . . . 0.0 115.457 -176.67 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 67.4 mtm-85 -130.23 146.2 60.58 Favored Pre-proline 0 N--CA 1.475 0.805 0 C-N-CA 125.252 1.421 . . . . 0.0 113.311 -176.216 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 95.2 Cg_endo -70.35 167.76 24.3 Favored 'Trans proline' 0 CA--C 1.543 0.958 0 C-N-CA 122.385 2.056 . . . . 0.0 110.021 171.706 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 -54.22 -29.12 45.28 Favored 'General case' 0 N--CA 1.475 0.81 0 N-CA-C 113.538 0.94 . . . . 0.0 113.538 177.158 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 16.2 p -75.52 -8.35 56.51 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 125.59 1.556 . . . . 0.0 114.981 178.642 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 19.3 mt-10 -124.78 -25.53 3.93 Favored 'General case' 0 N--CA 1.478 0.931 0 N-CA-C 116.092 1.886 . . . . 0.0 116.092 -176.012 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 4.3 t -68.92 163.14 25.11 Favored 'General case' 0 CA--C 1.548 0.895 0 N-CA-C 115.215 1.561 . . . . 0.0 115.215 -176.631 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -79.59 -9.99 59.72 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 127.286 2.234 . . . . 0.0 113.236 179.627 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 65.6 m-85 -140.54 174.0 10.95 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 126.411 1.885 . . . . 0.0 110.523 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -81.99 150.78 27.47 Favored 'General case' 0 CA--C 1.546 0.804 0 O-C-N 121.129 -0.982 . . . . 0.0 113.464 -177.742 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 66.5 m170 -123.82 86.52 53.24 Favored Pre-proline 0 CA--C 1.551 0.982 0 C-N-CA 126.043 1.737 . . . . 0.0 110.739 -179.587 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 29.5 Cg_endo -62.18 146.44 95.99 Favored 'Trans proline' 0 CA--C 1.54 0.811 0 C-N-CA 123.6 2.867 . . . . 0.0 114.923 -177.444 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 51.6 p -84.98 -176.05 6.04 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 124.867 1.267 . . . . 0.0 112.386 175.604 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 75.0 mmtt -60.67 -19.51 58.58 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 125.819 1.648 . . . . 0.0 113.553 173.558 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 43.0 m -109.06 -20.58 12.97 Favored 'General case' 0 N--CA 1.478 0.933 0 N-CA-C 114.216 1.191 . . . . 0.0 114.216 179.372 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 87.2 m -61.5 138.46 58.28 Favored 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 113.915 1.08 . . . . 0.0 113.915 -178.638 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 47.8 tt0 -83.57 127.66 33.91 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 125.832 1.653 . . . . 0.0 110.308 178.594 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 15.0 t -123.11 133.49 68.93 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.958 0 C-N-CA 125.666 1.587 . . . . 0.0 109.908 -177.852 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -144.24 129.29 18.57 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 125.114 1.366 . . . . 0.0 111.255 -179.136 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 61.9 t30 43.42 36.54 1.14 Allowed 'General case' 0 CA--C 1.552 1.051 0 C-N-CA 126.82 2.048 . . . . 0.0 116.462 177.94 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 87.41 14.24 64.17 Favored Glycine 0 CA--C 1.536 1.347 0 O-C-N 120.993 -1.067 . . . . 0.0 114.947 179.845 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 71.4 mtt180 -136.86 164.25 28.74 Favored 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 125.823 1.649 . . . . 0.0 111.087 -179.929 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 4.1 m -139.34 142.74 32.64 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.564 0 C-N-CA 127.13 2.172 . . . . 0.0 109.085 -177.926 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 29.1 mt -90.94 127.84 43.12 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.647 0 O-C-N 121.09 -1.006 . . . . 0.0 109.995 -178.51 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -73.38 147.46 44.29 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 123.962 0.905 . . . . 0.0 111.229 177.642 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 15.1 t -70.58 97.06 1.26 Allowed 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 125.655 1.582 . . . . 0.0 113.267 -175.82 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 28.1 p90 -59.66 -37.53 79.01 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 123.428 0.691 . . . . 0.0 110.407 175.179 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 69.7 m-20 -61.43 -36.82 81.42 Favored 'General case' 0 CA--C 1.54 0.574 0 O-C-N 121.645 -0.659 . . . . 0.0 111.632 177.273 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 46.7 p -67.19 -38.53 85.52 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-N 119.733 1.151 . . . . 0.0 111.976 177.304 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 42.1 mt -71.73 -42.97 66.64 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 124.51 1.124 . . . . 0.0 112.261 177.444 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 31.1 mmmt -76.12 -15.6 60.05 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 124.69 1.196 . . . . 0.0 113.7 179.573 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 87.76 42.41 6.07 Favored Glycine 0 CA--C 1.537 1.416 0 C-N-CA 124.519 1.057 . . . . 0.0 114.502 178.085 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 19.4 tpp180 -127.19 -23.43 3.57 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 125.865 1.666 . . . . 0.0 115.241 -176.922 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 8.2 t -62.67 128.96 38.39 Favored 'General case' 0 CA--C 1.546 0.8 0 CA-C-N 119.444 1.02 . . . . 0.0 113.142 -176.542 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 38.3 m -142.62 11.77 1.88 Allowed 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 126.743 2.017 . . . . 0.0 112.507 -179.773 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 77.4 mtm-85 -73.96 164.71 26.27 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 126.196 1.798 . . . . 0.0 114.047 -177.611 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -121.02 -1.59 9.82 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 125.961 1.704 . . . . 0.0 112.285 176.357 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 14.1 m120 -143.05 36.31 1.38 Allowed 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 128.127 2.571 . . . . 0.0 109.976 179.268 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 9.4 t -53.51 128.34 28.54 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 124.848 1.259 . . . . 0.0 111.436 -178.502 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 6.8 mtmp? -84.78 3.78 36.03 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 124.077 0.951 . . . . 0.0 113.457 -177.982 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 67.5 m-85 -124.76 152.79 43.37 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 124.207 1.003 . . . . 0.0 112.353 -173.881 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -79.65 116.4 19.83 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 123.712 0.805 . . . . 0.0 112.249 -175.788 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 32.7 m170 -68.99 114.42 23.1 Favored Pre-proline 0 CA--C 1.548 0.902 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 174.649 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 67.8 Cg_exo -47.23 112.99 0.6 Allowed 'Trans proline' 0 CA--C 1.541 0.861 0 C-N-CA 125.011 3.807 . . . . 0.0 116.267 -175.926 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 96.0 Cg_endo -76.0 157.01 38.7 Favored 'Trans proline' 0 CA--C 1.541 0.873 0 C-N-CA 121.74 1.627 . . . . 0.0 110.889 176.406 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_endo -57.41 -31.2 90.55 Favored 'Trans proline' 0 CA--C 1.539 0.734 0 C-N-CA 123.155 2.57 . . . . 0.0 114.839 -176.669 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 61.6 m80 -80.68 -10.84 59.7 Favored 'General case' 0 N--CA 1.475 0.803 0 N-CA-C 114.749 1.388 . . . . 0.0 114.749 178.169 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.548 HD13 HD21 ' A' ' 16' ' ' LEU . 77.3 mt -117.0 -16.96 10.47 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 124.214 1.005 . . . . 0.0 113.179 178.527 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 62.3 mttt -52.99 -35.47 59.29 Favored 'General case' 0 N--CA 1.475 0.825 0 CA-C-N 119.502 1.047 . . . . 0.0 111.58 173.249 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 24.5 m -63.64 -46.05 87.45 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 124.206 1.002 . . . . 0.0 111.295 175.969 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 92.4 mm-40 -65.57 -44.51 86.51 Favored 'General case' 0 N--CA 1.468 0.462 0 C-N-CA 123.637 0.775 . . . . 0.0 110.659 177.661 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 87.9 mt -60.75 -46.52 90.13 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 123.833 0.853 . . . . 0.0 111.974 177.305 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -65.91 -35.42 80.58 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-N 119.934 1.243 . . . . 0.0 112.098 177.52 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 64.9 mt -62.6 -43.56 98.6 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.786 0 CA-C-N 119.258 0.935 . . . . 0.0 109.647 175.337 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 83.8 m-20 -61.77 -44.12 97.51 Favored 'General case' 0 CA--C 1.542 0.668 0 O-C-N 121.778 -0.576 . . . . 0.0 110.482 175.307 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -61.93 -49.52 74.75 Favored Glycine 0 CA--C 1.528 0.856 0 C-N-CA 124.701 1.143 . . . . 0.0 112.559 179.354 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 87.7 mtt-85 -55.64 -29.0 58.49 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 125.078 1.351 . . . . 0.0 113.469 177.972 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 42.9 m-80 -86.9 -0.52 56.65 Favored 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 125.136 1.374 . . . . 0.0 113.959 178.142 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 57.6 m-80 -130.7 -31.97 1.72 Allowed 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 124.752 1.221 . . . . 0.0 113.995 -179.078 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 85.6 mt -77.51 49.34 0.72 Allowed 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 127.347 2.259 . . . . 0.0 112.539 179.676 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 1.5 pp -133.27 157.69 42.77 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.68 0 C-N-CA 125.617 1.567 . . . . 0.0 113.116 -177.574 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 4.9 tp-100 -70.02 142.5 52.75 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.03 0.932 . . . . 0.0 110.56 178.437 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 73.3 mm-40 -84.72 147.08 27.08 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 124.1 0.96 . . . . 0.0 111.533 -179.869 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 14.2 ptmm? -153.59 170.47 20.73 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 125.364 1.466 . . . . 0.0 112.768 -179.009 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 48.4 t-20 . . . . . 0 CA--C 1.545 0.772 0 C-N-CA 124.648 1.179 . . . . 0.0 111.359 175.61 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.541 0.623 0 N-CA-C 113.968 1.099 . . . . 0.0 113.968 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -77.74 46.5 0.56 Allowed 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 126.773 2.029 . . . . 0.0 112.599 179.344 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 8.6 p -146.33 165.57 8.53 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.7 0 C-N-CA 126.446 1.898 . . . . 0.0 110.99 -176.794 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 46.2 m -66.26 137.21 56.79 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 124.695 1.198 . . . . 0.0 111.314 177.174 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 46.2 t -141.58 151.97 19.31 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.964 0 C-N-CA 126.09 1.756 . . . . 0.0 108.855 179.399 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 13.8 p -58.47 152.37 44.92 Favored Pre-proline 0 N--CA 1.477 0.916 0 C-N-CA 124.256 1.023 . . . . 0.0 112.557 178.082 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 70.9 Cg_exo -49.44 142.1 23.9 Favored 'Trans proline' 0 C--N 1.353 0.771 0 C-N-CA 123.872 3.048 . . . . 0.0 114.749 -179.955 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 30.2 pt -61.64 149.55 8.7 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.727 0 C-N-CA 124.431 1.092 . . . . 0.0 112.289 178.609 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 76.2 ttt-85 -59.33 -47.63 84.69 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 124.902 1.281 . . . . 0.0 114.259 -177.312 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 45.2 t0 -163.23 165.01 24.82 Favored 'General case' 0 CA--C 1.549 0.918 0 C-N-CA 124.662 1.185 . . . . 0.0 112.218 -177.958 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 21.3 p -132.63 -5.16 3.26 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 127.487 2.315 . . . . 0.0 112.52 175.432 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 7.1 ttpm? -51.04 -42.76 60.69 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 124.641 1.176 . . . . 0.0 112.618 177.767 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -66.61 -29.95 70.12 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 124.304 1.042 . . . . 0.0 113.372 177.936 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 91.2 mt -88.2 -12.22 44.48 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 127.202 2.201 . . . . 0.0 113.886 -179.119 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 12.9 m -79.59 79.37 6.07 Favored 'General case' 0 N--CA 1.474 0.732 0 CA-C-O 122.487 1.137 . . . . 0.0 110.218 -178.377 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.483 HD21 HD13 ' A' ' 75' ' ' LEU . 11.9 tp -75.61 143.81 42.1 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 128.512 2.725 . . . . 0.0 111.548 -177.357 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 62.5 mt-10 -74.03 150.57 40.57 Favored 'General case' 0 CA--C 1.541 0.614 0 O-C-N 120.765 -1.21 . . . . 0.0 112.362 178.622 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 13.7 m -86.33 153.24 3.44 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.232 0 C-N-CA 123.539 0.736 . . . . 0.0 111.149 174.59 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 41.5 t -72.29 130.15 40.1 Favored 'General case' 0 CA--C 1.543 0.695 0 O-C-N 121.129 -0.982 . . . . 0.0 112.081 178.76 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.2 -28.94 69.73 Favored 'General case' 0 N--CA 1.479 0.992 0 O-C-N 121.287 -0.883 . . . . 0.0 113.09 179.821 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -77.03 -41.4 42.77 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 123.726 0.811 . . . . 0.0 110.142 178.884 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 65.0 t80 -63.54 -34.4 77.72 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 124.331 1.052 . . . . 0.0 111.517 175.907 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 13.6 mm100 -62.65 -14.51 44.33 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 124.03 0.932 . . . . 0.0 113.161 175.081 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 11.8 mtp-105 -121.41 12.67 10.9 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 127.428 2.291 . . . . 0.0 112.197 179.27 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 57.2 35.73 71.8 Favored Glycine 0 CA--C 1.534 1.261 0 C-N-CA 125.259 1.409 . . . . 0.0 114.0 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 7.4 t -131.73 15.6 4.84 Favored 'General case' 0 N--CA 1.476 0.842 0 N-CA-C 114.898 1.444 . . . . 0.0 114.898 -174.958 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 5.9 t -67.83 172.53 5.29 Favored 'General case' 0 CA--C 1.556 1.182 0 CA-C-N 119.137 0.88 . . . . 0.0 111.432 175.295 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 94.3 p -134.79 6.1 3.41 Favored 'General case' 0 N--CA 1.476 0.85 0 N-CA-C 115.55 1.685 . . . . 0.0 115.55 -175.782 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 81.5 mtt180 -133.1 143.34 48.04 Favored Pre-proline 0 N--CA 1.472 0.64 0 C-N-CA 125.53 1.532 . . . . 0.0 111.91 -179.39 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -68.17 165.72 27.54 Favored 'Trans proline' 0 CA--C 1.542 0.913 0 C-N-CA 122.144 1.896 . . . . 0.0 109.919 173.155 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -51.89 -32.7 33.59 Favored 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 113.765 1.024 . . . . 0.0 113.765 178.486 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 17.6 p -71.05 -14.08 62.2 Favored 'General case' 0 N--CA 1.473 0.725 0 C-N-CA 125.906 1.682 . . . . 0.0 115.021 178.481 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 74.3 mm-40 -123.78 -22.85 4.82 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 125.692 1.597 . . . . 0.0 115.23 -174.268 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 4.6 t -65.14 168.18 7.08 Favored 'General case' 0 CA--C 1.548 0.898 0 N-CA-C 115.937 1.829 . . . . 0.0 115.937 -175.527 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -80.41 -18.98 47.27 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 128.075 2.55 . . . . 0.0 113.102 -179.755 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 67.5 m-85 -145.2 178.37 8.12 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 126.625 1.97 . . . . 0.0 110.598 -178.061 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -79.37 151.13 31.15 Favored 'General case' 0 CA--C 1.547 0.864 0 O-C-N 120.812 -1.18 . . . . 0.0 113.404 -178.071 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 59.5 m170 -125.41 87.73 55.24 Favored Pre-proline 0 CA--C 1.549 0.932 0 C-N-CA 126.128 1.771 . . . . 0.0 110.355 179.576 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -64.32 147.32 90.9 Favored 'Trans proline' 0 C--N 1.352 0.754 0 C-N-CA 123.237 2.625 . . . . 0.0 114.379 -177.885 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 60.2 p -84.59 -176.31 6.18 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 124.685 1.194 . . . . 0.0 111.79 174.735 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 47.1 mmtm -61.04 -18.75 59.52 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 125.259 1.424 . . . . 0.0 113.253 173.084 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 42.1 m -109.17 -20.6 12.93 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 125.133 1.373 . . . . 0.0 114.563 -178.9 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 97.0 m -65.45 132.93 50.19 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-N 119.357 0.981 . . . . 0.0 112.659 179.862 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 33.9 mt-30 -77.24 138.43 39.41 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 123.271 0.628 . . . . 0.0 111.011 176.766 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 11.8 t -127.87 147.08 32.58 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.897 0 C-N-CA 125.666 1.586 . . . . 0.0 110.986 -176.895 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 4.3 pt-20 -149.02 117.48 6.51 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 125.188 1.395 . . . . 0.0 114.062 -179.349 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 75.0 m-20 40.66 30.46 0.09 Allowed 'General case' 0 CA--C 1.553 1.073 0 C-N-CA 127.536 2.334 . . . . 0.0 116.986 174.987 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 109.17 5.5 30.41 Favored Glycine 0 CA--C 1.536 1.371 0 C-N-CA 124.656 1.122 . . . . 0.0 114.932 -178.995 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 34.3 mtt180 -133.87 165.41 25.07 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 119.236 1.518 . . . . 0.0 112.508 179.04 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 3.8 m -140.42 145.79 25.39 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.534 0 C-N-CA 127.992 2.517 . . . . 0.0 109.107 -179.417 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 17.8 mt -94.13 131.44 41.01 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 O-C-N 121.003 -1.061 . . . . 0.0 110.201 -178.485 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -77.65 148.21 35.16 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 124.095 0.958 . . . . 0.0 111.659 178.632 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 21.5 t -70.63 98.94 1.58 Allowed 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 124.9 1.28 . . . . 0.0 112.582 -177.409 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 29.5 p90 -60.78 -38.34 84.95 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 123.652 0.781 . . . . 0.0 110.512 175.789 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 60.9 m-20 -59.59 -38.44 81.25 Favored 'General case' 0 CA--C 1.543 0.703 0 O-C-N 121.719 -0.613 . . . . 0.0 110.436 176.66 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 24.7 p -65.49 -41.71 92.98 Favored 'General case' 0 N--CA 1.472 0.632 0 CA-C-N 119.929 1.241 . . . . 0.0 112.164 177.832 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 33.6 mt -68.71 -41.25 79.34 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 124.756 1.222 . . . . 0.0 112.638 177.913 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 14.2 mmmm -77.53 -8.78 58.34 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 124.586 1.155 . . . . 0.0 113.437 178.743 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 78.71 41.12 16.02 Favored Glycine 0 CA--C 1.536 1.369 0 C-N-CA 124.733 1.158 . . . . 0.0 113.632 179.265 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 65.1 ttt-85 -123.64 -22.9 4.86 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 126.85 2.06 . . . . 0.0 114.873 -175.571 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 5.6 t -69.22 145.88 52.81 Favored 'General case' 0 CA--C 1.545 0.768 0 CA-C-N 119.24 0.927 . . . . 0.0 112.973 -178.0 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 78.4 p -154.98 9.54 0.32 Allowed 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 126.704 2.001 . . . . 0.0 112.904 178.94 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 68.2 mtm-85 -70.14 160.8 31.41 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 126.181 1.792 . . . . 0.0 113.263 -178.569 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -121.25 3.15 10.36 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 125.623 1.569 . . . . 0.0 112.459 177.125 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 27.2 m120 -142.71 27.66 1.65 Allowed 'General case' 0 CA--C 1.552 1.048 0 C-N-CA 127.751 2.42 . . . . 0.0 110.56 -179.218 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 4.5 t -50.17 128.83 20.09 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 126.502 1.921 . . . . 0.0 112.525 -176.189 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 32.3 mtmt -84.17 3.11 36.51 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 125.182 1.393 . . . . 0.0 113.868 -177.98 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 87.9 m-85 -125.46 152.87 44.34 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 124.944 1.298 . . . . 0.0 111.935 -175.298 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -76.38 117.42 18.03 Favored 'General case' 0 N--CA 1.465 0.307 0 C-N-CA 123.708 0.803 . . . . 0.0 112.213 -176.471 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 12.9 m170 -72.31 115.7 41.68 Favored Pre-proline 0 CA--C 1.547 0.859 0 N-CA-C 107.962 -1.125 . . . . 0.0 107.962 174.215 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_exo -48.87 115.22 1.56 Allowed 'Trans proline' 0 CA--C 1.542 0.905 0 C-N-CA 124.802 3.668 . . . . 0.0 115.696 -176.104 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 92.2 Cg_endo -78.88 153.65 25.77 Favored 'Trans proline' 0 CA--C 1.544 1.02 0 C-N-CA 121.887 1.725 . . . . 0.0 111.283 177.6 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 86.6 Cg_exo -47.16 -36.99 22.78 Favored 'Trans proline' 0 CA--C 1.537 0.664 0 C-N-CA 124.189 3.26 . . . . 0.0 115.704 179.682 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 69.8 m80 -79.63 -10.35 59.78 Favored 'General case' 0 N--CA 1.473 0.704 0 N-CA-C 115.588 1.699 . . . . 0.0 115.588 -179.643 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.483 HD13 HD21 ' A' ' 16' ' ' LEU . 79.9 mt -119.42 -14.55 9.16 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 124.512 1.125 . . . . 0.0 113.287 177.721 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 23.8 mtpp -54.45 -34.8 62.16 Favored 'General case' 0 N--CA 1.477 0.915 0 CA-C-N 119.451 1.023 . . . . 0.0 111.409 173.363 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 21.7 m -62.92 -45.71 91.2 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 123.877 0.871 . . . . 0.0 111.202 176.068 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 92.6 mm-40 -66.03 -44.99 83.05 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 123.604 0.761 . . . . 0.0 110.954 177.665 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 76.5 mt -60.72 -45.24 94.99 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 123.742 0.817 . . . . 0.0 112.212 177.809 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -66.85 -36.5 82.47 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-N 119.578 1.081 . . . . 0.0 111.886 177.343 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 63.9 mt -62.06 -42.05 93.49 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.754 0 CA-C-N 119.117 0.871 . . . . 0.0 109.797 175.384 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 86.4 m-20 -61.74 -47.12 86.64 Favored 'General case' 0 CA--C 1.543 0.704 0 O-C-N 121.861 -0.525 . . . . 0.0 110.395 175.32 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -60.43 -47.48 90.92 Favored Glycine 0 CA--C 1.531 1.058 0 C-N-CA 124.595 1.093 . . . . 0.0 113.105 179.355 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 88.9 mtt-85 -58.18 -21.32 46.92 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 125.32 1.448 . . . . 0.0 113.402 176.66 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 60.3 m-80 -106.28 9.81 31.9 Favored 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 125.991 1.717 . . . . 0.0 112.915 178.591 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 38.9 t30 -132.75 -25.09 1.9 Allowed 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 125.087 1.355 . . . . 0.0 114.213 -179.99 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 53.5 tp -61.47 -30.17 70.43 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 125.975 1.71 . . . . 0.0 113.551 -179.986 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . 0.492 HD13 ' H ' ' A' ' 88' ' ' ILE . 0.2 OUTLIER -72.47 173.3 0.89 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.686 0 C-N-CA 125.983 1.713 . . . . 0.0 112.753 178.064 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 5.6 tp-100 -63.02 156.26 25.23 Favored 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 125.29 1.436 . . . . 0.0 111.303 176.532 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 5.2 tp-100 -52.81 138.38 29.56 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 124.42 1.088 . . . . 0.0 112.462 179.642 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 62.0 mttp -69.71 -8.55 48.8 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 126.218 1.807 . . . . 0.0 115.843 -176.379 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 49.2 t-20 . . . . . 0 CA--C 1.542 0.672 0 C-N-CA 125.566 1.547 . . . . 0.0 111.497 179.806 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 13.8 tpt . . . . . 0 CA--C 1.545 0.766 0 N-CA-C 112.583 0.586 . . . . 0.0 112.583 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -137.9 11.82 2.88 Favored 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 125.912 1.685 . . . . 0.0 113.47 -179.875 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 35.9 m -131.32 9.8 1.85 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.23 0 C-N-CA 125.931 1.692 . . . . 0.0 113.473 -178.227 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 8.0 t -152.4 179.34 8.64 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 125.961 1.705 . . . . 0.0 111.272 179.862 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 14.7 p -143.52 143.43 24.4 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.798 0 C-N-CA 125.605 1.562 . . . . 0.0 111.234 179.672 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 26.6 p -71.1 142.38 87.4 Favored Pre-proline 0 N--CA 1.476 0.873 0 C-N-CA 124.655 1.182 . . . . 0.0 112.926 -179.19 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_endo -74.76 151.25 40.53 Favored 'Trans proline' 0 CA--C 1.541 0.866 0 C-N-CA 123.017 2.478 . . . . 0.0 111.533 177.217 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 9.1 tp -158.0 156.54 4.03 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.817 0 C-N-CA 125.298 1.439 . . . . 0.0 110.24 178.434 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 51.1 tpt85 -143.3 -29.64 0.52 Allowed 'General case' 0 N--CA 1.481 1.093 0 N-CA-C 114.621 1.341 . . . . 0.0 114.621 179.338 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 45.5 t0 -64.28 154.31 35.53 Favored 'General case' 0 CA--C 1.549 0.916 0 CA-C-N 119.389 0.995 . . . . 0.0 112.16 179.01 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 30.5 p -129.79 -1.11 4.8 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 126.864 2.065 . . . . 0.0 113.18 -179.521 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 7.4 ttpm? -49.33 -41.06 37.51 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 125.179 1.392 . . . . 0.0 113.945 179.04 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -75.48 -22.63 57.07 Favored 'General case' 0 N--CA 1.475 0.79 0 N-CA-C 114.113 1.153 . . . . 0.0 114.113 178.684 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 90.7 mt -91.72 -12.02 35.18 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 127.22 2.208 . . . . 0.0 114.423 -177.822 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 9.6 m -79.03 74.2 5.56 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 124.678 1.191 . . . . 0.0 110.898 -177.792 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.533 HD21 HD13 ' A' ' 75' ' ' LEU . 9.8 tp -75.7 143.73 41.96 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 126.845 2.058 . . . . 0.0 111.853 -178.047 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 8.2 mt-10 -69.54 150.29 47.28 Favored 'General case' 0 N--CA 1.472 0.67 0 O-C-N 120.766 -1.209 . . . . 0.0 112.308 178.735 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 21.3 m -82.15 148.85 5.01 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 N-CA-C 109.303 -0.628 . . . . 0.0 109.303 173.545 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 49.6 t -66.01 130.92 44.91 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-O 121.757 0.789 . . . . 0.0 111.01 178.124 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 2.8 mpt_? -69.41 -33.75 73.47 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 125.667 1.587 . . . . 0.0 112.192 -177.725 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 14.8 mm-40 -77.9 -34.5 51.42 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 123.676 0.79 . . . . 0.0 110.998 178.36 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 74.6 t80 -62.59 -27.51 69.24 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 124.452 1.101 . . . . 0.0 111.365 175.222 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 54.4 mm-40 -65.03 -19.5 66.03 Favored 'General case' 0 N--CA 1.475 0.825 0 N-CA-C 112.806 0.669 . . . . 0.0 112.806 175.337 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 6.9 mpt_? -111.75 10.2 20.9 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 126.477 1.911 . . . . 0.0 111.56 177.012 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 58.32 36.31 82.83 Favored Glycine 0 CA--C 1.533 1.213 0 C-N-CA 125.463 1.506 . . . . 0.0 114.287 -179.957 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 6.2 t -130.84 11.9 5.2 Favored 'General case' 0 N--CA 1.478 0.963 0 N-CA-C 115.117 1.525 . . . . 0.0 115.117 -175.388 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 36.8 t -61.45 139.11 58.27 Favored 'General case' 0 CA--C 1.551 1.017 0 O-C-N 121.318 -0.864 . . . . 0.0 110.988 176.165 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 78.2 p -89.23 0.67 56.59 Favored 'General case' 0 N--CA 1.472 0.631 0 N-CA-C 115.686 1.735 . . . . 0.0 115.686 -176.755 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 68.0 mtt180 -132.65 145.35 56.79 Favored Pre-proline 0 N--CA 1.475 0.803 0 C-N-CA 125.19 1.396 . . . . 0.0 113.042 -177.131 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -68.94 166.14 27.58 Favored 'Trans proline' 0 CA--C 1.543 0.965 0 C-N-CA 122.39 2.06 . . . . 0.0 110.125 172.878 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -52.23 -32.1 35.21 Favored 'General case' 0 N--CA 1.477 0.89 0 N-CA-C 113.868 1.062 . . . . 0.0 113.868 178.022 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 22.4 p -72.14 -13.71 61.63 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 125.585 1.554 . . . . 0.0 114.941 178.553 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 70.8 mm-40 -125.35 -22.25 4.38 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 125.574 1.55 . . . . 0.0 115.182 -174.623 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . 0.42 ' SG ' ' NZ ' ' A' ' 35' ' ' LYS . 14.3 t -60.03 162.75 5.35 Favored 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 115.37 1.618 . . . . 0.0 115.37 -176.509 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.42 ' NZ ' ' SG ' ' A' ' 34' ' ' CYS . 0.0 OUTLIER -80.42 -13.65 58.95 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 126.748 2.019 . . . . 0.0 112.821 177.959 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 70.3 m-85 -141.61 175.92 9.31 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 126.657 1.983 . . . . 0.0 111.151 -178.76 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -81.57 151.3 27.77 Favored 'General case' 0 CA--C 1.551 1.008 0 O-C-N 120.753 -1.217 . . . . 0.0 113.599 -178.283 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 56.0 m170 -124.67 91.28 49.7 Favored Pre-proline 0 CA--C 1.551 1.001 0 C-N-CA 126.006 1.722 . . . . 0.0 111.168 179.419 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo -66.49 167.05 19.81 Favored 'Trans proline' 0 CA--C 1.542 0.922 0 C-N-CA 123.678 2.919 . . . . 0.0 114.395 -179.237 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 59.7 p -125.04 -174.28 3.01 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 126.116 1.766 . . . . 0.0 111.954 177.401 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 30.9 mmmt -49.48 -26.58 3.49 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 127.31 2.244 . . . . 0.0 116.323 -179.378 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 21.1 m -109.05 -19.07 13.51 Favored 'General case' 0 N--CA 1.481 1.082 0 N-CA-C 114.506 1.299 . . . . 0.0 114.506 -179.389 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 58.3 m -63.49 135.43 56.88 Favored 'General case' 0 CA--C 1.543 0.7 0 CA-C-N 119.359 0.981 . . . . 0.0 113.137 -178.734 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 40.4 tt0 -85.29 127.6 34.38 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 125.519 1.527 . . . . 0.0 110.044 178.716 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 20.1 t -120.45 133.6 66.64 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 C-N-CA 125.523 1.529 . . . . 0.0 109.51 -178.162 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 -143.19 130.44 20.89 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 125.016 1.326 . . . . 0.0 110.864 -179.118 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 45.59 36.65 2.68 Favored 'General case' 0 CA--C 1.555 1.147 0 C-N-CA 126.451 1.9 . . . . 0.0 115.366 178.936 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 81.18 19.94 65.88 Favored Glycine 0 CA--C 1.536 1.387 0 O-C-N 120.956 -1.09 . . . . 0.0 114.579 -179.856 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 63.4 mtt180 -138.69 163.25 32.61 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 125.995 1.718 . . . . 0.0 110.938 -179.16 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 3.3 m -138.17 140.07 40.94 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.501 0 C-N-CA 126.613 1.965 . . . . 0.0 109.381 -177.91 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 54.7 mt -90.32 130.63 39.25 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.662 0 O-C-N 121.544 -0.723 . . . . 0.0 109.528 -178.952 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -74.99 150.56 38.94 Favored 'General case' 0 CA--C 1.551 0.982 0 C-N-CA 123.782 0.833 . . . . 0.0 112.556 178.642 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 2.5 t -68.35 91.51 0.39 Allowed 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 125.614 1.566 . . . . 0.0 110.85 -178.375 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 25.2 p90 -56.48 -36.94 69.69 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 124.167 0.987 . . . . 0.0 111.498 178.996 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 72.7 m-20 -61.82 -33.7 74.6 Favored 'General case' 0 CA--C 1.54 0.592 0 O-C-N 121.878 -0.514 . . . . 0.0 111.597 177.43 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 30.4 t -70.39 -41.21 73.32 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-N 119.678 1.126 . . . . 0.0 110.769 177.254 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 42.0 mt -66.74 -41.11 88.38 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.01 0.924 . . . . 0.0 112.912 176.075 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 32.1 mmmt -81.32 -7.53 59.59 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 125.114 1.365 . . . . 0.0 114.203 -179.302 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 77.61 39.95 23.98 Favored Glycine 0 CA--C 1.537 1.431 0 C-N-CA 124.505 1.05 . . . . 0.0 114.12 178.889 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 50.4 ttp180 -125.98 -16.54 5.57 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 126.758 2.023 . . . . 0.0 114.79 -176.546 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 4.7 t -62.29 133.48 55.19 Favored 'General case' 0 CA--C 1.544 0.713 0 CA-C-N 119.448 1.022 . . . . 0.0 113.322 -176.233 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 88.2 p -145.0 6.34 1.16 Allowed 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 127.138 2.175 . . . . 0.0 112.47 179.423 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.464 ' NH1' ' SG ' ' A' ' 66' ' ' CYS . 21.8 mtm105 -70.85 168.31 17.09 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 126.813 2.045 . . . . 0.0 113.248 179.434 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -136.66 14.84 3.15 Favored 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 127.019 2.128 . . . . 0.0 111.022 176.179 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 33.9 p-10 -144.67 19.68 1.67 Allowed 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 127.839 2.456 . . . . 0.0 113.522 -174.785 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' CYS . . . . . 0.464 ' SG ' ' NH1' ' A' ' 63' ' ' ARG . 63.2 m -41.51 115.56 0.65 Allowed 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 125.056 1.342 . . . . 0.0 114.506 -175.443 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 19.1 mtmt -80.66 4.0 20.17 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-N 114.916 -1.038 . . . . 0.0 111.459 173.991 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 65.5 m-85 -125.61 144.94 50.36 Favored 'General case' 0 N--CA 1.447 -0.605 0 C-N-CA 126.416 1.886 . . . . 0.0 110.21 -174.24 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -72.81 117.56 14.66 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 123.817 0.847 . . . . 0.0 112.252 -176.017 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 3.8 m-70 -65.4 123.97 85.82 Favored Pre-proline 0 CA--C 1.546 0.801 0 N-CA-C 105.865 -1.902 . . . . 0.0 105.865 170.328 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -70.02 122.87 9.46 Favored 'Trans proline' 0 CA--C 1.544 0.992 0 C-N-CA 121.946 1.764 . . . . 0.0 113.938 -170.932 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 94.5 Cg_endo -77.82 153.29 29.41 Favored 'Trans proline' 0 CA--C 1.543 0.962 0 C-N-CA 123.264 2.643 . . . . 0.0 112.015 179.261 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 80.6 Cg_exo -45.69 -42.9 19.09 Favored 'Trans proline' 0 CA--C 1.538 0.72 0 C-N-CA 124.319 3.346 . . . . 0.0 115.844 179.883 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 17.4 t-80 -70.77 -15.22 62.66 Favored 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 114.938 1.458 . . . . 0.0 114.938 -179.786 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.533 HD13 HD21 ' A' ' 16' ' ' LEU . 81.1 mt -112.55 -18.17 12.46 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 124.562 1.145 . . . . 0.0 112.975 178.622 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 57.4 mtpt -54.09 -35.76 62.45 Favored 'General case' 0 N--CA 1.478 0.941 0 CA-C-N 119.83 1.195 . . . . 0.0 111.593 174.852 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 22.4 m -62.83 -45.63 91.72 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 124.081 0.952 . . . . 0.0 111.374 175.691 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 76.2 mt-30 -64.21 -46.93 81.71 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 123.634 0.774 . . . . 0.0 110.711 177.449 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 92.4 mt -61.42 -45.8 92.77 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 124.205 1.002 . . . . 0.0 112.549 179.244 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 7.5 pt-20 -66.03 -37.01 84.79 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-N 119.91 1.232 . . . . 0.0 111.98 177.972 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 61.9 mt -61.59 -40.74 87.65 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 CA-C-N 119.215 0.916 . . . . 0.0 110.131 176.304 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 79.5 m-20 -67.59 -47.03 70.87 Favored 'General case' 0 CA--C 1.546 0.819 0 O-C-N 121.918 -0.489 . . . . 0.0 110.803 175.477 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -61.49 -40.16 98.3 Favored Glycine 0 CA--C 1.529 0.954 0 C-N-CA 125.114 1.34 . . . . 0.0 113.62 -179.278 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 82.0 mtt-85 -56.74 -16.73 6.98 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 125.239 1.416 . . . . 0.0 113.919 175.997 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 12.0 t-20 -115.57 9.41 15.36 Favored 'General case' 0 CA--C 1.555 1.147 0 C-N-CA 125.965 1.706 . . . . 0.0 112.522 178.771 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -134.77 -24.52 1.5 Allowed 'General case' 0 CA--C 1.549 0.93 0 C-N-CA 125.31 1.444 . . . . 0.0 114.383 -176.641 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 42.4 mt -61.93 -11.53 13.65 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 125.263 1.425 . . . . 0.0 114.205 179.348 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 1.7 pp -68.29 18.23 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.553 1.077 0 C-N-CA 128.099 2.56 . . . . 0.0 114.785 176.804 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 33.7 tt0 -49.33 134.13 18.91 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 126.706 2.002 . . . . 0.0 112.583 179.735 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 52.6 tt0 -148.66 149.66 31.87 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 125.1 1.36 . . . . 0.0 111.016 179.78 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 65.0 pttt -64.2 163.62 12.39 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 125.0 1.32 . . . . 0.0 113.423 178.624 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 44.2 t30 . . . . . 0 CA--C 1.545 0.756 0 C-N-CA 124.799 1.24 . . . . 0.0 112.502 178.228 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 64.7 mtt . . . . . 0 CA--C 1.544 0.715 0 N-CA-C 113.256 0.836 . . . . 0.0 113.256 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -138.23 12.19 2.82 Favored 'General case' 0 CA--C 1.551 1.01 0 C-N-CA 126.002 1.721 . . . . 0.0 113.406 -179.441 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 35.1 m -73.21 -7.95 10.7 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.167 0 C-N-CA 125.375 1.47 . . . . 0.0 114.652 -179.561 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 17.2 m -58.65 155.0 13.32 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 125.663 1.585 . . . . 0.0 113.759 -179.885 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 30.2 m -138.04 164.8 27.06 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.005 0 C-N-CA 125.526 1.53 . . . . 0.0 112.175 179.741 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 2.7 p -63.37 153.45 82.26 Favored Pre-proline 0 N--CA 1.477 0.909 0 C-N-CA 125.655 1.582 . . . . 0.0 113.539 179.25 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 62.2 Cg_endo -76.15 25.82 0.42 Allowed 'Trans proline' 0 CA--C 1.546 1.092 0 C-N-CA 125.187 3.925 . . . . 0.0 115.771 -178.167 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 44.6 pt -50.37 -28.5 5.29 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.048 0 C-N-CA 125.862 1.665 . . . . 0.0 115.393 -178.459 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 60.2 ttt85 -71.59 -31.5 67.01 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 124.297 1.039 . . . . 0.0 112.35 176.982 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -87.47 -35.37 18.28 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 124.689 1.196 . . . . 0.0 112.681 179.78 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 28.3 p -67.84 -3.11 8.57 Favored 'General case' 0 N--CA 1.481 1.12 0 N-CA-C 113.965 1.098 . . . . 0.0 113.965 177.02 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 36.2 ttpt -38.24 -45.89 1.02 Allowed 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 127.481 2.312 . . . . 0.0 114.302 178.2 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -80.34 -19.03 47.44 Favored 'General case' 0 CA--C 1.543 0.696 0 N-CA-C 114.743 1.386 . . . . 0.0 114.743 -178.402 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 83.5 mt -93.12 -18.52 22.49 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 126.362 1.865 . . . . 0.0 114.555 -176.605 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 2.6 m -73.71 75.3 1.56 Allowed 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 124.645 1.178 . . . . 0.0 111.863 -178.847 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -75.65 146.07 40.56 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 128.391 2.676 . . . . 0.0 111.094 -178.456 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 12.0 mt-10 -76.04 153.0 36.76 Favored 'General case' 0 N--CA 1.472 0.667 0 O-C-N 120.215 -1.553 . . . . 0.0 112.835 178.386 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 10.8 m -84.4 154.43 3.63 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.73 0 C-N-CA 122.748 0.419 . . . . 0.0 110.279 173.904 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 48.8 t -71.41 139.18 49.63 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-O 121.23 0.538 . . . . 0.0 110.361 176.609 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 3.8 mpt_? -68.59 -38.39 80.61 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 125.306 1.443 . . . . 0.0 112.452 -177.635 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 17.0 mm-40 -74.63 -33.78 62.64 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 123.918 0.887 . . . . 0.0 110.927 178.489 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 51.1 t80 -64.71 -22.78 67.06 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 123.801 0.841 . . . . 0.0 112.065 175.315 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 76.9 mt-30 -59.12 -22.58 61.09 Favored 'General case' 0 N--CA 1.477 0.882 0 O-C-N 121.568 -0.707 . . . . 0.0 112.872 175.526 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -116.62 14.26 15.41 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 125.741 1.616 . . . . 0.0 111.91 177.24 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 58.36 37.75 88.48 Favored Glycine 0 CA--C 1.534 1.227 0 C-N-CA 125.333 1.444 . . . . 0.0 114.228 -179.61 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 5.5 t -127.73 9.61 6.47 Favored 'General case' 0 N--CA 1.479 1.023 0 N-CA-C 114.632 1.345 . . . . 0.0 114.632 -175.279 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 34.6 t -62.7 134.61 56.57 Favored 'General case' 0 CA--C 1.55 0.947 0 O-C-N 120.927 -1.108 . . . . 0.0 111.021 175.729 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 27.8 m -79.37 2.79 20.34 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 125.69 1.596 . . . . 0.0 115.293 -177.358 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 71.2 mtm-85 -132.62 146.93 63.53 Favored Pre-proline 0 N--CA 1.474 0.775 0 C-N-CA 125.033 1.333 . . . . 0.0 113.733 -174.876 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 95.0 Cg_endo -71.01 166.87 27.75 Favored 'Trans proline' 0 CA--C 1.545 1.047 0 C-N-CA 122.337 2.024 . . . . 0.0 109.792 170.738 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -53.9 -32.4 53.22 Favored 'General case' 0 N--CA 1.477 0.924 0 O-C-N 121.157 -0.965 . . . . 0.0 112.79 177.681 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 26.9 p -71.16 -8.28 52.46 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 125.876 1.671 . . . . 0.0 115.147 178.158 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 20.5 mt-10 -125.14 -25.81 3.77 Favored 'General case' 0 N--CA 1.476 0.854 0 N-CA-C 115.439 1.644 . . . . 0.0 115.439 -177.587 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 4.2 t -70.16 164.23 24.65 Favored 'General case' 0 CA--C 1.548 0.878 0 N-CA-C 115.154 1.539 . . . . 0.0 115.154 -177.01 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 75.0 mmtt -81.31 -10.55 59.55 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 127.272 2.229 . . . . 0.0 113.25 179.949 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 73.7 m-85 -139.15 175.66 9.36 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 126.878 2.071 . . . . 0.0 110.196 179.497 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -86.11 150.13 24.64 Favored 'General case' 0 CA--C 1.546 0.805 0 O-C-N 121.213 -0.93 . . . . 0.0 113.458 -177.655 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 61.5 m170 -122.17 90.62 49.02 Favored Pre-proline 0 CA--C 1.554 1.128 0 C-N-CA 125.573 1.549 . . . . 0.0 111.056 179.222 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 30.8 Cg_endo -62.36 161.35 27.64 Favored 'Trans proline' 0 C--N 1.355 0.878 0 C-N-CA 123.62 2.88 . . . . 0.0 114.878 -178.874 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 52.5 p -113.44 -174.21 2.42 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 125.655 1.582 . . . . 0.0 112.265 177.439 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 58.0 mtmt -52.55 -25.4 10.36 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 126.873 2.069 . . . . 0.0 115.512 178.981 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 42.7 m -109.07 -19.83 13.23 Favored 'General case' 0 N--CA 1.478 0.968 0 N-CA-C 114.827 1.418 . . . . 0.0 114.827 -179.07 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 63.8 m -62.82 133.72 55.16 Favored 'General case' 0 CA--C 1.541 0.611 0 CA-C-N 119.471 1.032 . . . . 0.0 113.419 -179.107 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 35.5 mt-30 -81.92 139.14 34.81 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 123.41 0.684 . . . . 0.0 110.888 175.769 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 12.0 t -131.49 138.71 52.44 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.794 0 C-N-CA 125.413 1.485 . . . . 0.0 110.59 -177.275 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -145.69 132.75 20.33 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 125.093 1.357 . . . . 0.0 111.128 177.879 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 63.1 t30 42.78 37.14 0.97 Allowed 'General case' 0 CA--C 1.552 1.021 0 C-N-CA 126.684 1.994 . . . . 0.0 116.105 177.89 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 84.25 17.18 65.23 Favored Glycine 0 CA--C 1.536 1.402 0 O-C-N 120.998 -1.064 . . . . 0.0 114.848 -179.62 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 64.1 mtt180 -136.48 160.28 39.24 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 125.617 1.567 . . . . 0.0 111.736 -179.546 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 3.2 m -138.79 139.31 41.02 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.491 0 C-N-CA 127.63 2.372 . . . . 0.0 110.392 -176.459 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 59.1 mt -87.19 129.08 39.23 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.78 0 O-C-N 121.118 -0.988 . . . . 0.0 109.716 -179.788 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -75.13 149.87 38.92 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 124.185 0.994 . . . . 0.0 111.74 178.14 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 18.8 t -68.93 99.87 1.12 Allowed 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 124.682 1.193 . . . . 0.0 113.061 -177.045 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 33.2 p90 -61.83 -38.0 86.55 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 115.071 -0.968 . . . . 0.0 110.229 175.064 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 70.0 m-20 -62.22 -44.28 96.93 Favored 'General case' 0 CA--C 1.537 0.452 0 O-C-N 121.755 -0.591 . . . . 0.0 110.612 176.962 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 41.6 t -63.94 -41.79 97.51 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-N 119.631 1.105 . . . . 0.0 111.509 177.516 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 31.3 mt -63.57 -40.53 97.21 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 123.774 0.83 . . . . 0.0 112.875 176.286 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 32.2 mmmt -82.87 -9.07 59.49 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 124.878 1.271 . . . . 0.0 113.845 179.589 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 80.84 38.18 17.01 Favored Glycine 0 CA--C 1.537 1.463 0 C-N-CA 124.722 1.154 . . . . 0.0 114.103 179.571 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 50.3 ttp180 -120.75 -19.47 7.35 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 126.631 1.972 . . . . 0.0 114.83 -176.525 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 4.8 t -69.23 148.67 49.51 Favored 'General case' 0 CA--C 1.546 0.796 0 CA-C-N 119.311 0.96 . . . . 0.0 113.562 -177.789 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 86.6 p -156.38 7.58 0.2 Allowed 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 126.777 2.031 . . . . 0.0 113.438 179.562 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 76.3 mtm-85 -68.93 161.25 29.2 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 126.01 1.724 . . . . 0.0 114.077 -178.076 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -117.81 -1.73 11.49 Favored 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 125.926 1.691 . . . . 0.0 112.081 176.016 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 14.8 m120 -142.92 39.19 1.47 Allowed 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 128.496 2.719 . . . . 0.0 109.49 179.161 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 7.9 t -54.11 126.49 22.96 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 124.777 1.231 . . . . 0.0 111.465 -177.968 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 25.7 mtmt -80.46 0.78 32.03 Favored 'General case' 0 N--CA 1.474 0.771 0 N-CA-C 114.007 1.114 . . . . 0.0 114.007 -177.532 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 80.8 m-85 -125.58 154.35 42.36 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 125.127 1.371 . . . . 0.0 111.394 -175.127 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -76.69 113.15 14.02 Favored 'General case' 0 CA--C 1.533 0.312 0 O-C-N 121.654 -0.654 . . . . 0.0 112.265 -176.258 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 8.3 m170 -64.49 127.08 91.9 Favored Pre-proline 0 CA--C 1.545 0.768 0 N-CA-C 106.892 -1.521 . . . . 0.0 106.892 172.48 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 89.7 Cg_endo -72.97 120.73 6.79 Favored 'Trans proline' 0 CA--C 1.546 1.075 0 C-N-CA 122.401 2.067 . . . . 0.0 114.06 -170.757 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 94.3 Cg_endo -77.05 153.41 32.31 Favored 'Trans proline' 0 CA--C 1.544 1.001 0 C-N-CA 123.206 2.604 . . . . 0.0 111.973 178.297 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_exo -46.27 -41.45 22.28 Favored 'Trans proline' 0 CA--C 1.538 0.706 0 C-N-CA 124.156 3.237 . . . . 0.0 115.753 179.449 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 57.3 m80 -72.4 -13.7 61.52 Favored 'General case' 0 N--CA 1.475 0.805 0 N-CA-C 115.181 1.548 . . . . 0.0 115.181 179.605 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 92.1 mt -114.13 -17.21 11.96 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 124.426 1.091 . . . . 0.0 112.949 177.565 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 56.0 mtpt -54.89 -38.91 68.16 Favored 'General case' 0 N--CA 1.478 0.944 0 CA-C-N 119.931 1.241 . . . . 0.0 111.85 174.944 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 4.7 m -63.02 -38.51 91.48 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 123.728 0.811 . . . . 0.0 111.777 176.753 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 92.5 mm-40 -69.95 -49.57 50.49 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 123.175 0.59 . . . . 0.0 109.721 177.638 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 95.4 mt -58.47 -47.04 85.37 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 124.134 0.974 . . . . 0.0 113.056 178.767 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -62.97 -32.25 73.54 Favored 'General case' 0 N--CA 1.475 0.811 0 CA-C-N 119.932 1.242 . . . . 0.0 112.444 178.759 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 57.0 mt -74.73 -42.58 47.63 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.584 0 C-N-CA 123.858 0.863 . . . . 0.0 110.269 175.783 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 26.5 m120 -60.64 -36.17 78.01 Favored 'General case' 0 CA--C 1.543 0.692 0 CA-C-N 119.406 1.003 . . . . 0.0 110.423 174.75 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -57.17 -26.98 57.0 Favored Glycine 0 CA--C 1.535 1.295 0 C-N-CA 125.18 1.371 . . . . 0.0 113.643 176.56 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -60.31 -27.13 67.06 Favored 'General case' 0 N--CA 1.479 0.985 0 CA-C-N 118.633 1.216 . . . . 0.0 112.124 175.774 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 8.8 t-20 -80.17 -1.7 41.52 Favored 'General case' 0 CA--C 1.554 1.108 0 C-N-CA 125.419 1.488 . . . . 0.0 113.022 175.789 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 39.8 t30 -130.85 8.37 4.83 Favored 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 126.157 1.783 . . . . 0.0 112.679 179.978 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 15.3 tp -75.88 37.77 0.15 Allowed 'General case' 0 CA--C 1.552 1.055 0 C-N-CA 126.353 1.861 . . . . 0.0 113.406 -178.86 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 43.3 pt -77.58 -2.84 4.95 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.944 0 C-N-CA 126.069 1.748 . . . . 0.0 113.928 -179.779 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 87.7 mt-30 -138.27 165.24 27.22 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 126.591 1.956 . . . . 0.0 110.983 178.694 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 8.5 pt20 -55.06 142.21 31.31 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 124.977 1.311 . . . . 0.0 113.954 -179.542 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.21 -2.84 26.54 Favored 'General case' 0 N--CA 1.483 1.188 0 N-CA-C 115.3 1.593 . . . . 0.0 115.3 179.122 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 59.1 t-20 . . . . . 0 CA--C 1.545 0.763 0 C-N-CA 127.996 2.519 . . . . 0.0 114.677 -179.183 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.6 mmt . . . . . 0 CA--C 1.545 0.751 0 N-CA-C 113.433 0.901 . . . . 0.0 113.433 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -151.32 170.95 18.27 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 126.175 1.79 . . . . 0.0 111.81 179.843 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 48.1 t -136.0 136.42 49.71 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.928 0 C-N-CA 125.46 1.504 . . . . 0.0 109.725 179.29 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 9.5 t -154.96 -174.45 4.99 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 125.736 1.614 . . . . 0.0 110.774 179.718 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 6.5 p -71.44 23.75 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.482 1.155 0 C-N-CA 127.715 2.406 . . . . 0.0 114.685 -179.83 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 27.3 p -59.91 154.67 47.34 Favored Pre-proline 0 N--CA 1.479 1.006 0 C-N-CA 126.275 1.83 . . . . 0.0 113.225 178.723 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 47.0 Cg_endo -63.47 140.18 74.55 Favored 'Trans proline' 0 CA--C 1.54 0.796 0 C-N-CA 122.715 2.276 . . . . 0.0 112.243 179.321 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 8.9 tp -156.07 166.72 0.93 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.829 0 C-N-CA 126.451 1.9 . . . . 0.0 110.131 -179.111 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 11.7 tpt85 -58.68 146.29 36.96 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 124.242 1.017 . . . . 0.0 111.434 178.136 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -51.31 -71.55 0.06 Allowed 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 126.553 1.941 . . . . 0.0 115.697 -174.636 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 73.8 p -147.77 4.28 0.75 Allowed 'General case' 0 N--CA 1.486 1.341 0 N-CA-C 115.535 1.68 . . . . 0.0 115.535 -174.196 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 49.8 tttm -45.08 -29.36 0.87 Allowed 'General case' 0 N--CA 1.484 1.226 0 N-CA-C 117.405 2.372 . . . . 0.0 117.405 -174.85 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 2.5 p90 -112.39 1.07 15.84 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 124.89 1.276 . . . . 0.0 114.308 -179.337 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 94.8 mt -105.03 -10.13 17.4 Favored 'General case' 0 CA--C 1.539 0.522 0 N-CA-C 116.269 1.952 . . . . 0.0 116.269 -172.263 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 4.0 m -75.01 79.7 2.2 Favored 'General case' 0 N--CA 1.479 1.015 0 CA-C-N 120.474 1.488 . . . . 0.0 112.208 -179.044 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -75.68 144.59 41.53 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 127.066 2.146 . . . . 0.0 112.41 -177.908 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 10.3 mt-10 -74.89 150.96 38.99 Favored 'General case' 0 N--CA 1.474 0.771 0 O-C-N 120.688 -1.258 . . . . 0.0 111.916 176.577 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 15.9 m -82.06 150.89 4.3 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.795 0 N-CA-C 109.816 -0.439 . . . . 0.0 109.816 174.362 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 53.5 t -63.82 130.7 45.23 Favored 'General case' 0 C--O 1.237 0.43 0 CA-C-O 122.552 1.168 . . . . 0.0 111.349 177.671 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 3.3 mpt_? -68.45 -25.3 64.93 Favored 'General case' 0 N--CA 1.465 0.296 0 C-N-CA 124.716 1.207 . . . . 0.0 112.244 -178.582 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -84.21 -37.61 21.6 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 123.125 0.57 . . . . 0.0 110.017 177.303 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 63.5 t80 -62.0 -31.24 71.6 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 124.823 1.249 . . . . 0.0 110.884 174.982 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 12.4 mm100 -62.98 -15.81 57.44 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 123.928 0.891 . . . . 0.0 113.294 175.264 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 6.2 mpt_? -120.32 13.4 11.91 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 126.605 1.962 . . . . 0.0 111.464 177.058 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 57.96 35.82 77.84 Favored Glycine 0 CA--C 1.533 1.197 0 C-N-CA 125.396 1.474 . . . . 0.0 114.375 179.888 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 6.4 t -131.13 11.04 5.0 Favored 'General case' 0 N--CA 1.477 0.91 0 N-CA-C 115.128 1.529 . . . . 0.0 115.128 -175.527 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 44.3 t -60.7 136.57 58.11 Favored 'General case' 0 CA--C 1.548 0.891 0 CA-C-N 119.091 0.86 . . . . 0.0 110.523 176.078 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 80.2 p -93.01 6.37 48.15 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 125.541 1.537 . . . . 0.0 114.394 -178.235 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 57.2 mtm-85 -129.64 151.49 78.14 Favored Pre-proline 0 N--CA 1.474 0.76 0 C-N-CA 125.253 1.421 . . . . 0.0 113.795 -173.946 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 95.1 Cg_endo -74.59 163.88 35.01 Favored 'Trans proline' 0 CA--C 1.542 0.88 0 C-N-CA 122.429 2.086 . . . . 0.0 109.419 172.338 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 -54.62 -28.11 44.29 Favored 'General case' 0 N--CA 1.475 0.821 0 N-CA-C 113.407 0.891 . . . . 0.0 113.407 176.477 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 22.1 p -73.85 -17.43 61.06 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 125.57 1.548 . . . . 0.0 115.126 178.948 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -115.65 -31.08 5.96 Favored 'General case' 0 N--CA 1.478 0.939 0 N-CA-C 114.295 1.22 . . . . 0.0 114.295 -179.277 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 4.7 t -56.77 147.11 23.91 Favored 'General case' 0 CA--C 1.545 0.756 0 CA-C-O 122.735 1.255 . . . . 0.0 113.887 -175.63 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 39.6 mmtm -81.88 4.83 20.92 Favored 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 126.475 1.91 . . . . 0.0 113.145 -177.706 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 75.6 m-85 -143.76 170.18 16.35 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 128.633 2.773 . . . . 0.0 108.631 175.913 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -84.24 153.53 23.55 Favored 'General case' 0 CA--C 1.547 0.863 0 N-CA-C 114.526 1.306 . . . . 0.0 114.526 -177.048 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 65.0 m170 -124.58 90.66 50.61 Favored Pre-proline 0 CA--C 1.55 0.943 0 C-N-CA 126.203 1.801 . . . . 0.0 110.361 178.048 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 34.7 Cg_endo -64.0 148.53 91.56 Favored 'Trans proline' 0 CA--C 1.539 0.754 0 C-N-CA 123.31 2.674 . . . . 0.0 114.483 -177.535 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 52.9 p -86.72 -175.88 5.58 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 125.114 1.366 . . . . 0.0 112.228 175.847 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 58.0 mtmt -60.72 -20.04 60.2 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 125.556 1.542 . . . . 0.0 113.472 173.645 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 49.1 m -109.11 -20.81 12.87 Favored 'General case' 0 N--CA 1.477 0.897 0 N-CA-C 114.436 1.273 . . . . 0.0 114.436 -179.594 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 84.5 m -63.94 134.87 55.89 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 119.498 1.044 . . . . 0.0 113.193 179.878 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 35.7 mt-30 -81.45 142.1 33.27 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 123.181 0.592 . . . . 0.0 111.253 176.669 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 11.8 t -132.34 138.16 52.87 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.865 0 C-N-CA 125.404 1.481 . . . . 0.0 110.573 -177.748 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -146.21 132.66 19.68 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 125.298 1.439 . . . . 0.0 111.391 178.194 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 62.5 t30 41.26 37.94 0.7 Allowed 'General case' 0 CA--C 1.553 1.073 0 C-N-CA 126.99 2.116 . . . . 0.0 116.578 177.16 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 87.77 13.73 64.32 Favored Glycine 0 CA--C 1.535 1.335 0 O-C-N 120.997 -1.064 . . . . 0.0 115.188 179.777 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 56.0 mtt180 -136.56 164.16 28.85 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 125.421 1.488 . . . . 0.0 111.432 179.39 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 5.2 m -134.34 176.81 8.0 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 C-N-CA 129.127 2.971 . . . . 0.0 107.493 179.623 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 59.1 mt -126.71 130.07 71.57 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.833 0 CA-C-N 119.78 1.173 . . . . 0.0 108.786 179.589 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -73.04 147.62 44.89 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 123.758 0.823 . . . . 0.0 111.931 177.873 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 13.9 t -69.75 99.37 1.34 Allowed 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 125.067 1.347 . . . . 0.0 113.35 -176.432 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 26.4 p90 -61.92 -37.94 86.56 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 115.191 -0.913 . . . . 0.0 110.013 174.34 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 70.3 m-20 -61.44 -43.09 99.47 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 123.099 0.559 . . . . 0.0 110.851 177.193 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 44.6 t -64.66 -43.23 94.26 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-N 119.506 1.048 . . . . 0.0 111.566 177.911 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 34.3 mt -65.39 -36.99 85.65 Favored 'General case' 0 CA--C 1.542 0.665 0 N-CA-C 113.378 0.881 . . . . 0.0 113.378 177.124 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 29.7 mmmt -88.17 -5.62 58.32 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 125.197 1.399 . . . . 0.0 114.509 -178.32 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 81.02 39.84 12.48 Favored Glycine 0 CA--C 1.536 1.38 0 C-N-CA 124.506 1.05 . . . . 0.0 114.384 178.221 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 71.9 ttt-85 -123.64 -21.52 5.21 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 126.546 1.939 . . . . 0.0 114.695 -176.63 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 5.5 t -73.06 136.29 44.96 Favored 'General case' 0 CA--C 1.545 0.765 0 CA-C-N 119.431 1.014 . . . . 0.0 113.387 -177.396 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 58.3 m -145.38 11.79 1.32 Allowed 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 127.12 2.168 . . . . 0.0 112.066 178.343 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 81.3 mtm-85 -70.24 160.01 32.96 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 125.888 1.675 . . . . 0.0 114.265 -177.608 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -114.16 -9.35 12.91 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 127.843 2.457 . . . . 0.0 112.507 177.731 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 10.8 m120 -142.47 41.09 1.6 Allowed 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 128.155 2.582 . . . . 0.0 109.857 -179.614 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 9.0 t -53.07 129.07 29.7 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 124.774 1.23 . . . . 0.0 111.607 -178.367 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 31.8 mtmt -84.17 2.33 40.21 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 124.62 1.168 . . . . 0.0 113.63 -177.87 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 84.4 m-85 -125.08 154.36 41.5 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 125.384 1.473 . . . . 0.0 111.908 -175.521 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -78.07 114.72 17.22 Favored 'General case' 0 N--CA 1.465 0.318 0 C-N-CA 123.989 0.915 . . . . 0.0 112.155 -176.619 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 11.0 m170 -70.2 115.17 31.73 Favored Pre-proline 0 CA--C 1.546 0.8 0 N-CA-C 108.094 -1.076 . . . . 0.0 108.094 174.654 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 81.1 Cg_exo -48.89 114.07 1.12 Allowed 'Trans proline' 0 CA--C 1.543 0.928 0 C-N-CA 124.621 3.547 . . . . 0.0 116.794 -174.757 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_endo -77.02 155.78 33.9 Favored 'Trans proline' 0 CA--C 1.546 1.114 0 C-N-CA 122.658 2.238 . . . . 0.0 111.479 175.965 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 92.9 Cg_exo -43.58 -45.79 10.44 Favored 'Trans proline' 0 CA--C 1.539 0.73 0 C-N-CA 124.861 3.707 . . . . 0.0 116.531 -179.777 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -73.53 -12.61 60.83 Favored 'General case' 0 N--CA 1.478 0.971 0 N-CA-C 114.676 1.362 . . . . 0.0 114.676 -179.431 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 87.0 mt -112.64 -19.56 12.02 Favored 'General case' 0 N--CA 1.475 0.789 0 CA-C-N 119.458 1.026 . . . . 0.0 113.71 -179.717 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 54.3 mtpt -52.69 -39.66 62.17 Favored 'General case' 0 N--CA 1.48 1.035 0 CA-C-N 119.908 1.231 . . . . 0.0 111.426 174.252 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 24.7 m -63.19 -41.59 99.21 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 124.781 1.232 . . . . 0.0 111.92 176.926 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 16.9 mm100 -68.57 -44.39 74.54 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 123.56 0.744 . . . . 0.0 110.521 179.206 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 81.0 mt -62.31 -46.63 87.89 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 123.376 0.67 . . . . 0.0 112.235 177.769 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -64.21 -29.78 70.87 Favored 'General case' 0 N--CA 1.476 0.854 0 CA-C-N 120.361 1.437 . . . . 0.0 113.106 178.147 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 63.9 mt -71.15 -44.88 73.77 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.69 0 O-C-N 121.354 -0.841 . . . . 0.0 109.242 174.854 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 75.7 m-20 -62.15 -36.72 82.68 Favored 'General case' 0 CA--C 1.542 0.639 0 O-C-N 121.644 -0.66 . . . . 0.0 110.955 175.773 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -61.01 -49.28 80.36 Favored Glycine 0 CA--C 1.529 0.93 0 C-N-CA 124.513 1.054 . . . . 0.0 111.494 177.95 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 82.6 mtt85 -57.81 -43.02 85.42 Favored 'General case' 0 N--CA 1.481 1.078 0 CA-C-N 118.063 0.931 . . . . 0.0 111.559 175.334 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 55.9 t30 -64.5 -7.73 11.2 Favored 'General case' 0 CA--C 1.553 1.071 0 C-N-CA 124.959 1.304 . . . . 0.0 114.027 177.271 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 61.1 m-80 -125.28 12.46 8.2 Favored 'General case' 0 CA--C 1.551 1.003 0 C-N-CA 126.507 1.923 . . . . 0.0 112.38 178.771 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 18.7 tp -130.48 21.76 5.15 Favored 'General case' 0 CA--C 1.55 0.971 0 C-N-CA 126.714 2.005 . . . . 0.0 111.082 179.549 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 75.2 mt -57.32 123.98 10.06 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.535 0 C-N-CA 126.814 2.045 . . . . 0.0 109.71 179.719 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 3.6 tp-100 -110.74 2.83 18.66 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 125.091 1.356 . . . . 0.0 114.057 -175.728 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 89.9 mm-40 -60.72 -9.89 4.61 Favored 'General case' 0 N--CA 1.477 0.897 0 N-CA-C 115.963 1.838 . . . . 0.0 115.963 -178.895 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 65.6 pttt -121.8 11.96 10.5 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 125.777 1.631 . . . . 0.0 114.397 -179.637 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 45.7 t30 . . . . . 0 CA--C 1.545 0.767 0 C-N-CA 124.793 1.237 . . . . 0.0 112.855 179.552 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.0 mmt . . . . . 0 CA--C 1.54 0.592 0 N-CA-C 113.485 0.92 . . . . 0.0 113.485 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -55.7 -10.73 0.76 Allowed 'General case' 0 CA--C 1.552 1.046 0 N-CA-C 116.276 1.954 . . . . 0.0 116.276 -179.341 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 8.2 p -127.63 8.68 3.28 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.976 0 C-N-CA 126.372 1.869 . . . . 0.0 112.329 179.166 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 37.0 m -133.35 -20.05 2.13 Favored 'General case' 0 N--CA 1.479 0.977 0 N-CA-C 114.881 1.438 . . . . 0.0 114.881 -178.031 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 9.3 p -66.32 145.04 14.15 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.892 0 C-N-CA 124.364 1.066 . . . . 0.0 112.063 179.0 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 41.5 p -143.23 151.21 54.65 Favored Pre-proline 0 N--CA 1.478 0.968 0 C-N-CA 125.741 1.616 . . . . 0.0 110.866 178.986 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 70.6 Cg_endo -78.97 -12.7 14.52 Favored 'Trans proline' 0 CA--C 1.542 0.896 0 C-N-CA 123.358 2.705 . . . . 0.0 115.176 -177.554 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 43.8 pt -77.83 176.53 0.66 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 C-N-CA 125.713 1.605 . . . . 0.0 113.635 -177.797 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 41.3 ptt180 -55.56 155.91 5.13 Favored 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 125.387 1.475 . . . . 0.0 113.225 177.832 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -145.49 145.5 31.09 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 124.263 1.025 . . . . 0.0 112.807 -177.528 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 28.9 p -134.41 -5.81 2.59 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 125.19 1.396 . . . . 0.0 113.129 174.613 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 24.5 pttm -64.58 -31.91 73.34 Favored 'General case' 0 N--CA 1.477 0.884 0 CA-C-N 120.695 1.588 . . . . 0.0 111.932 175.56 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -64.92 -31.33 72.51 Favored 'General case' 0 N--CA 1.476 0.858 0 CA-C-N 118.651 0.66 . . . . 0.0 111.29 172.397 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 92.5 mt -89.76 -8.45 52.17 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 126.615 1.966 . . . . 0.0 114.268 -179.146 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 18.2 m -81.15 80.52 7.59 Favored 'General case' 0 N--CA 1.475 0.781 0 CA-C-O 122.13 0.966 . . . . 0.0 110.477 -178.625 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -75.77 145.21 40.95 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 128.613 2.765 . . . . 0.0 111.983 -178.232 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 52.8 mt-10 -72.33 150.99 43.02 Favored 'General case' 0 N--CA 1.47 0.564 0 O-C-N 120.487 -1.383 . . . . 0.0 112.615 176.899 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 16.8 m -86.69 156.49 3.3 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.971 0 C-N-CA 123.506 0.723 . . . . 0.0 111.418 174.359 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 49.1 t -77.66 129.69 35.88 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-O 121.607 0.718 . . . . 0.0 110.649 177.238 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 4.2 mpt_? -66.64 -28.99 68.92 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 124.418 1.087 . . . . 0.0 113.247 -177.462 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -78.13 -40.21 38.83 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 123.443 0.697 . . . . 0.0 109.518 177.79 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 64.3 t80 -63.24 -35.07 79.11 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 124.486 1.115 . . . . 0.0 111.298 175.957 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 13.8 mm100 -62.12 -15.31 44.65 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 124.227 1.011 . . . . 0.0 113.38 175.424 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 11.8 mtp-105 -120.76 12.67 11.41 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 127.233 2.213 . . . . 0.0 112.28 179.569 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 57.99 34.69 73.15 Favored Glycine 0 CA--C 1.536 1.354 0 C-N-CA 125.086 1.327 . . . . 0.0 113.9 -179.771 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 7.3 t -129.88 13.36 5.8 Favored 'General case' 0 N--CA 1.475 0.801 0 N-CA-C 114.906 1.447 . . . . 0.0 114.906 -175.196 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 6.5 t -69.53 171.7 8.45 Favored 'General case' 0 CA--C 1.556 1.182 0 O-C-N 121.413 -0.804 . . . . 0.0 110.542 173.823 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 50.7 m -135.45 13.57 3.49 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 125.059 1.344 . . . . 0.0 114.457 -176.796 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 51.0 mtt85 -135.45 145.97 55.81 Favored Pre-proline 0 N--CA 1.47 0.553 0 C-N-CA 125.301 1.44 . . . . 0.0 112.756 -176.349 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_endo -69.69 165.34 31.21 Favored 'Trans proline' 0 CA--C 1.545 1.06 0 C-N-CA 121.943 1.762 . . . . 0.0 109.744 171.323 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -54.6 -30.25 54.09 Favored 'General case' 0 N--CA 1.477 0.91 0 O-C-N 121.124 -0.985 . . . . 0.0 112.678 177.882 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 29.9 p -72.37 -8.43 54.93 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 126.268 1.827 . . . . 0.0 115.135 177.792 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 27.0 mm-40 -124.61 -24.86 4.1 Favored 'General case' 0 N--CA 1.476 0.868 0 N-CA-C 115.53 1.678 . . . . 0.0 115.53 -175.993 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 1.4 t -73.45 170.33 15.34 Favored 'General case' 0 CA--C 1.545 0.753 0 N-CA-C 115.361 1.615 . . . . 0.0 115.361 -175.921 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 13.0 mmmm -85.24 -13.16 50.74 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 126.807 2.043 . . . . 0.0 113.285 -179.377 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 56.7 m-85 -140.02 174.86 10.09 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 126.761 2.025 . . . . 0.0 109.598 179.001 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -83.65 151.04 25.51 Favored 'General case' 0 CA--C 1.545 0.784 0 N-CA-C 114.177 1.177 . . . . 0.0 114.177 -177.034 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 64.2 m170 -121.86 87.27 46.59 Favored Pre-proline 0 CA--C 1.553 1.068 0 C-N-CA 126.158 1.783 . . . . 0.0 110.888 179.572 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 39.5 Cg_endo -64.4 150.54 88.08 Favored 'Trans proline' 0 CA--C 1.54 0.808 0 C-N-CA 123.568 2.845 . . . . 0.0 114.912 -177.797 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 53.4 p -88.01 -174.93 4.9 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 124.945 1.298 . . . . 0.0 111.985 175.578 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 63.0 mttp -62.01 -18.67 61.28 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 125.523 1.529 . . . . 0.0 113.368 173.421 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 25.1 m -109.12 -22.4 12.14 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.917 1.287 . . . . 0.0 114.153 -179.079 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 89.6 m -63.58 138.35 58.47 Favored 'General case' 0 CA--C 1.542 0.651 0 CA-C-N 119.394 0.997 . . . . 0.0 113.175 179.586 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 16.3 mt-30 -80.66 136.2 36.17 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 124.663 1.185 . . . . 0.0 111.466 179.004 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 9.2 t -129.75 136.25 59.49 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.816 0 C-N-CA 124.958 1.303 . . . . 0.0 110.913 -178.084 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -146.99 131.8 18.01 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 125.286 1.435 . . . . 0.0 111.79 178.185 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 62.5 t30 39.46 39.3 0.47 Allowed 'General case' 0 CA--C 1.554 1.106 0 C-N-CA 127.28 2.232 . . . . 0.0 116.863 176.63 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 90.58 11.55 62.11 Favored Glycine 0 CA--C 1.536 1.374 0 O-C-N 121.101 -1.0 . . . . 0.0 115.393 179.465 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 42.1 mtm180 -136.17 164.9 26.98 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 125.53 1.532 . . . . 0.0 112.358 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 5.2 m -137.2 151.21 26.64 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.642 0 C-N-CA 128.12 2.568 . . . . 0.0 109.135 -179.93 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 17.2 mt -100.5 130.68 49.38 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.78 0 O-C-N 121.191 -0.943 . . . . 0.0 110.181 -178.306 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -78.31 149.79 33.41 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 123.946 0.898 . . . . 0.0 111.99 178.637 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 19.2 t -71.79 99.21 2.12 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 125.242 1.417 . . . . 0.0 113.039 -176.362 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 24.3 p90 -60.88 -36.83 80.21 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 123.574 0.75 . . . . 0.0 110.514 174.76 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 73.6 m-20 -61.3 -38.24 86.1 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 123.397 0.679 . . . . 0.0 111.199 177.338 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 31.2 p -64.72 -41.37 96.02 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 119.5 1.045 . . . . 0.0 112.216 178.058 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 38.5 mt -69.7 -40.74 76.13 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 124.575 1.15 . . . . 0.0 112.04 177.613 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 30.9 mmmt -76.31 -11.87 59.98 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 124.464 1.106 . . . . 0.0 113.71 178.482 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 78.5 35.75 31.96 Favored Glycine 0 CA--C 1.537 1.457 0 C-N-CA 124.563 1.078 . . . . 0.0 113.43 -179.508 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 50.8 ttp180 -116.66 -19.85 9.8 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 126.623 1.969 . . . . 0.0 114.378 -176.67 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 5.1 t -67.92 140.85 56.48 Favored 'General case' 0 CA--C 1.545 0.784 0 CA-C-N 119.078 0.854 . . . . 0.0 112.949 -177.879 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 87.6 p -152.4 8.92 0.47 Allowed 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 126.709 2.004 . . . . 0.0 113.056 179.715 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 87.3 mtm-85 -67.84 163.37 22.02 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 126.393 1.877 . . . . 0.0 114.65 -178.216 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -125.38 8.55 7.8 Favored 'General case' 0 CA--C 1.553 1.095 0 C-N-CA 126.916 2.086 . . . . 0.0 110.526 173.64 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 35.6 p-10 -142.76 22.73 1.95 Allowed 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 129.311 3.045 . . . . 0.0 112.15 -177.843 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 4.2 t -49.54 120.01 3.85 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 125.228 1.411 . . . . 0.0 112.518 -175.723 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 33.8 mtmt -84.88 6.97 22.61 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 125.556 1.542 . . . . 0.0 113.636 -177.399 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 84.8 m-85 -129.14 151.88 49.33 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 125.192 1.397 . . . . 0.0 112.258 -174.589 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -77.2 118.61 19.88 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 123.723 0.809 . . . . 0.0 112.096 -176.992 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 11.2 m170 -71.4 115.91 41.96 Favored Pre-proline 0 CA--C 1.548 0.876 0 N-CA-C 108.045 -1.094 . . . . 0.0 108.045 174.381 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_exo -47.3 112.18 0.5 Allowed 'Trans proline' 0 CA--C 1.543 0.969 0 C-N-CA 125.015 3.81 . . . . 0.0 115.507 -176.231 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -75.68 148.82 33.19 Favored 'Trans proline' 0 CA--C 1.542 0.887 0 C-N-CA 122.052 1.835 . . . . 0.0 110.366 176.866 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_exo -47.32 -37.64 25.1 Favored 'Trans proline' 0 CA--C 1.539 0.748 0 C-N-CA 123.723 2.949 . . . . 0.0 115.193 179.433 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 6.8 t-80 -72.04 -16.94 62.05 Favored 'General case' 0 N--CA 1.472 0.659 0 N-CA-C 115.177 1.547 . . . . 0.0 115.177 179.778 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 90.9 mt -115.22 -15.78 11.6 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 124.735 1.214 . . . . 0.0 112.898 177.791 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 52.9 mtpt -53.98 -34.36 59.58 Favored 'General case' 0 N--CA 1.475 0.78 0 CA-C-N 119.662 1.119 . . . . 0.0 111.384 174.37 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 27.5 m -61.82 -47.13 86.47 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-N 118.723 0.692 . . . . 0.0 111.462 175.381 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 93.3 mm-40 -66.23 -43.56 86.28 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 123.772 0.829 . . . . 0.0 111.316 178.04 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 76.3 mt -62.53 -45.49 92.75 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 123.896 0.879 . . . . 0.0 111.984 178.085 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 5.3 pt-20 -66.11 -36.48 83.27 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-N 119.459 1.027 . . . . 0.0 112.153 177.859 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 51.2 mt -61.11 -39.84 83.75 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 CA-C-N 119.509 1.05 . . . . 0.0 110.386 177.193 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 29.4 m-80 -70.76 -43.5 68.66 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 123.216 0.606 . . . . 0.0 111.4 175.436 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -66.14 -40.82 95.12 Favored Glycine 0 CA--C 1.533 1.179 0 C-N-CA 124.242 0.925 . . . . 0.0 113.71 -179.665 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 53.2 mtp180 -60.9 -17.18 49.22 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 125.742 1.617 . . . . 0.0 113.47 176.586 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 63.9 t30 -107.92 14.13 25.6 Favored 'General case' 0 CA--C 1.554 1.108 0 C-N-CA 125.881 1.672 . . . . 0.0 111.96 177.578 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 25.2 t-20 -136.63 -35.87 0.72 Allowed 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 125.811 1.644 . . . . 0.0 113.863 -176.15 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 87.5 mt -74.33 62.26 0.95 Allowed 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 127.029 2.132 . . . . 0.0 112.678 179.708 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 25.2 pt -135.82 144.41 33.62 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.62 0 C-N-CA 126.645 1.978 . . . . 0.0 110.681 -179.411 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -158.63 159.51 35.49 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 125.248 1.419 . . . . 0.0 112.029 -178.108 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 87.5 mt-30 -60.77 -24.74 65.99 Favored 'General case' 0 N--CA 1.478 0.955 0 N-CA-C 113.816 1.043 . . . . 0.0 113.816 179.222 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 75.2 mmtt -81.01 7.28 11.15 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 126.168 1.787 . . . . 0.0 113.732 178.329 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 49.6 t-20 . . . . . 0 CA--C 1.542 0.649 0 C-N-CA 125.879 1.671 . . . . 0.0 112.446 -176.056 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 95.5 mmm . . . . . 0 CA--C 1.542 0.67 0 N-CA-C 113.339 0.866 . . . . 0.0 113.339 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -57.56 -24.91 58.8 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 125.008 1.323 . . . . 0.0 114.217 -179.896 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 7.8 p -62.78 -22.86 31.32 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 C-N-CA 125.013 1.325 . . . . 0.0 113.632 178.339 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 50.1 m -71.34 -7.82 49.66 Favored 'General case' 0 N--CA 1.475 0.783 0 N-CA-C 116.12 1.896 . . . . 0.0 116.12 -178.073 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 35.0 m -64.34 156.49 5.42 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.156 0 CA-C-N 119.89 1.223 . . . . 0.0 113.12 179.406 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 7.4 p -68.72 150.73 97.56 Favored Pre-proline 0 N--CA 1.475 0.817 0 C-N-CA 124.178 0.991 . . . . 0.0 112.506 177.516 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 93.0 Cg_endo -74.79 166.14 29.94 Favored 'Trans proline' 0 CA--C 1.541 0.87 0 C-N-CA 123.301 2.667 . . . . 0.0 112.549 179.08 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 44.7 pt -107.77 10.15 9.17 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.121 0 C-N-CA 125.292 1.437 . . . . 0.0 113.02 178.828 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 33.9 ttm180 -60.87 -22.58 64.42 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 126.359 1.864 . . . . 0.0 113.93 179.236 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 55.5 t0 -73.52 68.34 1.15 Allowed 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 125.887 1.675 . . . . 0.0 112.594 178.76 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 22.3 p -64.49 0.37 1.08 Allowed 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 126.181 1.792 . . . . 0.0 115.138 -179.737 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 1.6 ttmp? -47.7 -42.71 25.66 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 125.704 1.601 . . . . 0.0 112.668 178.377 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -72.86 -27.88 62.18 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 124.359 1.064 . . . . 0.0 113.814 179.686 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 82.6 mt -91.77 -16.6 26.6 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 127.021 2.128 . . . . 0.0 114.994 -176.998 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 7.0 m -77.41 77.14 3.94 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 124.314 1.046 . . . . 0.0 111.543 -177.096 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.442 HD21 HD13 ' A' ' 75' ' ' LEU . 13.0 tp -75.62 143.76 42.11 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 128.757 2.823 . . . . 0.0 112.007 -178.375 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 10.1 mt-10 -73.32 150.5 41.85 Favored 'General case' 0 N--CA 1.474 0.743 0 O-C-N 120.448 -1.407 . . . . 0.0 112.886 178.788 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 16.0 m -84.48 154.66 3.62 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.838 0 C-N-CA 122.805 0.442 . . . . 0.0 111.673 176.256 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 44.8 t -74.98 131.02 40.35 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-O 121.192 0.52 . . . . 0.0 109.829 175.316 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 4.5 mpt_? -68.29 -37.34 80.55 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 125.623 1.569 . . . . 0.0 112.976 -176.836 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 15.9 mm-40 -76.65 -33.54 58.31 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 123.848 0.859 . . . . 0.0 111.151 179.334 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 78.3 t80 -63.3 -27.79 69.57 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 123.964 0.906 . . . . 0.0 111.287 174.923 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 52.9 mm-40 -63.59 -19.6 64.97 Favored 'General case' 0 N--CA 1.476 0.858 0 N-CA-C 112.855 0.687 . . . . 0.0 112.855 175.307 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 6.7 mpt_? -111.85 10.67 20.76 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 126.404 1.882 . . . . 0.0 111.645 177.008 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 58.05 36.34 80.97 Favored Glycine 0 CA--C 1.534 1.26 0 C-N-CA 125.542 1.544 . . . . 0.0 114.216 -179.879 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 6.1 t -132.54 13.46 4.51 Favored 'General case' 0 N--CA 1.479 0.983 0 N-CA-C 115.143 1.534 . . . . 0.0 115.143 -175.031 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 39.6 t -59.9 131.77 51.88 Favored 'General case' 0 CA--C 1.55 0.967 0 O-C-N 121.379 -0.825 . . . . 0.0 111.157 176.984 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 21.8 m -73.95 1.89 9.81 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 125.985 1.714 . . . . 0.0 115.217 -177.347 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 63.4 mtm-85 -132.49 148.67 70.55 Favored Pre-proline 0 N--CA 1.474 0.75 0 C-N-CA 125.657 1.583 . . . . 0.0 112.867 -175.466 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -67.81 162.21 40.54 Favored 'Trans proline' 0 CA--C 1.542 0.923 0 C-N-CA 121.92 1.747 . . . . 0.0 109.425 171.674 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 17.2 m-20 -53.45 -25.44 16.1 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 125.025 1.33 . . . . 0.0 114.205 -177.437 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 16.8 p -83.84 -12.75 55.12 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 127.342 2.257 . . . . 0.0 115.317 178.855 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 16.2 mt-10 -111.5 -22.77 11.1 Favored 'General case' 0 N--CA 1.478 0.943 0 N-CA-C 115.291 1.589 . . . . 0.0 115.291 -176.835 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 3.8 t -66.92 164.85 16.63 Favored 'General case' 0 CA--C 1.545 0.769 0 N-CA-C 114.059 1.133 . . . . 0.0 114.059 -178.571 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 44.1 mmtm -100.58 6.66 44.22 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 126.541 1.937 . . . . 0.0 113.6 -176.94 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 51.9 m-85 -141.3 167.57 21.86 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 127.64 2.376 . . . . 0.0 108.448 173.503 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -80.08 148.04 31.19 Favored 'General case' 0 CA--C 1.544 0.75 0 O-C-N 120.94 -1.1 . . . . 0.0 113.584 -176.372 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 20.6 m170 -120.27 87.86 40.79 Favored Pre-proline 0 CA--C 1.554 1.097 0 C-N-CA 125.79 1.636 . . . . 0.0 110.563 -179.366 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -59.67 146.08 96.35 Favored 'Trans proline' 0 C--N 1.354 0.863 0 C-N-CA 123.442 2.761 . . . . 0.0 114.871 -178.032 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 48.1 p -82.86 -178.78 7.23 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 124.305 1.042 . . . . 0.0 112.474 175.942 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -59.8 -19.85 53.19 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 125.698 1.599 . . . . 0.0 113.599 173.934 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 51.8 m -109.23 -15.59 14.25 Favored 'General case' 0 N--CA 1.476 0.828 0 N-CA-C 114.888 1.44 . . . . 0.0 114.888 -179.259 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 78.8 m -65.67 159.52 24.76 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-N 119.896 1.225 . . . . 0.0 114.046 179.459 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 41.1 mt-30 -119.37 140.81 49.76 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 125.257 1.423 . . . . 0.0 111.063 178.15 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 1.1 m -131.79 149.87 33.29 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.576 0 C-N-CA 125.118 1.367 . . . . 0.0 112.546 -177.388 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 -144.59 139.13 27.92 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 125.929 1.692 . . . . 0.0 110.455 176.445 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 89.4 m-20 45.54 34.83 1.77 Allowed 'General case' 0 CA--C 1.554 1.124 0 N-CA-C 115.464 1.653 . . . . 0.0 115.464 176.18 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 81.07 19.81 66.41 Favored Glycine 0 CA--C 1.536 1.359 0 C-N-CA 124.243 0.925 . . . . 0.0 114.781 -179.363 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 44.3 mtt180 -137.33 160.83 37.94 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 125.145 1.378 . . . . 0.0 112.311 -179.067 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 3.3 m -137.41 142.63 36.39 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.648 0 C-N-CA 127.817 2.447 . . . . 0.0 109.972 -177.075 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 43.4 mt -91.26 126.34 43.94 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.567 0 O-C-N 121.386 -0.821 . . . . 0.0 109.871 -178.504 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -70.05 146.15 51.19 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 123.954 0.901 . . . . 0.0 111.334 177.689 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 29.4 t -67.08 100.22 0.74 Allowed 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 124.675 1.19 . . . . 0.0 112.244 -178.122 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 32.9 p90 -61.3 -37.8 84.51 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 115.017 -0.992 . . . . 0.0 110.017 175.557 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 70.9 m-20 -61.89 -44.63 96.41 Favored 'General case' 0 CA--C 1.539 0.55 0 O-C-N 121.8 -0.562 . . . . 0.0 110.475 176.746 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 43.3 t -63.57 -46.11 87.36 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 119.748 1.158 . . . . 0.0 111.247 177.763 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 34.4 mt -61.16 -40.75 95.02 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 124.059 0.944 . . . . 0.0 113.42 176.759 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 31.3 mmmt -81.23 -12.88 59.01 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 124.78 1.232 . . . . 0.0 113.746 179.297 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 85.66 38.08 9.07 Favored Glycine 0 CA--C 1.539 1.539 0 C-N-CA 124.681 1.134 . . . . 0.0 114.336 179.438 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 47.8 ttp180 -121.86 -20.76 6.28 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 126.716 2.006 . . . . 0.0 114.764 -176.705 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 5.0 t -68.43 147.25 52.32 Favored 'General case' 0 CA--C 1.544 0.742 0 CA-C-N 119.442 1.019 . . . . 0.0 113.349 -177.835 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 86.1 p -154.49 7.6 0.31 Allowed 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 126.738 2.015 . . . . 0.0 113.146 179.559 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 76.8 mtm-85 -69.56 161.71 29.02 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 126.126 1.77 . . . . 0.0 113.74 -178.451 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -119.46 -0.26 10.92 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 125.884 1.674 . . . . 0.0 112.136 176.219 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 17.8 m120 -143.54 37.06 1.33 Allowed 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 128.217 2.607 . . . . 0.0 109.831 179.28 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 7.8 t -54.0 128.71 31.57 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 125.049 1.339 . . . . 0.0 111.272 -178.42 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 27.0 mtmt -83.47 0.83 44.62 Favored 'General case' 0 N--CA 1.477 0.899 0 N-CA-C 113.731 1.011 . . . . 0.0 113.731 -177.856 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 84.7 m-85 -122.82 154.0 38.81 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 125.203 1.401 . . . . 0.0 111.438 -175.778 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -75.56 112.32 11.78 Favored 'General case' 0 CA--C 1.531 0.242 0 N-CA-C 113.513 0.931 . . . . 0.0 113.513 -175.548 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 12.0 m170 -69.05 117.36 51.04 Favored Pre-proline 0 CA--C 1.545 0.777 0 N-CA-C 105.111 -2.181 . . . . 0.0 105.111 169.972 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -71.41 132.51 20.84 Favored 'Trans proline' 0 CA--C 1.541 0.849 0 C-N-CA 121.821 1.68 . . . . 0.0 114.719 -169.948 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 86.7 Cg_endo -77.16 153.88 32.24 Favored 'Trans proline' 0 CA--C 1.544 0.979 0 C-N-CA 123.39 2.727 . . . . 0.0 111.501 178.18 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 98.6 Cg_exo -44.81 -39.96 14.25 Favored 'Trans proline' 0 CA--C 1.539 0.771 0 C-N-CA 124.561 3.507 . . . . 0.0 116.11 179.902 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 72.7 m80 -73.4 -14.38 61.26 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 115.138 1.533 . . . . 0.0 115.138 179.796 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.442 HD13 HD21 ' A' ' 16' ' ' LEU . 92.8 mt -116.04 -16.29 11.07 Favored 'General case' 0 N--CA 1.474 0.725 0 C-N-CA 124.817 1.247 . . . . 0.0 113.383 179.814 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 61.2 mtpt -54.5 -36.68 64.45 Favored 'General case' 0 N--CA 1.48 1.033 0 CA-C-N 119.572 1.078 . . . . 0.0 111.11 172.569 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 19.6 m -63.97 -42.73 97.16 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 124.644 1.178 . . . . 0.0 111.65 176.211 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 89.9 mm-40 -66.85 -43.73 82.85 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 123.543 0.737 . . . . 0.0 110.51 178.827 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 93.8 mt -63.32 -43.46 97.73 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-O 118.405 -0.807 . . . . 0.0 112.401 177.378 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -65.81 -35.81 81.73 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-N 120.339 1.427 . . . . 0.0 111.827 176.58 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 66.7 mt -62.48 -42.48 95.87 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.845 0 CA-C-N 119.034 0.834 . . . . 0.0 109.677 175.25 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 82.4 m-20 -63.92 -44.49 92.74 Favored 'General case' 0 CA--C 1.544 0.743 0 O-C-N 121.658 -0.651 . . . . 0.0 110.537 174.927 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -59.76 -45.61 95.46 Favored Glycine 0 CA--C 1.528 0.865 0 C-N-CA 125.328 1.442 . . . . 0.0 112.452 179.294 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 86.6 mtt-85 -58.42 -19.24 34.58 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 125.177 1.391 . . . . 0.0 113.389 175.843 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 53.9 m-80 -103.86 6.19 36.34 Favored 'General case' 0 CA--C 1.551 1.017 0 C-N-CA 125.976 1.711 . . . . 0.0 113.279 178.501 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 35.4 m-80 -129.88 -36.73 1.56 Allowed 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 125.374 1.47 . . . . 0.0 112.525 178.848 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 61.5 tp -59.09 -30.26 67.96 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 125.625 1.57 . . . . 0.0 112.525 177.482 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 1.6 pp -57.14 -7.08 0.49 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.878 0 C-N-CA 126.93 2.092 . . . . 0.0 115.648 178.475 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 39.3 mt-30 -67.21 -13.77 62.28 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 124.489 1.115 . . . . 0.0 113.1 176.348 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -73.4 -13.02 61.01 Favored 'General case' 0 CA--C 1.548 0.883 0 N-CA-C 114.142 1.164 . . . . 0.0 114.142 178.234 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 67.4 mttm -60.76 156.2 17.58 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 125.448 1.499 . . . . 0.0 112.864 178.625 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 43.5 t30 . . . . . 0 CA--C 1.542 0.666 0 C-N-CA 125.33 1.452 . . . . 0.0 111.468 179.413 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.7 mpp? . . . . . 0 CA--C 1.546 0.789 0 N-CA-C 113.198 0.814 . . . . 0.0 113.198 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -150.25 166.98 28.27 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 126.025 1.73 . . . . 0.0 111.993 179.65 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 28.2 m -140.16 163.17 24.15 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.998 0 C-N-CA 125.952 1.701 . . . . 0.0 111.594 179.542 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 40.6 m -144.24 163.71 32.86 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 125.268 1.427 . . . . 0.0 111.874 -179.682 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 30.8 m -139.62 164.34 24.07 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.023 0 C-N-CA 126.041 1.737 . . . . 0.0 111.17 179.08 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 12.4 p -62.71 125.63 86.73 Favored Pre-proline 0 N--CA 1.477 0.879 0 C-N-CA 124.1 0.96 . . . . 0.0 112.064 179.178 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 96.4 Cg_endo -76.44 166.99 26.49 Favored 'Trans proline' 0 CA--C 1.542 0.875 0 C-N-CA 123.336 2.691 . . . . 0.0 112.847 -179.978 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 47.4 pt -126.0 -2.11 4.96 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.099 0 C-N-CA 125.259 1.423 . . . . 0.0 113.547 178.825 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 32.2 ttt85 -49.27 -36.61 21.1 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 125.796 1.638 . . . . 0.0 113.856 -178.515 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 -67.57 -17.93 64.82 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 126.187 1.795 . . . . 0.0 115.084 -179.842 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 68.9 p -134.53 -10.36 2.46 Favored 'General case' 0 N--CA 1.481 1.1 0 N-CA-C 115.25 1.574 . . . . 0.0 115.25 -178.482 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 86.3 tttt -51.95 -28.7 17.53 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 125.055 1.342 . . . . 0.0 114.338 178.947 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -96.25 -6.93 36.86 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 125.403 1.481 . . . . 0.0 113.982 177.814 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 65.4 mt -98.44 -11.92 21.88 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 126.344 1.858 . . . . 0.0 115.454 -175.479 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 4.8 m -77.09 75.66 3.66 Favored 'General case' 0 N--CA 1.478 0.944 0 CA-C-O 122.366 1.079 . . . . 0.0 110.949 -179.788 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.523 HD21 HD13 ' A' ' 75' ' ' LEU . 12.2 tp -75.98 143.24 41.64 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 128.027 2.531 . . . . 0.0 112.455 -177.757 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -68.44 148.78 50.14 Favored 'General case' 0 N--CA 1.474 0.755 0 O-C-N 120.729 -1.232 . . . . 0.0 112.255 177.578 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 20.9 m -82.68 149.95 4.48 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.827 0 C-N-CA 122.927 0.491 . . . . 0.0 110.286 173.142 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . 0.46 ' HB2' ' CE1' ' A' ' 38' ' ' HIS . 48.1 t -67.31 123.4 20.24 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-O 122.352 1.073 . . . . 0.0 111.463 178.071 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 2.7 mpt_? -64.39 -28.74 69.89 Favored 'General case' 0 N--CA 1.467 0.41 0 C-N-CA 124.965 1.306 . . . . 0.0 113.372 -175.903 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 11.5 mm-40 -82.93 -38.87 22.2 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 123.18 0.592 . . . . 0.0 110.138 177.839 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 81.1 t80 -61.65 -31.98 72.12 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 124.669 1.188 . . . . 0.0 111.042 174.772 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 12.6 mm100 -61.56 -16.86 51.81 Favored 'General case' 0 CA--C 1.545 0.771 0 N-CA-C 113.429 0.9 . . . . 0.0 113.429 175.698 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 5.6 mpt_? -121.69 14.04 10.88 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 126.338 1.855 . . . . 0.0 111.727 177.737 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 58.61 36.1 83.9 Favored Glycine 0 CA--C 1.535 1.289 0 C-N-CA 125.16 1.362 . . . . 0.0 114.183 -179.984 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 6.9 t -128.63 16.73 6.42 Favored 'General case' 0 N--CA 1.477 0.896 0 N-CA-C 114.489 1.292 . . . . 0.0 114.489 -176.005 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 9.1 t -67.31 173.98 3.58 Favored 'General case' 0 CA--C 1.558 1.264 0 O-C-N 121.633 -0.667 . . . . 0.0 110.858 173.985 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 90.7 p -136.24 9.43 3.22 Favored 'General case' 0 N--CA 1.477 0.902 0 N-CA-C 115.359 1.614 . . . . 0.0 115.359 -176.241 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 65.6 mtm-85 -132.69 153.61 81.16 Favored Pre-proline 0 N--CA 1.475 0.793 0 C-N-CA 125.941 1.696 . . . . 0.0 112.13 -178.449 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_endo -73.51 161.81 41.45 Favored 'Trans proline' 0 CA--C 1.541 0.827 0 C-N-CA 122.0 1.8 . . . . 0.0 109.109 173.109 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 -53.9 -28.44 36.55 Favored 'General case' 0 N--CA 1.473 0.709 0 N-CA-C 113.241 0.83 . . . . 0.0 113.241 177.69 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 27.2 p -72.1 -20.16 61.69 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 125.933 1.693 . . . . 0.0 115.069 178.887 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -114.84 -30.7 6.35 Favored 'General case' 0 N--CA 1.477 0.892 0 N-CA-C 114.295 1.221 . . . . 0.0 114.295 -178.014 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . 0.433 ' HB3' ' CE1' ' A' ' 38' ' ' HIS . 3.1 t -59.04 158.1 9.11 Favored 'General case' 0 CA--C 1.549 0.905 0 N-CA-C 114.675 1.361 . . . . 0.0 114.675 -175.654 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 36.7 mmtm -86.89 -0.31 56.28 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 126.773 2.029 . . . . 0.0 115.102 -173.095 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 75.3 m-85 -144.29 168.41 20.15 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 127.015 2.126 . . . . 0.0 109.388 175.692 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -73.7 150.69 41.06 Favored 'General case' 0 CA--C 1.548 0.871 0 O-C-N 120.414 -1.428 . . . . 0.0 113.842 -177.052 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . 0.46 ' CE1' ' HB2' ' A' ' 19' ' ' CYS . 7.1 m80 -127.33 84.16 64.15 Favored Pre-proline 0 CA--C 1.55 0.945 0 C-N-CA 125.451 1.5 . . . . 0.0 110.782 -177.415 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 35.2 Cg_endo -63.87 150.44 88.41 Favored 'Trans proline' 0 C--N 1.353 0.779 0 C-N-CA 123.636 2.891 . . . . 0.0 115.146 -177.078 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 54.1 p -89.35 -176.25 5.01 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 125.109 1.363 . . . . 0.0 111.695 174.536 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 60.9 mtpt -59.6 -21.9 61.05 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 125.516 1.526 . . . . 0.0 113.605 174.274 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 40.0 m -109.14 -16.13 14.16 Favored 'General case' 0 N--CA 1.477 0.923 0 N-CA-C 114.716 1.376 . . . . 0.0 114.716 -179.346 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 92.3 m -64.88 136.28 56.68 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-N 119.465 1.03 . . . . 0.0 112.218 179.462 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 42.0 tt0 -81.53 126.3 31.52 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 124.669 1.188 . . . . 0.0 110.502 179.165 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 18.7 t -119.75 134.65 62.59 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.941 0 C-N-CA 125.927 1.691 . . . . 0.0 109.688 -178.37 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -144.06 130.17 19.61 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 125.128 1.371 . . . . 0.0 111.331 -179.057 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 61.9 t30 42.75 37.01 0.93 Allowed 'General case' 0 CA--C 1.553 1.082 0 C-N-CA 126.989 2.115 . . . . 0.0 116.526 177.885 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 88.1 14.35 62.62 Favored Glycine 0 CA--C 1.536 1.35 0 O-C-N 121.103 -0.998 . . . . 0.0 114.929 179.653 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 31.1 mtt180 -138.52 167.56 21.67 Favored 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 126.101 1.76 . . . . 0.0 111.95 -179.57 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 4.4 m -140.03 146.56 24.71 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.571 0 C-N-CA 127.119 2.167 . . . . 0.0 108.911 -179.892 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 26.1 mt -95.72 127.98 47.3 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.814 0 O-C-N 121.108 -0.995 . . . . 0.0 109.611 -179.071 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -73.27 151.66 41.28 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 123.462 0.705 . . . . 0.0 111.683 177.44 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 13.2 t -73.46 98.87 2.85 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 124.421 1.089 . . . . 0.0 113.064 -176.881 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 30.0 p90 -61.66 -38.22 86.95 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 123.942 0.897 . . . . 0.0 110.139 174.843 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 66.1 m-20 -61.08 -42.38 98.39 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 123.011 0.524 . . . . 0.0 110.509 176.978 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 47.6 t -64.4 -42.37 96.14 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-N 119.519 1.054 . . . . 0.0 111.441 177.425 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 31.0 mt -63.73 -40.38 96.59 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 123.763 0.825 . . . . 0.0 112.921 176.399 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 31.4 mmmt -81.35 -9.46 59.74 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 124.763 1.225 . . . . 0.0 114.017 179.486 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 79.41 37.16 24.86 Favored Glycine 0 CA--C 1.536 1.4 0 C-N-CA 124.477 1.037 . . . . 0.0 113.525 -179.644 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 72.8 ttt-85 -117.19 -24.02 7.66 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 127.163 2.185 . . . . 0.0 113.966 -176.826 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 5.8 t -67.4 139.96 57.16 Favored 'General case' 0 CA--C 1.544 0.716 0 CA-C-O 121.768 0.794 . . . . 0.0 112.734 -177.92 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 7.3 t -152.73 14.94 0.56 Allowed 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 126.407 1.883 . . . . 0.0 111.938 179.149 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 74.4 mtm-85 -73.4 162.59 29.14 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 125.903 1.681 . . . . 0.0 113.007 -178.865 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -120.53 1.15 10.61 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 125.513 1.525 . . . . 0.0 112.515 177.048 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 68.3 m-80 -143.32 29.14 1.45 Allowed 'General case' 0 CA--C 1.552 1.022 0 C-N-CA 127.613 2.365 . . . . 0.0 110.772 -179.504 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 7.4 t -52.11 125.6 16.14 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 126.087 1.755 . . . . 0.0 111.876 -177.542 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 30.4 mtmt -85.25 1.28 48.92 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 124.578 1.151 . . . . 0.0 113.308 -178.558 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 87.3 m-85 -115.13 147.65 39.98 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 124.191 0.997 . . . . 0.0 111.469 -175.402 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -73.42 112.79 9.82 Favored 'General case' 0 N--CA 1.465 0.287 0 C-N-CA 123.473 0.709 . . . . 0.0 111.9 -176.18 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 12.1 m170 -68.71 114.02 19.74 Favored Pre-proline 0 CA--C 1.547 0.831 0 N-CA-C 107.487 -1.301 . . . . 0.0 107.487 174.285 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 67.7 Cg_exo -47.93 112.56 0.59 Allowed 'Trans proline' 0 CA--C 1.543 0.943 0 C-N-CA 124.842 3.694 . . . . 0.0 117.153 -173.691 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -76.69 153.55 34.03 Favored 'Trans proline' 0 CA--C 1.547 1.149 0 C-N-CA 122.068 1.845 . . . . 0.0 111.734 176.215 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 81.4 Cg_exo -42.27 -49.52 6.02 Favored 'Trans proline' 0 CA--C 1.539 0.73 0 C-N-CA 125.046 3.831 . . . . 0.0 116.823 -179.059 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 1.7 t60 -66.8 -29.94 70.01 Favored 'General case' 0 N--CA 1.478 0.954 0 N-CA-C 113.585 0.957 . . . . 0.0 113.585 -179.393 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.523 HD13 HD21 ' A' ' 16' ' ' LEU . 85.5 mt -93.64 -21.35 19.44 Favored 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 114.026 1.121 . . . . 0.0 114.026 -178.058 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 54.1 mtpt -53.5 -38.87 64.12 Favored 'General case' 0 N--CA 1.48 1.037 0 CA-C-N 120.204 1.366 . . . . 0.0 111.611 175.397 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 29.7 m -62.73 -43.98 97.4 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 124.937 1.295 . . . . 0.0 111.561 175.855 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 94.5 mm-40 -66.21 -43.04 87.86 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 123.622 0.769 . . . . 0.0 110.933 178.33 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 88.1 mt -62.02 -50.44 72.02 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 123.876 0.87 . . . . 0.0 111.554 177.632 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -62.61 -28.85 70.18 Favored 'General case' 0 N--CA 1.476 0.843 0 CA-C-N 120.025 1.284 . . . . 0.0 113.489 178.919 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 61.2 mt -70.23 -43.59 78.53 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.727 0 C-N-CA 123.723 0.809 . . . . 0.0 109.743 174.892 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 24.8 m-80 -66.2 -35.97 81.84 Favored 'General case' 0 CA--C 1.542 0.647 0 O-C-N 121.352 -0.842 . . . . 0.0 110.958 175.453 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -59.68 -46.13 94.53 Favored Glycine 0 CA--C 1.532 1.109 0 C-N-CA 124.487 1.041 . . . . 0.0 112.158 177.247 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 80.2 mtt85 -61.2 -18.2 57.01 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 124.25 1.02 . . . . 0.0 113.53 174.576 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 51.9 m-80 -104.72 11.18 34.28 Favored 'General case' 0 CA--C 1.551 0.991 0 C-N-CA 126.136 1.774 . . . . 0.0 112.428 178.32 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 21.9 t30 -127.77 -48.54 1.38 Allowed 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 125.817 1.647 . . . . 0.0 112.511 -179.58 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 94.6 mt -61.58 -16.38 47.49 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 124.308 1.043 . . . . 0.0 113.551 179.673 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 36.2 pt -83.73 -15.87 11.2 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.76 0 C-N-CA 127.514 2.326 . . . . 0.0 114.627 177.712 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 43.2 tt0 -68.25 109.09 3.43 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 124.046 0.938 . . . . 0.0 113.124 -175.114 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 4.2 tm0? -68.73 -32.04 71.53 Favored 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 123.845 0.858 . . . . 0.0 113.177 -178.848 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -141.21 123.9 16.05 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 126.161 1.784 . . . . 0.0 110.302 178.411 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 59.1 t30 . . . . . 0 CA--C 1.544 0.735 0 C-N-CA 124.216 1.006 . . . . 0.0 112.567 -179.227 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.3 mpt? . . . . . 0 CA--C 1.546 0.813 0 N-CA-C 113.194 0.812 . . . . 0.0 113.194 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -149.97 166.38 29.82 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 125.99 1.716 . . . . 0.0 112.08 179.606 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 6.5 m -141.0 148.45 21.56 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.98 0 C-N-CA 126.03 1.732 . . . . 0.0 111.437 179.813 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 20.1 m -69.0 -24.17 64.19 Favored 'General case' 0 N--CA 1.478 0.94 0 N-CA-C 114.758 1.392 . . . . 0.0 114.758 -178.189 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 25.4 m -143.79 162.82 15.67 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.965 0 C-N-CA 126.55 1.94 . . . . 0.0 110.64 179.796 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 23.5 p -60.87 139.84 93.63 Favored Pre-proline 0 N--CA 1.476 0.869 0 C-N-CA 123.44 0.696 . . . . 0.0 112.186 179.209 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 69.0 Cg_endo -77.63 -4.92 15.06 Favored 'Trans proline' 0 CA--C 1.543 0.937 0 C-N-CA 123.843 3.028 . . . . 0.0 115.129 -178.163 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 17.8 pt -62.06 156.67 3.97 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.673 0 C-N-CA 125.676 1.59 . . . . 0.0 113.462 -178.293 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 66.2 ttt180 -144.4 -36.66 0.32 Allowed 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 124.411 1.085 . . . . 0.0 113.397 176.172 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 13.2 m-20 -61.67 -25.39 67.36 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 124.597 1.159 . . . . 0.0 113.536 178.025 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 25.7 p -126.15 1.35 7.17 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 125.829 1.652 . . . . 0.0 113.731 179.914 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 16.1 tppt? -53.82 -45.28 70.76 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 124.378 1.071 . . . . 0.0 111.78 177.656 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -73.07 -23.67 60.58 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 124.606 1.163 . . . . 0.0 113.473 178.628 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 95.0 mt -91.67 -14.92 29.28 Favored 'General case' 0 N--CA 1.467 0.376 0 C-N-CA 126.064 1.746 . . . . 0.0 114.429 -177.802 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 12.8 m -75.83 78.93 2.75 Favored 'General case' 0 N--CA 1.475 0.791 0 CA-C-N 119.508 1.049 . . . . 0.0 110.785 -179.208 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.47 HD21 HD13 ' A' ' 75' ' ' LEU . 10.6 tp -75.52 141.42 43.03 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 128.021 2.528 . . . . 0.0 111.985 -176.352 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 53.0 mt-10 -71.77 151.32 43.62 Favored 'General case' 0 N--CA 1.472 0.642 0 O-C-N 120.933 -1.104 . . . . 0.0 112.452 178.623 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 16.9 m -86.71 156.54 3.29 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.904 0 C-N-CA 123.107 0.563 . . . . 0.0 111.201 174.487 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 42.2 t -75.89 132.09 40.09 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-O 121.725 0.774 . . . . 0.0 110.677 176.685 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 3.8 mpt_? -66.62 -28.17 68.28 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 124.641 1.176 . . . . 0.0 113.167 -177.79 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -84.47 -36.13 22.49 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 118.36 0.527 . . . . 0.0 110.415 178.62 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 59.1 t80 -62.69 -31.28 72.14 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 123.686 0.794 . . . . 0.0 110.835 173.565 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 12.2 mm100 -62.48 -17.93 60.7 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 124.028 0.931 . . . . 0.0 113.334 175.387 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 1.7 mpp_? -118.16 13.12 13.73 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 126.417 1.887 . . . . 0.0 111.673 176.159 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 58.76 36.04 84.78 Favored Glycine 0 CA--C 1.533 1.218 0 C-N-CA 125.12 1.343 . . . . 0.0 113.894 -179.572 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 6.4 t -130.08 15.27 5.71 Favored 'General case' 0 N--CA 1.477 0.91 0 N-CA-C 114.827 1.418 . . . . 0.0 114.827 -175.333 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 8.8 t -67.99 169.8 9.39 Favored 'General case' 0 CA--C 1.557 1.212 0 CA-C-N 118.865 0.757 . . . . 0.0 110.454 173.435 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 50.5 m -132.23 13.58 4.65 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 125.302 1.441 . . . . 0.0 114.394 -176.09 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 75.5 mtm-85 -135.8 144.87 50.53 Favored Pre-proline 0 N--CA 1.472 0.63 0 C-N-CA 125.493 1.517 . . . . 0.0 112.337 -177.184 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_endo -69.37 165.72 29.55 Favored 'Trans proline' 0 CA--C 1.544 0.986 0 C-N-CA 121.955 1.77 . . . . 0.0 109.697 171.472 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -54.27 -31.31 53.43 Favored 'General case' 0 N--CA 1.478 0.939 0 O-C-N 121.196 -0.94 . . . . 0.0 112.468 177.554 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 24.6 p -70.15 -10.9 60.25 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 126.496 1.918 . . . . 0.0 115.141 177.47 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 44.6 mm-40 -122.83 -29.91 3.91 Favored 'General case' 0 N--CA 1.476 0.841 0 N-CA-C 115.184 1.55 . . . . 0.0 115.184 -177.003 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 3.4 t -66.99 164.75 17.02 Favored 'General case' 0 CA--C 1.546 0.81 0 N-CA-C 115.123 1.527 . . . . 0.0 115.123 -175.364 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -80.96 -12.31 59.41 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 126.777 2.031 . . . . 0.0 113.433 -179.632 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 60.5 m-85 -139.81 176.55 8.65 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 126.556 1.943 . . . . 0.0 110.173 179.408 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -84.58 148.49 26.44 Favored 'General case' 0 CA--C 1.547 0.845 0 O-C-N 121.134 -0.979 . . . . 0.0 113.361 -177.214 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 66.8 m170 -119.64 87.98 38.2 Favored Pre-proline 0 CA--C 1.55 0.958 0 C-N-CA 125.847 1.659 . . . . 0.0 111.177 179.385 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_endo -62.92 144.41 93.19 Favored 'Trans proline' 0 CA--C 1.539 0.759 0 C-N-CA 123.458 2.772 . . . . 0.0 114.45 -178.323 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 45.1 p -81.78 -175.09 5.39 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 124.438 1.095 . . . . 0.0 111.941 175.233 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 61.2 mtpt -60.12 -21.3 61.38 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 125.359 1.464 . . . . 0.0 113.152 173.198 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 46.1 m -109.27 -21.03 12.74 Favored 'General case' 0 N--CA 1.478 0.951 0 N-CA-C 114.548 1.314 . . . . 0.0 114.548 -179.958 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 81.9 m -61.59 135.6 57.7 Favored 'General case' 0 CA--C 1.544 0.718 0 CA-C-N 119.653 1.115 . . . . 0.0 112.352 179.39 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 38.4 tt0 -79.2 129.46 34.48 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.695 1.198 . . . . 0.0 111.091 179.993 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 13.7 t -122.87 133.45 68.94 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.037 0 C-N-CA 125.692 1.597 . . . . 0.0 110.025 -178.268 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 50.7 mt-10 -145.16 129.05 17.38 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 125.156 1.382 . . . . 0.0 111.813 -178.594 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 61.7 t30 39.66 38.82 0.46 Allowed 'General case' 0 CA--C 1.553 1.08 0 C-N-CA 127.572 2.349 . . . . 0.0 117.273 176.735 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 93.79 9.64 59.63 Favored Glycine 0 CA--C 1.535 1.3 0 O-C-N 120.955 -1.091 . . . . 0.0 115.168 178.961 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 31.7 mtt180 -137.69 170.91 15.24 Favored 'General case' 0 N--CA 1.466 0.331 0 C-N-CA 125.682 1.593 . . . . 0.0 111.827 179.591 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 5.3 m -135.85 171.95 16.38 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.675 0 C-N-CA 128.876 2.87 . . . . 0.0 107.324 177.593 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 38.7 mt -122.29 129.04 75.62 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.941 0 CA-C-N 120.209 1.368 . . . . 0.0 109.099 -179.927 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -73.72 146.08 44.67 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 124.176 0.99 . . . . 0.0 111.636 178.458 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 15.5 t -70.3 100.47 1.72 Allowed 'General case' 0 C--O 1.24 0.584 0 C-N-CA 124.972 1.309 . . . . 0.0 113.133 -176.918 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 31.3 p90 -61.51 -38.57 87.85 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 115.281 -0.872 . . . . 0.0 110.207 175.021 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 73.7 m-20 -61.38 -42.11 98.18 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 123.116 0.566 . . . . 0.0 110.855 177.433 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 48.4 t -64.31 -42.22 96.45 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 119.452 1.024 . . . . 0.0 111.472 177.538 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 29.9 mt -64.94 -40.89 95.71 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 123.636 0.774 . . . . 0.0 112.862 176.397 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 31.4 mmmt -79.51 -10.44 59.8 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 124.703 1.201 . . . . 0.0 113.872 179.087 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 80.25 37.52 21.08 Favored Glycine 0 CA--C 1.537 1.409 0 C-N-CA 124.642 1.115 . . . . 0.0 113.712 -179.932 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 50.5 ttp180 -120.24 -19.82 7.55 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 126.822 2.049 . . . . 0.0 114.507 -176.614 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 6.2 t -68.08 139.36 56.22 Favored 'General case' 0 CA--C 1.545 0.774 0 CA-C-N 119.247 0.93 . . . . 0.0 112.603 -178.376 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 87.6 p -150.68 9.31 0.6 Allowed 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 126.601 1.96 . . . . 0.0 112.944 -179.958 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 80.3 mtm-85 -68.13 163.45 22.54 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 126.339 1.856 . . . . 0.0 113.797 -178.66 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -119.46 -2.28 10.58 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 126.362 1.865 . . . . 0.0 112.831 176.981 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 36.2 m-20 -144.46 31.56 1.2 Allowed 'General case' 0 CA--C 1.552 1.036 0 C-N-CA 127.659 2.384 . . . . 0.0 110.88 -178.329 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 8.1 t -51.74 125.53 15.24 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 126.104 1.762 . . . . 0.0 111.866 -178.346 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 27.4 mtmt -84.12 2.09 41.1 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 124.607 1.163 . . . . 0.0 113.374 -178.588 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 80.6 m-85 -117.65 149.19 41.12 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 124.334 1.053 . . . . 0.0 111.591 -174.763 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -76.09 117.75 18.12 Favored 'General case' 0 N--CA 1.464 0.253 0 C-N-CA 123.516 0.727 . . . . 0.0 111.293 -176.49 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 15.3 m170 -72.25 114.32 28.48 Favored Pre-proline 0 CA--C 1.549 0.907 0 N-CA-C 107.46 -1.311 . . . . 0.0 107.46 174.602 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 63.6 Cg_exo -47.27 115.9 1.55 Allowed 'Trans proline' 0 CA--C 1.543 0.96 0 C-N-CA 124.855 3.703 . . . . 0.0 116.522 -174.433 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -76.3 149.36 31.47 Favored 'Trans proline' 0 CA--C 1.542 0.887 0 C-N-CA 121.906 1.737 . . . . 0.0 110.472 175.955 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 84.6 Cg_exo -47.05 -39.32 25.41 Favored 'Trans proline' 0 CA--C 1.537 0.671 0 C-N-CA 123.868 3.045 . . . . 0.0 115.192 179.547 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 12.6 t-80 -69.8 -17.76 63.42 Favored 'General case' 0 N--CA 1.473 0.698 0 N-CA-C 114.99 1.478 . . . . 0.0 114.99 179.473 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.47 HD13 HD21 ' A' ' 16' ' ' LEU . 84.3 mt -114.19 -16.87 12.0 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 124.64 1.176 . . . . 0.0 112.848 178.742 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 54.2 mtpt -54.65 -36.2 64.3 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-N 119.725 1.148 . . . . 0.0 111.449 174.103 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 25.1 m -63.21 -43.73 97.31 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 123.635 0.774 . . . . 0.0 111.455 176.168 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 16.4 mm100 -67.5 -44.84 77.5 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 123.664 0.786 . . . . 0.0 110.75 178.129 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 81.7 mt -61.74 -48.69 79.57 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 124.2 1.0 . . . . 0.0 112.233 177.921 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -63.85 -35.67 81.39 Favored 'General case' 0 N--CA 1.474 0.741 0 CA-C-N 119.886 1.221 . . . . 0.0 112.733 179.725 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 60.2 mt -64.23 -45.49 96.09 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.763 0 CA-C-N 118.802 0.728 . . . . 0.0 110.062 176.203 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 32.2 m-80 -65.85 -37.88 87.35 Favored 'General case' 0 CA--C 1.542 0.672 0 O-C-N 121.696 -0.627 . . . . 0.0 111.354 175.956 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -63.08 -48.79 77.12 Favored Glycine 0 CA--C 1.528 0.846 0 C-N-CA 124.502 1.048 . . . . 0.0 111.981 177.653 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 71.8 mtp85 -57.73 -39.38 77.17 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 124.53 1.132 . . . . 0.0 112.024 176.231 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 49.6 t30 -67.34 -31.14 71.2 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 123.776 0.83 . . . . 0.0 112.641 176.694 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 56.7 t30 -86.48 -30.65 21.83 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 125.085 1.354 . . . . 0.0 113.536 179.791 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 37.4 tp -54.55 -13.53 1.0 Allowed 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 127.71 2.404 . . . . 0.0 115.414 -179.014 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 21.0 pt -64.68 10.76 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.548 0.9 0 C-N-CA 127.205 2.202 . . . . 0.0 115.355 177.856 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -49.97 -27.61 5.64 Favored 'General case' 0 N--CA 1.477 0.892 0 N-CA-C 116.356 1.984 . . . . 0.0 116.356 -177.413 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . 0.451 ' NE2' ' H ' ' A' ' 90' ' ' GLN . 0.0 OUTLIER -80.82 -4.5 54.89 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 124.922 1.289 . . . . 0.0 114.044 177.046 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 39.5 ttpt -129.6 -30.95 2.05 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 126.426 1.891 . . . . 0.0 113.499 -178.065 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 54.0 t-20 . . . . . 0 C--O 1.243 0.74 0 C-N-CA 125.436 1.495 . . . . 0.0 111.486 179.574 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.5 mmt . . . . . 0 CA--C 1.542 0.641 0 N-CA-C 113.141 0.793 . . . . 0.0 113.141 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -49.49 -25.93 3.02 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 126.539 1.936 . . . . 0.0 114.839 -179.451 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 26.7 m -66.0 -16.11 20.06 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.754 0 C-N-CA 125.548 1.539 . . . . 0.0 114.452 177.521 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 89.2 p -139.75 -18.69 0.94 Allowed 'General case' 0 N--CA 1.478 0.935 0 N-CA-C 116.722 2.119 . . . . 0.0 116.722 -177.467 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 34.1 m -74.99 41.73 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.542 0 CA-C-N 120.553 1.524 . . . . 0.0 114.439 179.651 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 60.9 p -57.57 151.28 41.12 Favored Pre-proline 0 N--CA 1.479 1.004 0 C-N-CA 124.97 1.308 . . . . 0.0 112.832 179.886 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 85.6 Cg_exo -49.06 133.8 29.14 Favored 'Trans proline' 0 C--N 1.353 0.815 0 C-N-CA 124.229 3.286 . . . . 0.0 115.08 -178.563 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 9.8 tp -58.03 132.39 22.65 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.637 0 C-N-CA 123.952 0.901 . . . . 0.0 111.513 179.068 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 34.8 ptt-85 -161.6 161.82 29.83 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 126.868 2.067 . . . . 0.0 110.855 -176.192 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 8.7 p-10 -63.38 -27.21 69.15 Favored 'General case' 0 CA--C 1.544 0.735 0 N-CA-C 113.53 0.937 . . . . 0.0 113.53 177.545 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 25.5 p -87.1 2.27 50.29 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 125.314 1.445 . . . . 0.0 114.112 178.079 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 3.3 tmpt? -54.45 -39.93 67.88 Favored 'General case' 0 N--CA 1.479 0.992 0 O-C-N 120.734 -1.229 . . . . 0.0 112.866 -178.601 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -75.29 -24.7 57.55 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 123.868 0.867 . . . . 0.0 113.051 177.683 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 86.8 mt -89.37 -14.65 35.12 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 126.127 1.771 . . . . 0.0 114.375 -178.227 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 6.8 m -78.03 75.86 4.56 Favored 'General case' 0 N--CA 1.477 0.907 0 CA-C-N 119.289 0.95 . . . . 0.0 111.008 -178.958 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.458 HD21 HD13 ' A' ' 75' ' ' LEU . 12.0 tp -75.66 145.88 40.67 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 127.531 2.332 . . . . 0.0 112.374 -178.227 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 15.9 mt-10 -75.24 150.9 38.48 Favored 'General case' 0 N--CA 1.472 0.638 0 O-C-N 120.602 -1.311 . . . . 0.0 112.752 179.29 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 13.0 m -83.52 155.56 3.75 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 C-N-CA 122.787 0.435 . . . . 0.0 111.596 176.29 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 42.6 t -72.89 129.5 38.28 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-O 122.063 0.935 . . . . 0.0 110.608 176.046 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 3.9 mpt_? -67.82 -27.82 67.05 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 124.925 1.29 . . . . 0.0 113.211 -177.542 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 15.8 mm-40 -84.13 -36.38 22.97 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 123.297 0.639 . . . . 0.0 110.11 178.423 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 72.7 t80 -63.27 -30.93 71.98 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 124.214 1.005 . . . . 0.0 110.917 174.19 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 12.6 mm100 -62.17 -16.03 50.16 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 123.886 0.874 . . . . 0.0 113.045 174.899 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 6.5 mpt_? -119.4 12.84 12.56 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 126.72 2.008 . . . . 0.0 111.622 176.684 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 58.22 36.12 81.18 Favored Glycine 0 CA--C 1.534 1.249 0 C-N-CA 125.479 1.514 . . . . 0.0 114.565 179.742 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 6.4 t -132.07 12.25 4.69 Favored 'General case' 0 N--CA 1.478 0.962 0 N-CA-C 115.202 1.556 . . . . 0.0 115.202 -175.384 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 31.0 t -61.03 131.84 51.91 Favored 'General case' 0 CA--C 1.548 0.897 0 O-C-N 121.175 -0.953 . . . . 0.0 110.783 176.53 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 75.4 p -83.18 6.67 18.52 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 125.94 1.696 . . . . 0.0 114.645 -178.04 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 75.3 mtm-85 -127.38 152.87 76.97 Favored Pre-proline 0 N--CA 1.473 0.685 0 C-N-CA 125.851 1.661 . . . . 0.0 113.476 -175.69 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo -72.66 160.61 46.03 Favored 'Trans proline' 0 CA--C 1.54 0.79 0 C-N-CA 122.098 1.865 . . . . 0.0 109.053 172.461 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 16.7 m-20 -55.3 -22.12 17.46 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 124.759 1.223 . . . . 0.0 113.822 -178.71 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 14.9 p -83.55 -22.08 32.48 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 127.306 2.242 . . . . 0.0 115.5 179.296 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -101.51 -31.9 10.65 Favored 'General case' 0 N--CA 1.477 0.883 0 CA-C-N 119.742 1.155 . . . . 0.0 113.839 -177.519 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 4.3 t -56.67 150.31 16.07 Favored 'General case' 0 CA--C 1.545 0.763 0 N-CA-C 115.007 1.484 . . . . 0.0 115.007 -174.105 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 13.4 mptt -81.9 -2.24 50.58 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 127.046 2.139 . . . . 0.0 113.134 -177.241 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 63.8 m-85 -138.79 169.8 17.14 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 127.461 2.304 . . . . 0.0 109.587 174.622 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -80.37 149.06 30.36 Favored 'General case' 0 CA--C 1.547 0.857 0 N-CA-C 114.382 1.253 . . . . 0.0 114.382 -175.948 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 21.2 m170 -121.07 86.78 42.88 Favored Pre-proline 0 CA--C 1.556 1.178 0 C-N-CA 125.99 1.716 . . . . 0.0 111.173 -179.179 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 35.2 Cg_endo -65.25 150.01 87.93 Favored 'Trans proline' 0 CA--C 1.539 0.771 0 C-N-CA 123.279 2.653 . . . . 0.0 114.671 -178.8 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 46.1 p -88.4 -175.34 4.96 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 124.476 1.11 . . . . 0.0 111.536 174.19 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 62.8 mttp -61.21 -18.53 58.72 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 125.379 1.471 . . . . 0.0 113.388 173.221 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 47.8 m -109.19 -20.99 12.78 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 125.078 1.351 . . . . 0.0 114.645 -178.783 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 71.6 m -63.58 137.55 58.16 Favored 'General case' 0 CA--C 1.543 0.701 0 CA-C-N 119.304 0.956 . . . . 0.0 113.32 -179.883 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 4.3 tm0? -82.88 134.28 35.09 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 124.774 1.23 . . . . 0.0 111.257 178.817 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -139.07 145.06 28.11 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.677 0 C-N-CA 125.251 1.42 . . . . 0.0 112.259 179.775 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -147.27 140.6 25.36 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 126.019 1.727 . . . . 0.0 110.911 176.802 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 61.1 t30 41.4 38.13 0.78 Allowed 'General case' 0 CA--C 1.553 1.073 0 C-N-CA 126.585 1.954 . . . . 0.0 116.166 177.53 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 84.53 16.65 65.76 Favored Glycine 0 CA--C 1.537 1.424 0 O-C-N 121.091 -1.006 . . . . 0.0 115.358 -179.938 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 55.5 mtt85 -136.92 160.87 37.6 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 124.913 1.285 . . . . 0.0 112.043 -179.945 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 5.8 m -135.89 150.1 28.24 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.698 0 C-N-CA 128.034 2.533 . . . . 0.0 109.847 -177.512 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 40.4 mt -98.84 127.63 51.25 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.75 0 O-C-N 121.28 -0.887 . . . . 0.0 109.992 -179.055 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -73.44 147.43 44.2 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 124.268 1.027 . . . . 0.0 111.716 177.6 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 17.9 t -69.26 100.08 1.26 Allowed 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 124.93 1.292 . . . . 0.0 112.784 -177.392 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 30.2 p90 -61.57 -38.47 87.63 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 115.23 -0.895 . . . . 0.0 110.163 175.183 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 71.1 m-20 -61.47 -42.69 99.17 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 123.127 0.571 . . . . 0.0 110.761 177.29 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 47.6 t -64.11 -42.32 96.93 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-N 119.491 1.041 . . . . 0.0 111.574 177.669 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 28.6 mt -65.46 -40.57 93.35 Favored 'General case' 0 CA--C 1.543 0.674 0 O-C-N 121.436 -0.79 . . . . 0.0 112.881 176.625 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 31.3 mmmt -79.84 -11.31 59.83 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 124.679 1.191 . . . . 0.0 113.928 179.167 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 82.17 37.79 14.53 Favored Glycine 0 CA--C 1.537 1.409 0 C-N-CA 124.577 1.085 . . . . 0.0 113.959 179.76 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 50.5 ttp180 -121.23 -18.29 7.44 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 126.652 1.981 . . . . 0.0 114.518 -176.646 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 6.0 t -71.67 133.69 45.83 Favored 'General case' 0 CA--C 1.545 0.765 0 CA-C-N 119.298 0.954 . . . . 0.0 112.747 -178.331 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 59.8 m -142.93 12.84 1.86 Allowed 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 126.85 2.06 . . . . 0.0 112.022 178.874 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 82.5 mtm-85 -70.6 163.52 26.8 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 125.791 1.636 . . . . 0.0 113.74 -178.323 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -119.77 -3.19 10.29 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 126.515 1.926 . . . . 0.0 112.968 177.268 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 43.9 m-20 -145.13 34.7 1.09 Allowed 'General case' 0 CA--C 1.551 1.017 0 C-N-CA 127.745 2.418 . . . . 0.0 110.308 -178.348 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 8.4 t -51.17 127.63 19.77 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 125.688 1.595 . . . . 0.0 112.28 -177.341 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 36.1 mtmt -85.02 5.63 28.6 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 125.324 1.45 . . . . 0.0 113.612 -177.281 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 84.4 m-85 -126.57 155.34 42.6 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 124.87 1.268 . . . . 0.0 112.061 -175.532 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -76.99 114.94 16.34 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 123.679 0.792 . . . . 0.0 112.267 -176.598 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 10.7 m170 -71.5 113.62 21.2 Favored Pre-proline 0 CA--C 1.546 0.807 0 N-CA-C 107.605 -1.257 . . . . 0.0 107.605 173.539 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 89.3 Cg_exo -50.1 111.36 0.51 Allowed 'Trans proline' 0 CA--C 1.542 0.901 0 C-N-CA 124.801 3.667 . . . . 0.0 117.226 -173.871 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 97.1 Cg_endo -76.34 152.97 35.2 Favored 'Trans proline' 0 CA--C 1.547 1.15 0 C-N-CA 122.109 1.873 . . . . 0.0 111.109 175.254 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 91.6 Cg_exo -43.95 -44.92 11.87 Favored 'Trans proline' 0 CA--C 1.538 0.717 0 C-N-CA 124.755 3.637 . . . . 0.0 116.308 -179.51 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 25.6 m170 -74.76 -5.82 45.45 Favored 'General case' 0 N--CA 1.478 0.95 0 N-CA-C 115.111 1.523 . . . . 0.0 115.111 -179.523 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.458 HD13 HD21 ' A' ' 16' ' ' LEU . 95.5 mt -116.16 -21.24 9.49 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 124.852 1.261 . . . . 0.0 113.122 177.198 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 57.4 mtpt -54.09 -35.46 62.13 Favored 'General case' 0 N--CA 1.477 0.922 0 CA-C-N 119.752 1.16 . . . . 0.0 111.439 175.304 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 23.0 m -63.62 -46.82 83.98 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 124.798 1.239 . . . . 0.0 111.416 174.902 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 75.1 mt-30 -62.51 -44.98 95.03 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.64 0.776 . . . . 0.0 110.884 177.708 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 82.2 mt -61.77 -50.18 73.41 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 124.205 1.002 . . . . 0.0 111.861 177.998 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 7.5 pt-20 -63.6 -35.16 79.59 Favored 'General case' 0 N--CA 1.474 0.726 0 CA-C-N 119.838 1.199 . . . . 0.0 112.895 179.279 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 60.4 mt -60.62 -41.21 87.18 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.795 0 CA-C-N 119.269 0.941 . . . . 0.0 110.063 176.369 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 12.7 t-20 -69.67 -45.0 69.36 Favored 'General case' 0 CA--C 1.545 0.783 0 O-C-N 121.827 -0.545 . . . . 0.0 110.595 175.316 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -56.65 -40.13 87.44 Favored Glycine 0 CA--C 1.534 1.273 0 C-N-CA 125.171 1.367 . . . . 0.0 113.357 177.726 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 86.4 mtt-85 -62.38 -29.49 70.51 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 125.432 1.493 . . . . 0.0 112.52 176.241 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 62.7 t30 -84.45 -36.93 21.99 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 124.006 0.922 . . . . 0.0 110.637 174.765 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -77.49 7.08 5.9 Favored 'General case' 0 CA--C 1.555 1.139 0 C-N-CA 126.405 1.882 . . . . 0.0 113.104 176.781 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 13.6 tp -62.51 -5.64 2.74 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 126.964 2.106 . . . . 0.0 115.04 -177.149 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 49.9 pt -56.1 -11.68 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.479 1.002 0 C-N-CA 126.655 1.982 . . . . 0.0 115.234 177.821 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 20.1 pt20 -114.83 10.96 16.58 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 126.211 1.804 . . . . 0.0 113.762 179.664 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 25.2 tm0? -60.3 -24.31 64.86 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 125.061 1.344 . . . . 0.0 114.16 -179.699 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 19.5 ptpt -143.1 166.16 25.41 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 125.976 1.71 . . . . 0.0 112.275 178.907 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 45.3 t30 . . . . . 0 CA--C 1.542 0.668 0 C-N-CA 125.409 1.484 . . . . 0.0 111.435 -179.733 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.3 mmt . . . . . 0 CA--C 1.545 0.754 0 N-CA-C 113.48 0.919 . . . . 0.0 113.48 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -64.67 157.61 26.76 Favored 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 124.93 1.292 . . . . 0.0 113.162 179.057 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 30.6 m -67.25 -18.21 23.74 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.175 0 N-CA-C 114.502 1.297 . . . . 0.0 114.502 179.685 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 8.1 t -156.05 172.32 18.61 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 125.854 1.662 . . . . 0.0 111.163 178.899 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 27.8 m -64.41 153.94 7.31 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.876 0 C-N-CA 124.867 1.267 . . . . 0.0 112.861 179.051 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 20.1 p -72.65 154.61 91.37 Favored Pre-proline 0 N--CA 1.475 0.786 0 C-N-CA 124.509 1.124 . . . . 0.0 112.451 178.335 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 82.6 Cg_endo -71.88 162.8 40.86 Favored 'Trans proline' 0 C--N 1.351 0.707 0 C-N-CA 123.217 2.612 . . . . 0.0 113.069 -178.992 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 12.4 tt -66.42 22.09 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.484 1.269 0 C-N-CA 127.178 2.191 . . . . 0.0 115.048 179.001 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 1.4 mpt_? -126.39 -8.68 6.35 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 127.637 2.375 . . . . 0.0 112.059 176.845 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -70.87 -10.6 59.92 Favored 'General case' 0 CA--C 1.549 0.937 0 C-N-CA 124.699 1.2 . . . . 0.0 112.268 174.965 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 21.3 p -59.92 -2.8 0.44 Allowed 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 127.182 2.193 . . . . 0.0 115.468 177.716 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 85.0 tttt -48.72 -34.71 12.56 Favored 'General case' 0 N--CA 1.477 0.918 0 CA-C-N 120.699 1.59 . . . . 0.0 113.857 179.08 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -65.7 -25.74 67.45 Favored 'General case' 0 N--CA 1.474 0.772 0 N-CA-C 113.818 1.044 . . . . 0.0 113.818 177.488 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 87.1 mt -88.81 -8.9 53.54 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 127.26 2.224 . . . . 0.0 113.797 -179.418 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 4.1 m -77.43 76.94 3.97 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-O 122.738 1.256 . . . . 0.0 110.366 -179.632 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -75.65 142.26 42.62 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 128.428 2.691 . . . . 0.0 111.716 -177.139 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 51.8 mt-10 -70.89 149.86 46.33 Favored 'General case' 0 N--CA 1.471 0.612 0 O-C-N 120.718 -1.239 . . . . 0.0 112.08 176.927 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 16.5 m -84.1 155.2 3.66 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.921 0 C-N-CA 123.163 0.585 . . . . 0.0 111.191 174.555 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 42.3 t -74.76 133.56 41.96 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-O 121.861 0.839 . . . . 0.0 110.841 176.861 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 3.4 mpt_? -67.95 -26.96 66.21 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 124.994 1.317 . . . . 0.0 113.437 -177.562 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 7.8 mm-40 -87.86 -32.9 18.75 Favored 'General case' 0 N--CA 1.465 0.32 0 C-N-CA 123.053 0.541 . . . . 0.0 110.701 178.427 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 64.2 t80 -64.15 -31.69 72.98 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 123.513 0.725 . . . . 0.0 110.212 172.93 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 12.0 mm100 -61.61 -24.21 66.54 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 123.669 0.788 . . . . 0.0 112.541 174.382 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 28.0 mtm105 -103.48 -2.36 26.98 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 125.967 1.707 . . . . 0.0 112.575 177.649 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 72.58 35.86 59.02 Favored Glycine 0 CA--C 1.533 1.191 0 C-N-CA 126.223 1.868 . . . . 0.0 113.983 179.927 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 5.3 t -137.15 10.62 3.03 Favored 'General case' 0 N--CA 1.48 1.053 0 N-CA-C 116.122 1.897 . . . . 0.0 116.122 -175.033 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 28.9 t -60.77 131.73 51.61 Favored 'General case' 0 CA--C 1.55 0.971 0 CA-C-N 119.723 1.147 . . . . 0.0 111.518 177.545 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 29.0 m -80.16 5.14 15.26 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 125.811 1.644 . . . . 0.0 114.894 -177.581 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 79.1 mtm-85 -129.69 145.22 56.12 Favored Pre-proline 0 N--CA 1.475 0.798 0 C-N-CA 125.243 1.417 . . . . 0.0 113.491 -175.28 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 93.5 Cg_endo -70.22 166.79 27.01 Favored 'Trans proline' 0 CA--C 1.543 0.959 0 C-N-CA 122.251 1.967 . . . . 0.0 109.803 171.382 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 7.1 p-10 -54.61 -28.76 48.83 Favored 'General case' 0 N--CA 1.475 0.821 0 O-C-N 121.031 -1.043 . . . . 0.0 113.507 177.088 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 35.0 p -75.52 -9.25 58.42 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 125.472 1.509 . . . . 0.0 114.995 178.874 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 25.5 mm-40 -122.12 -25.16 4.96 Favored 'General case' 0 N--CA 1.477 0.901 0 N-CA-C 115.763 1.764 . . . . 0.0 115.763 -175.748 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 4.3 t -71.02 164.55 25.33 Favored 'General case' 0 CA--C 1.545 0.788 0 N-CA-C 115.181 1.549 . . . . 0.0 115.181 -175.164 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -83.33 -13.29 55.37 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 126.888 2.075 . . . . 0.0 113.428 -179.805 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 59.5 m-85 -136.76 171.79 13.98 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 127.093 2.157 . . . . 0.0 110.105 179.068 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -81.26 151.96 27.85 Favored 'General case' 0 CA--C 1.545 0.757 0 N-CA-C 114.555 1.317 . . . . 0.0 114.555 -176.15 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 67.7 m170 -124.25 85.32 55.3 Favored Pre-proline 0 CA--C 1.553 1.072 0 C-N-CA 126.315 1.846 . . . . 0.0 110.638 -179.788 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_endo -63.42 151.71 83.62 Favored 'Trans proline' 0 C--N 1.352 0.762 0 C-N-CA 123.606 2.871 . . . . 0.0 115.166 -177.43 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 59.6 p -84.77 -176.31 6.16 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 124.785 1.234 . . . . 0.0 111.93 174.492 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 67.7 mttm -63.24 -18.34 63.43 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 125.477 1.511 . . . . 0.0 113.407 173.686 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 70.8 p -109.26 -21.23 12.65 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 125.368 1.467 . . . . 0.0 114.696 -178.92 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 84.0 m -63.68 138.89 58.68 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 119.463 1.029 . . . . 0.0 113.581 179.522 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 24.3 mt-30 -78.79 136.82 37.47 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 124.808 1.243 . . . . 0.0 111.449 178.242 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 11.2 t -130.23 135.4 60.88 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.687 0 C-N-CA 124.789 1.235 . . . . 0.0 110.478 -179.484 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -145.91 132.72 20.06 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 125.149 1.379 . . . . 0.0 111.202 178.236 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 63.2 t30 41.16 38.39 0.73 Allowed 'General case' 0 CA--C 1.552 1.038 0 C-N-CA 126.951 2.1 . . . . 0.0 116.419 177.622 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 87.26 14.99 63.11 Favored Glycine 0 CA--C 1.536 1.377 0 O-C-N 121.071 -1.018 . . . . 0.0 115.136 179.892 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 30.0 mtt180 -137.01 163.75 30.0 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 125.452 1.501 . . . . 0.0 112.702 -179.664 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 6.2 m -137.6 141.35 39.51 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.562 0 C-N-CA 127.87 2.468 . . . . 0.0 109.91 -179.243 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 49.8 mt -90.2 142.29 13.14 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.964 0 O-C-N 121.092 -1.005 . . . . 0.0 108.991 178.591 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -90.8 152.28 20.85 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 123.54 0.736 . . . . 0.0 112.693 -179.718 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 3.7 t -70.29 88.87 0.64 Allowed 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.997 1.719 . . . . 0.0 111.398 -177.061 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 28.9 p90 -57.7 -36.86 72.55 Favored 'General case' 0 N--CA 1.469 0.508 0 O-C-N 121.341 -0.849 . . . . 0.0 111.934 179.374 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 66.8 m-20 -59.48 -30.79 68.79 Favored 'General case' 0 CA--C 1.542 0.648 0 O-C-N 121.807 -0.558 . . . . 0.0 111.66 177.269 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 47.9 t -71.28 -41.46 69.99 Favored 'General case' 0 N--CA 1.469 0.513 0 O-C-N 120.744 -1.223 . . . . 0.0 111.104 177.054 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 48.3 mt -66.94 -40.25 87.53 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 123.912 0.885 . . . . 0.0 112.49 175.731 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 14.2 mmmm -78.48 -8.4 58.49 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 125.078 1.351 . . . . 0.0 114.591 -179.381 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 76.05 49.59 8.47 Favored Glycine 0 CA--C 1.534 1.219 0 CA-C-N 118.786 0.721 . . . . 0.0 112.26 -179.222 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.13 -21.8 1.19 Allowed 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 125.981 1.713 . . . . 0.0 115.588 -174.843 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 7.4 t -56.18 113.76 1.68 Allowed 'General case' 0 CA--C 1.546 0.816 0 N-CA-C 114.362 1.245 . . . . 0.0 114.362 -174.159 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 19.9 m -142.13 15.55 2.07 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 127.871 2.468 . . . . 0.0 110.968 179.188 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.473 HH21 ' HA ' ' A' ' 66' ' ' CYS . 20.1 ttm105 -63.34 143.2 58.01 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 127.354 2.262 . . . . 0.0 112.96 -176.283 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 3.5 mp0 -64.93 -35.18 80.31 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 124.301 1.041 . . . . 0.0 112.892 179.761 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 52.5 m-80 -152.39 109.85 3.58 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 126.697 1.999 . . . . 0.0 109.271 179.543 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' CYS . . . . . 0.473 ' HA ' HH21 ' A' ' 63' ' ' ARG . 59.0 m -69.36 139.09 54.15 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-O 121.84 0.829 . . . . 0.0 111.138 177.751 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 35.2 mtmt -115.51 15.65 16.66 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 125.788 1.635 . . . . 0.0 111.144 176.457 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 68.7 m-85 -139.03 150.43 45.79 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 127.714 2.405 . . . . 0.0 111.381 -174.683 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -73.63 122.06 21.69 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 124.598 1.159 . . . . 0.0 112.874 -178.406 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 4.0 m170 -72.92 117.59 61.06 Favored Pre-proline 0 CA--C 1.547 0.83 0 N-CA-C 107.609 -1.256 . . . . 0.0 107.609 171.455 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 90.1 Cg_exo -48.89 111.47 0.48 Allowed 'Trans proline' 0 CA--C 1.545 1.045 0 C-N-CA 124.475 3.45 . . . . 0.0 116.238 -176.301 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 68.1 Cg_endo -74.53 154.1 44.68 Favored 'Trans proline' 0 CA--C 1.542 0.893 0 C-N-CA 122.391 2.061 . . . . 0.0 111.048 176.38 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -54.95 -34.66 87.21 Favored 'Trans proline' 0 CA--C 1.536 0.59 0 C-N-CA 123.532 2.821 . . . . 0.0 114.682 -177.413 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 19.4 t-80 -75.66 -13.44 60.33 Favored 'General case' 0 N--CA 1.474 0.734 0 N-CA-C 114.519 1.303 . . . . 0.0 114.519 178.308 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 87.7 mt -115.55 -14.6 11.5 Favored 'General case' 0 N--CA 1.474 0.769 0 N-CA-C 113.948 1.092 . . . . 0.0 113.948 178.461 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 56.0 mtpt -54.55 -32.71 58.88 Favored 'General case' 0 N--CA 1.475 0.78 0 CA-C-N 119.728 1.149 . . . . 0.0 110.638 173.103 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 17.4 m -62.89 -42.98 99.97 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 124.648 1.179 . . . . 0.0 111.585 175.208 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 -66.65 -47.23 73.19 Favored 'General case' 0 CA--C 1.536 0.438 0 O-C-N 121.419 -0.801 . . . . 0.0 110.093 176.663 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 44.3 mt -61.92 -39.15 91.03 Favored 'General case' 0 N--CA 1.471 0.584 0 N-CA-C 113.183 0.809 . . . . 0.0 113.183 178.287 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 17.7 mm-40 -53.49 -54.29 39.28 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 124.733 1.213 . . . . 0.0 110.443 174.485 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 69.5 mt -68.45 -37.52 77.93 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.402 0 C-N-CA 126.032 1.733 . . . . 0.0 111.197 -176.186 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 72.8 m-20 -63.13 -44.26 96.09 Favored 'General case' 0 CA--C 1.542 0.66 0 O-C-N 121.623 -0.673 . . . . 0.0 110.294 173.081 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -63.39 -46.0 93.7 Favored Glycine 0 CA--C 1.529 0.913 0 C-N-CA 124.431 1.015 . . . . 0.0 112.421 179.326 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 81.8 mtt-85 -58.64 -37.15 75.32 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 124.596 1.158 . . . . 0.0 111.434 175.81 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 43.8 t30 -73.53 -44.27 58.01 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 123.767 0.827 . . . . 0.0 111.887 175.603 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 30.1 t30 -59.9 -29.86 68.64 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 125.174 1.39 . . . . 0.0 113.849 179.414 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 32.4 tp -49.49 -26.51 3.45 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 125.695 1.598 . . . . 0.0 114.464 -179.102 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 9.4 pt -53.59 -32.54 20.96 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.745 0 C-N-CA 124.635 1.174 . . . . 0.0 112.939 176.138 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 18.6 tt0 -61.0 -30.85 70.53 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 124.126 0.97 . . . . 0.0 112.318 177.552 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -93.67 2.48 56.3 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 125.539 1.536 . . . . 0.0 112.889 178.28 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 59.6 mtpt -125.44 -16.22 5.92 Favored 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 125.316 1.447 . . . . 0.0 114.765 -178.758 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 45.7 t30 . . . . . 0 CA--C 1.542 0.661 0 C-N-CA 125.629 1.572 . . . . 0.0 111.502 -179.573 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 94.7 mtp . . . . . 0 CA--C 1.545 0.771 0 N-CA-C 113.405 0.891 . . . . 0.0 113.405 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -65.15 157.36 28.89 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 124.897 1.279 . . . . 0.0 113.144 179.022 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 32.8 m -132.66 11.89 1.55 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.239 0 C-N-CA 125.565 1.546 . . . . 0.0 113.407 -179.352 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 20.0 m -60.24 151.53 27.1 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 125.562 1.545 . . . . 0.0 113.825 -179.164 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 40.3 t -140.34 148.25 22.53 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.992 0 C-N-CA 126.291 1.837 . . . . 0.0 109.197 179.057 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 15.2 p -62.03 153.75 72.22 Favored Pre-proline 0 N--CA 1.479 1.003 0 C-N-CA 124.472 1.109 . . . . 0.0 112.867 178.762 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_exo -52.98 144.39 45.64 Favored 'Trans proline' 0 CA--C 1.541 0.825 0 C-N-CA 123.784 2.989 . . . . 0.0 115.083 179.806 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 47.0 pt -133.13 14.13 1.46 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.205 0 C-N-CA 126.027 1.731 . . . . 0.0 113.009 179.113 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 46.9 ptt85 -140.95 11.98 2.23 Favored 'General case' 0 N--CA 1.481 1.111 0 N-CA-C 115.282 1.586 . . . . 0.0 115.282 -177.33 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -53.19 -30.94 40.3 Favored 'General case' 0 CA--C 1.547 0.845 0 N-CA-C 116.291 1.96 . . . . 0.0 116.291 -175.407 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 21.8 p -134.79 -5.72 2.46 Favored 'General case' 0 N--CA 1.483 1.198 0 N-CA-C 115.963 1.838 . . . . 0.0 115.963 -178.735 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 18.6 ptpt -54.56 -25.69 27.63 Favored 'General case' 0 N--CA 1.485 1.279 0 CA-C-N 121.485 1.948 . . . . 0.0 115.606 -178.466 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -77.71 -22.97 49.6 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 123.729 0.812 . . . . 0.0 112.785 175.403 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 85.7 mt -95.06 -20.34 19.4 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 127.269 2.228 . . . . 0.0 114.081 -177.649 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 4.5 m -73.19 73.69 1.26 Allowed 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 125.251 1.42 . . . . 0.0 112.029 -178.957 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.545 HD21 HD13 ' A' ' 75' ' ' LEU . 10.2 tp -75.67 145.25 41.12 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 127.137 2.175 . . . . 0.0 112.098 -178.751 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 11.2 mt-10 -72.95 152.19 41.51 Favored 'General case' 0 N--CA 1.471 0.588 0 O-C-N 120.589 -1.319 . . . . 0.0 112.865 179.146 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 18.0 m -85.21 156.18 3.49 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.852 0 C-N-CA 123.333 0.653 . . . . 0.0 111.446 175.559 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 42.6 t -75.69 128.06 34.39 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-O 121.61 0.719 . . . . 0.0 110.44 176.741 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 4.3 mpt_? -66.82 -27.64 67.72 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 124.384 1.073 . . . . 0.0 113.141 -177.658 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -78.92 -40.75 31.27 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.457 0.703 . . . . 0.0 109.518 177.803 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 63.8 t80 -62.79 -35.28 79.36 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 124.752 1.221 . . . . 0.0 111.2 175.745 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 50.3 mm-40 -62.04 -15.92 48.12 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 124.408 1.083 . . . . 0.0 113.406 175.248 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 12.0 mtp-105 -120.82 12.71 11.37 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 127.06 2.144 . . . . 0.0 112.266 -179.852 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 58.06 34.62 73.37 Favored Glycine 0 CA--C 1.535 1.285 0 C-N-CA 125.061 1.315 . . . . 0.0 113.845 -179.791 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 7.6 t -129.87 14.1 5.82 Favored 'General case' 0 N--CA 1.475 0.796 0 N-CA-C 114.597 1.332 . . . . 0.0 114.597 -175.342 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 6.8 t -68.57 173.35 5.14 Favored 'General case' 0 CA--C 1.556 1.176 0 O-C-N 121.409 -0.807 . . . . 0.0 110.837 174.133 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 91.6 p -139.4 9.34 2.47 Favored 'General case' 0 N--CA 1.477 0.878 0 N-CA-C 115.097 1.517 . . . . 0.0 115.097 -176.825 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 48.3 mtt85 -130.86 145.47 57.85 Favored Pre-proline 0 N--CA 1.47 0.569 0 C-N-CA 125.596 1.558 . . . . 0.0 112.116 -177.589 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -69.05 166.44 26.72 Favored 'Trans proline' 0 CA--C 1.543 0.958 0 C-N-CA 121.962 1.775 . . . . 0.0 109.735 171.973 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -54.24 -29.79 47.88 Favored 'General case' 0 N--CA 1.476 0.862 0 O-C-N 121.129 -0.982 . . . . 0.0 113.054 176.946 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 31.7 p -73.1 -7.63 52.17 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 125.991 1.717 . . . . 0.0 115.004 178.317 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 21.8 mt-10 -127.39 -24.33 3.37 Favored 'General case' 0 N--CA 1.476 0.838 0 N-CA-C 116.059 1.874 . . . . 0.0 116.059 -176.167 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 1.1 t -71.71 164.64 25.59 Favored 'General case' 0 CA--C 1.543 0.691 0 N-CA-C 115.415 1.635 . . . . 0.0 115.415 -176.538 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -81.62 -10.81 59.33 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 126.591 1.956 . . . . 0.0 113.717 -178.598 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 63.1 m-85 -140.06 174.0 10.96 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 126.549 1.939 . . . . 0.0 110.336 179.507 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -80.11 150.02 30.4 Favored 'General case' 0 CA--C 1.548 0.871 0 N-CA-C 113.349 0.87 . . . . 0.0 113.349 -176.957 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 65.8 m170 -123.42 86.14 52.19 Favored Pre-proline 0 CA--C 1.553 1.092 0 C-N-CA 126.049 1.74 . . . . 0.0 110.965 -179.327 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_endo -63.82 152.64 79.75 Favored 'Trans proline' 0 CA--C 1.541 0.842 0 C-N-CA 123.704 2.936 . . . . 0.0 114.998 -177.894 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 39.2 p -92.32 -174.44 3.72 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 124.99 1.316 . . . . 0.0 112.096 175.563 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -62.09 -17.02 56.32 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 125.693 1.597 . . . . 0.0 113.559 173.31 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 61.2 m -109.07 -25.71 10.54 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 124.719 1.208 . . . . 0.0 114.081 -179.744 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 75.2 m -60.56 129.52 41.98 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 123.861 0.864 . . . . 0.0 113.137 -179.618 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 33.9 mt-30 -77.05 141.62 40.21 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 123.161 0.584 . . . . 0.0 110.978 176.115 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 14.5 t -129.48 139.59 51.3 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 C-N-CA 125.438 1.495 . . . . 0.0 110.604 -177.695 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 74.1 mm-40 -145.32 129.35 17.49 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 125.213 1.405 . . . . 0.0 111.49 179.943 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 63.3 t30 42.88 37.23 1.03 Allowed 'General case' 0 CA--C 1.555 1.138 0 N-CA-C 116.298 1.962 . . . . 0.0 116.298 176.684 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 85.58 17.18 62.49 Favored Glycine 0 CA--C 1.536 1.399 0 O-C-N 120.975 -1.078 . . . . 0.0 114.813 -179.407 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 60.8 mtt180 -138.72 162.01 35.75 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 125.842 1.657 . . . . 0.0 111.472 -179.1 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 4.9 m -138.35 142.25 35.7 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.626 0 C-N-CA 126.949 2.1 . . . . 0.0 109.938 -177.869 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 31.8 mt -90.36 129.28 41.46 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.766 0 O-C-N 121.289 -0.882 . . . . 0.0 110.337 -178.048 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -75.53 149.24 38.43 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 124.16 0.984 . . . . 0.0 111.733 177.868 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 15.2 t -69.45 99.52 1.25 Allowed 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 124.876 1.27 . . . . 0.0 112.985 -176.696 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 32.1 p90 -61.66 -38.56 88.19 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 115.165 -0.925 . . . . 0.0 110.154 175.108 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 69.9 m-20 -61.26 -41.78 97.52 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 123.17 0.588 . . . . 0.0 111.033 177.187 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 48.2 t -64.63 -41.65 96.03 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-N 119.48 1.036 . . . . 0.0 111.462 177.678 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 31.2 mt -66.5 -41.63 88.6 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 123.804 0.841 . . . . 0.0 112.882 176.504 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 31.4 mmmt -77.77 -10.97 59.82 Favored 'General case' 0 N--CA 1.478 0.966 0 C-N-CA 124.668 1.187 . . . . 0.0 113.71 179.158 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 81.14 38.39 15.44 Favored Glycine 0 CA--C 1.537 1.412 0 C-N-CA 124.605 1.098 . . . . 0.0 113.803 179.644 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 50.9 ttp180 -121.97 -20.78 6.22 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 126.551 1.94 . . . . 0.0 114.555 -176.592 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 5.4 t -67.74 142.84 56.14 Favored 'General case' 0 CA--C 1.544 0.728 0 CA-C-N 119.318 0.963 . . . . 0.0 112.973 -178.286 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 78.0 p -154.07 10.93 0.4 Allowed 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 126.669 1.987 . . . . 0.0 112.846 179.224 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 79.8 mtm-85 -68.5 161.82 26.97 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 126.026 1.731 . . . . 0.0 113.781 -178.507 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -116.04 -5.06 11.96 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 126.353 1.861 . . . . 0.0 112.849 177.023 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 62.1 m-20 -144.33 37.85 1.25 Allowed 'General case' 0 CA--C 1.552 1.03 0 C-N-CA 127.939 2.496 . . . . 0.0 109.912 -178.205 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 7.4 t -52.45 128.4 25.57 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 125.586 1.554 . . . . 0.0 112.167 -177.041 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 30.4 mtmt -84.64 4.49 32.15 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 125.07 1.348 . . . . 0.0 114.089 -177.374 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 86.8 m-85 -127.24 155.71 43.03 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 124.823 1.249 . . . . 0.0 112.173 -175.304 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -77.31 114.43 16.12 Favored 'General case' 0 N--CA 1.467 0.412 0 C-N-CA 123.699 0.799 . . . . 0.0 112.079 -177.306 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 9.3 m170 -69.57 115.16 30.09 Favored Pre-proline 0 CA--C 1.546 0.805 0 N-CA-C 107.741 -1.207 . . . . 0.0 107.741 173.849 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 92.9 Cg_exo -49.71 114.1 1.22 Allowed 'Trans proline' 0 CA--C 1.543 0.967 0 C-N-CA 124.554 3.503 . . . . 0.0 116.238 -174.887 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -77.42 149.76 27.81 Favored 'Trans proline' 0 CA--C 1.542 0.923 0 C-N-CA 122.114 1.876 . . . . 0.0 110.435 175.876 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 88.5 Cg_exo -46.87 -39.47 24.48 Favored 'Trans proline' 0 CA--C 1.539 0.739 0 C-N-CA 123.895 3.064 . . . . 0.0 115.437 -179.968 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 12.7 t-80 -70.71 -17.78 62.82 Favored 'General case' 0 N--CA 1.472 0.666 0 N-CA-C 115.08 1.511 . . . . 0.0 115.08 179.774 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.545 HD13 HD21 ' A' ' 16' ' ' LEU . 76.3 mt -113.32 -16.36 12.51 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 124.597 1.159 . . . . 0.0 113.009 178.143 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 53.6 mtpt -54.72 -34.73 62.82 Favored 'General case' 0 N--CA 1.478 0.964 0 CA-C-N 119.742 1.156 . . . . 0.0 111.533 174.365 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 23.0 m -63.75 -43.72 95.62 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 123.461 0.705 . . . . 0.0 111.329 175.805 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 91.1 mm-40 -67.22 -45.7 76.03 Favored 'General case' 0 N--CA 1.469 0.514 0 O-C-N 121.458 -0.776 . . . . 0.0 111.002 177.598 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 81.8 mt -61.82 -49.86 74.59 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 124.376 1.07 . . . . 0.0 112.285 178.467 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.35 -35.84 82.2 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-N 119.541 1.064 . . . . 0.0 112.735 -179.598 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 59.4 mt -62.58 -44.29 99.24 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.785 0 CA-C-N 118.759 0.709 . . . . 0.0 109.851 174.582 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 13.3 t-20 -63.98 -39.8 94.94 Favored 'General case' 0 CA--C 1.546 0.814 0 O-C-N 121.677 -0.639 . . . . 0.0 110.5 175.78 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -57.77 -47.91 85.46 Favored Glycine 0 CA--C 1.532 1.115 0 C-N-CA 124.858 1.218 . . . . 0.0 112.259 176.564 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 91.4 mtt-85 -58.15 -37.03 73.87 Favored 'General case' 0 N--CA 1.48 1.056 0 CA-C-N 118.525 1.163 . . . . 0.0 112.148 176.021 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 17.3 t-20 -76.05 -14.69 60.2 Favored 'General case' 0 CA--C 1.553 1.059 0 C-N-CA 124.897 1.279 . . . . 0.0 113.538 177.808 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 24.2 t-20 -99.85 -46.01 5.53 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 125.763 1.625 . . . . 0.0 112.185 -179.524 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 90.7 mt -74.91 9.28 1.97 Allowed 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 126.417 1.887 . . . . 0.0 114.995 -178.374 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 76.6 mt -48.96 -40.33 12.51 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.056 0 C-N-CA 125.512 1.525 . . . . 0.0 112.813 -179.149 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 91.1 mt-30 -59.57 -23.7 63.13 Favored 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 114.097 1.147 . . . . 0.0 114.097 179.249 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 24.2 tt0 -64.26 -22.1 66.83 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 124.357 1.063 . . . . 0.0 112.72 177.672 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -69.76 -15.24 63.1 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 125.14 1.376 . . . . 0.0 113.832 178.346 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 44.8 t30 . . . . . 0 CA--C 1.545 0.769 0 C-N-CA 125.103 1.361 . . . . 0.0 112.632 179.774 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.3 mpt? . . . . . 0 CA--C 1.545 0.757 0 N-CA-C 113.099 0.778 . . . . 0.0 113.099 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -139.19 15.5 2.61 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 125.807 1.643 . . . . 0.0 113.502 -179.128 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 33.4 m -57.87 -19.79 13.09 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.194 0 N-CA-C 114.734 1.383 . . . . 0.0 114.734 -179.378 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 45.4 p -75.08 -12.99 60.44 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 125.736 1.614 . . . . 0.0 114.291 177.591 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 26.9 m -126.28 159.87 34.54 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.75 0 C-N-CA 124.649 1.18 . . . . 0.0 113.423 -178.817 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 55.8 p -146.17 168.6 11.3 Favored Pre-proline 0 N--CA 1.474 0.769 0 C-N-CA 128.615 2.766 . . . . 0.0 108.53 -177.908 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 75.0 Cg_exo -48.84 -42.43 37.33 Favored 'Trans proline' 0 C--N 1.351 0.708 0 C-N-CA 122.807 2.338 . . . . 0.0 114.343 178.974 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 43.5 pt -71.47 -5.12 5.4 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 N-CA-C 114.647 1.351 . . . . 0.0 114.647 179.281 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 98.4 mtt180 -114.49 4.35 15.21 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 127.15 2.18 . . . . 0.0 111.975 176.741 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -135.04 -39.18 0.77 Allowed 'General case' 0 N--CA 1.473 0.683 0 N-CA-C 114.266 1.21 . . . . 0.0 114.266 -176.021 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 43.5 p -66.42 -6.53 14.82 Favored 'General case' 0 N--CA 1.482 1.172 0 N-CA-C 115.165 1.543 . . . . 0.0 115.165 179.477 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 22.8 tptm -51.87 -38.75 57.28 Favored 'General case' 0 N--CA 1.476 0.867 0 CA-C-N 119.945 1.248 . . . . 0.0 112.933 178.846 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -68.84 -32.97 73.04 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 123.817 0.847 . . . . 0.0 112.923 177.181 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 83.9 mt -85.13 -13.89 48.75 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 126.816 2.046 . . . . 0.0 114.017 -178.714 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 11.1 m -77.97 79.17 4.44 Favored 'General case' 0 N--CA 1.475 0.821 0 CA-C-O 122.442 1.115 . . . . 0.0 110.398 -178.538 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -75.64 140.78 42.76 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 128.492 2.717 . . . . 0.0 111.363 -177.612 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 14.5 mt-10 -74.47 151.49 39.56 Favored 'General case' 0 N--CA 1.472 0.664 0 O-C-N 120.49 -1.381 . . . . 0.0 112.179 177.917 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 13.9 m -83.46 155.77 3.76 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.765 0 C-N-CA 122.848 0.459 . . . . 0.0 110.605 175.372 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 40.5 t -75.0 130.12 38.82 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-O 121.646 0.736 . . . . 0.0 110.648 177.096 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 3.5 mpt_? -67.59 -28.68 67.97 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 124.355 1.062 . . . . 0.0 113.207 -177.32 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -82.26 -33.06 29.34 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 118.262 0.483 . . . . 0.0 110.831 178.436 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 72.9 t80 -64.96 -35.92 82.72 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 123.702 0.801 . . . . 0.0 109.657 172.938 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 60.2 mm-40 -65.01 -18.6 65.44 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 124.132 0.973 . . . . 0.0 112.591 173.786 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 47.9 mtp180 -106.67 3.26 26.59 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 126.481 1.912 . . . . 0.0 112.494 178.523 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 62.61 34.04 88.38 Favored Glycine 0 CA--C 1.537 1.417 0 C-N-CA 125.197 1.379 . . . . 0.0 113.606 -178.077 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 5.3 t -138.12 16.09 2.82 Favored 'General case' 0 N--CA 1.478 0.937 0 N-CA-C 115.464 1.653 . . . . 0.0 115.464 -174.854 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 7.5 t -64.71 168.79 5.69 Favored 'General case' 0 CA--C 1.558 1.277 0 CA-C-N 119.275 0.943 . . . . 0.0 111.441 175.647 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 50.7 m -128.95 7.2 5.54 Favored 'General case' 0 N--CA 1.48 1.046 0 N-CA-C 115.562 1.69 . . . . 0.0 115.562 -175.289 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 87.9 mtt180 -137.07 145.68 51.4 Favored Pre-proline 0 N--CA 1.474 0.748 0 C-N-CA 125.527 1.531 . . . . 0.0 111.921 -178.874 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 74.6 Cg_endo -69.26 167.66 23.13 Favored 'Trans proline' 0 CA--C 1.544 1.005 0 C-N-CA 122.231 1.954 . . . . 0.0 110.141 172.49 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -54.38 -31.19 54.24 Favored 'General case' 0 N--CA 1.48 1.038 0 O-C-N 121.079 -1.013 . . . . 0.0 112.492 177.543 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 23.5 p -71.33 -6.94 43.73 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 126.318 1.847 . . . . 0.0 114.982 177.206 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 29.4 mt-10 -132.56 -21.44 2.24 Favored 'General case' 0 N--CA 1.476 0.836 0 N-CA-C 116.342 1.979 . . . . 0.0 116.342 -176.27 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 3.7 t -72.19 169.87 15.23 Favored 'General case' 0 CA--C 1.552 1.037 0 CA-C-N 119.935 1.243 . . . . 0.0 114.214 -177.977 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 56.0 mtmt -88.26 -10.66 48.91 Favored 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 126.518 1.927 . . . . 0.0 114.081 -178.516 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 66.7 m-85 -139.33 171.63 13.99 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 127.301 2.24 . . . . 0.0 109.389 177.02 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -82.38 150.86 26.91 Favored 'General case' 0 CA--C 1.546 0.809 0 N-CA-C 114.644 1.349 . . . . 0.0 114.644 -175.894 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 57.4 m170 -122.88 88.28 50.52 Favored Pre-proline 0 CA--C 1.552 1.028 0 C-N-CA 126.017 1.727 . . . . 0.0 110.577 179.073 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 26.5 Cg_endo -61.79 148.06 93.92 Favored 'Trans proline' 0 C--N 1.352 0.731 0 C-N-CA 123.148 2.565 . . . . 0.0 114.569 -178.315 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 59.7 p -82.48 -178.92 7.24 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 124.405 1.082 . . . . 0.0 111.908 175.055 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 31.2 mmmt -61.43 -17.36 53.98 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 125.445 1.498 . . . . 0.0 113.352 173.383 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 50.5 m -109.2 -17.94 13.73 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 125.016 1.326 . . . . 0.0 114.535 -178.686 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 83.5 m -69.27 154.14 42.52 Favored 'General case' 0 CA--C 1.543 0.676 0 CA-C-N 119.704 1.138 . . . . 0.0 112.682 177.833 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 39.0 mt-30 -110.13 141.21 43.33 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 124.483 1.113 . . . . 0.0 111.466 178.807 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -133.38 148.34 30.97 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.558 0 C-N-CA 125.054 1.342 . . . . 0.0 112.632 -177.48 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -146.01 140.79 27.09 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 125.934 1.694 . . . . 0.0 110.524 177.015 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 7.3 t-20 46.51 30.7 1.14 Allowed 'General case' 0 CA--C 1.553 1.069 0 C-N-CA 126.083 1.753 . . . . 0.0 115.245 179.207 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 82.09 22.81 58.54 Favored Glycine 0 CA--C 1.537 1.425 0 O-C-N 121.044 -1.035 . . . . 0.0 114.19 -178.253 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 53.2 mtt85 -138.13 160.64 38.87 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 125.249 1.42 . . . . 0.0 112.088 -178.446 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 4.4 m -136.78 138.59 46.01 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.514 0 C-N-CA 127.733 2.413 . . . . 0.0 109.886 -176.99 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 20.6 mt -88.48 129.77 39.09 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.558 0 O-C-N 121.306 -0.871 . . . . 0.0 109.63 -179.033 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -75.39 147.2 40.21 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 123.84 0.856 . . . . 0.0 111.067 178.054 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 11.8 t -69.23 98.79 1.07 Allowed 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 124.489 1.115 . . . . 0.0 112.538 -177.094 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 30.8 p90 -60.91 -38.18 84.82 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.104 175.645 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 70.1 m-20 -62.14 -36.65 82.44 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 123.571 0.748 . . . . 0.0 111.695 177.098 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 29.6 t -66.67 -42.12 87.07 Favored 'General case' 0 CA--C 1.539 0.558 0 CA-C-N 119.613 1.097 . . . . 0.0 111.146 176.461 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 31.8 mt -67.75 -39.89 84.17 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 123.82 0.848 . . . . 0.0 112.836 176.573 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . 0.444 ' HA ' ' HE2' ' A' ' 58' ' ' LYS . 10.0 mmpt? -80.82 -7.55 59.45 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 125.034 1.334 . . . . 0.0 114.161 -179.397 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 78.26 39.45 22.86 Favored Glycine 0 CA--C 1.536 1.366 0 C-N-CA 124.428 1.013 . . . . 0.0 113.837 179.021 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 34.7 ttm105 -120.73 -27.42 5.07 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 126.805 2.042 . . . . 0.0 113.755 -177.17 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 7.2 t -65.81 127.26 31.27 Favored 'General case' 0 CA--C 1.544 0.741 0 CA-C-N 118.991 0.814 . . . . 0.0 112.229 -178.293 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 63.8 p -152.53 17.67 0.62 Allowed 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 126.475 1.91 . . . . 0.0 112.493 -178.968 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 81.9 mtt85 -61.62 153.68 27.2 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 126.445 1.898 . . . . 0.0 114.286 -177.869 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -75.54 -19.9 59.02 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 123.604 0.762 . . . . 0.0 110.853 171.01 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -158.99 131.01 6.56 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 128.128 2.571 . . . . 0.0 108.658 176.879 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 4.2 t -110.67 159.07 17.93 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 124.456 1.103 . . . . 0.0 111.159 -179.998 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 32.5 mtmt -117.55 2.7 12.4 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 125.723 1.609 . . . . 0.0 113.533 -177.304 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 88.4 m-85 -123.45 151.74 42.37 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 125.95 1.7 . . . . 0.0 110.461 -176.987 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -75.08 115.42 14.69 Favored 'General case' 0 N--CA 1.467 0.396 0 O-C-N 121.595 -0.69 . . . . 0.0 112.017 -176.331 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 14.4 m170 -70.53 114.0 22.77 Favored Pre-proline 0 CA--C 1.547 0.857 0 N-CA-C 108.199 -1.038 . . . . 0.0 108.199 175.161 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 66.4 Cg_exo -46.96 109.53 0.22 Allowed 'Trans proline' 0 CA--C 1.544 1.01 0 C-N-CA 125.074 3.849 . . . . 0.0 117.143 -174.168 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_endo -77.59 151.59 28.89 Favored 'Trans proline' 0 CA--C 1.544 1.013 0 C-N-CA 122.815 2.343 . . . . 0.0 111.35 176.462 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_exo -47.26 -40.67 27.94 Favored 'Trans proline' 0 CA--C 1.539 0.769 0 C-N-CA 123.916 3.077 . . . . 0.0 115.496 179.059 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 8.3 m-70 -70.64 -15.79 62.76 Favored 'General case' 0 N--CA 1.476 0.866 0 N-CA-C 114.87 1.433 . . . . 0.0 114.87 178.98 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 85.7 mt -116.42 -15.21 10.94 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 124.116 0.966 . . . . 0.0 113.562 178.956 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 54.9 mtpt -55.73 -32.32 63.26 Favored 'General case' 0 N--CA 1.475 0.808 0 CA-C-N 119.736 1.153 . . . . 0.0 110.527 172.944 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 21.5 m -62.82 -45.45 92.57 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 124.206 1.002 . . . . 0.0 111.227 174.811 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 77.6 mt-30 -64.94 -46.54 81.17 Favored 'General case' 0 CA--C 1.54 0.57 0 O-C-N 121.39 -0.819 . . . . 0.0 110.518 176.636 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 85.1 mt -61.92 -39.8 93.3 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 124.33 1.052 . . . . 0.0 112.711 178.164 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 20.1 mm-40 -55.71 -53.64 54.13 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 124.89 1.276 . . . . 0.0 110.428 174.975 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 62.3 mt -67.68 -38.63 80.71 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.428 0 C-N-CA 125.711 1.605 . . . . 0.0 111.074 -175.97 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 54.7 m-20 -62.32 -43.46 98.76 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 123.157 0.583 . . . . 0.0 110.394 172.65 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -64.04 -48.82 71.86 Favored Glycine 0 CA--C 1.527 0.832 0 C-N-CA 124.209 0.909 . . . . 0.0 111.81 178.558 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 83.1 mtt-85 -56.68 -37.89 71.49 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 124.842 1.257 . . . . 0.0 112.069 176.662 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 52.1 t30 -66.44 -12.46 57.28 Favored 'General case' 0 CA--C 1.553 1.064 0 C-N-CA 124.528 1.131 . . . . 0.0 113.881 175.953 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 47.5 m-80 -113.96 -21.91 10.36 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 125.779 1.632 . . . . 0.0 112.609 178.333 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 33.6 tp -64.83 -22.14 66.93 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 126.628 1.971 . . . . 0.0 113.199 178.105 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 29.6 pt -52.95 135.8 14.45 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.423 0 C-N-CA 126.936 2.094 . . . . 0.0 112.32 178.427 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 63.3 mm-40 -58.72 -17.62 24.43 Favored 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 124.765 1.226 . . . . 0.0 114.144 -179.97 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 54.7 tt0 -66.0 -18.59 65.44 Favored 'General case' 0 CA--C 1.55 0.979 0 C-N-CA 125.117 1.367 . . . . 0.0 112.529 174.829 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -132.19 -40.65 1.02 Allowed 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 125.699 1.6 . . . . 0.0 113.114 -179.967 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 58.2 t-20 . . . . . 0 CA--C 1.543 0.68 0 C-N-CA 125.705 1.602 . . . . 0.0 112.194 178.456 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 64.5 mtt . . . . . 0 CA--C 1.545 0.757 0 N-CA-C 113.467 0.914 . . . . 0.0 113.467 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -150.06 166.89 28.37 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 126.07 1.748 . . . . 0.0 111.849 179.555 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 10.7 p -150.63 153.36 10.35 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.914 0 C-N-CA 125.369 1.467 . . . . 0.0 111.044 179.529 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 62.9 p -70.42 166.22 20.84 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 124.952 1.301 . . . . 0.0 113.198 178.478 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 6.1 p -134.56 4.77 1.17 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.168 0 C-N-CA 125.184 1.393 . . . . 0.0 113.009 -179.536 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 18.6 p -141.91 153.73 64.52 Favored Pre-proline 0 N--CA 1.478 0.931 0 C-N-CA 126.739 2.016 . . . . 0.0 111.074 179.693 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 86.6 Cg_endo -71.71 164.93 34.1 Favored 'Trans proline' 0 CA--C 1.541 0.873 0 C-N-CA 123.298 2.665 . . . . 0.0 112.826 179.85 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 9.6 tp -147.35 149.42 15.58 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.762 0 C-N-CA 125.433 1.493 . . . . 0.0 110.868 178.772 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 35.4 ptt-85 -65.81 160.02 24.04 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 124.989 1.315 . . . . 0.0 114.208 -179.669 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -136.49 11.25 3.22 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 126.538 1.935 . . . . 0.0 112.886 178.608 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 16.9 p -69.78 2.61 3.19 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 127.772 2.429 . . . . 0.0 115.715 -179.19 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -40.55 -43.0 1.78 Allowed 'General case' 0 N--CA 1.481 1.114 0 C-N-CA 126.425 1.89 . . . . 0.0 116.02 -177.346 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -74.55 -22.61 58.92 Favored 'General case' 0 N--CA 1.476 0.875 0 N-CA-C 114.687 1.366 . . . . 0.0 114.687 -179.282 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 67.8 mt -86.09 -10.32 55.12 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 126.72 2.008 . . . . 0.0 114.091 -177.463 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 3.6 m -75.76 76.24 2.72 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 124.752 1.221 . . . . 0.0 110.922 -178.698 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.433 HD21 HD13 ' A' ' 75' ' ' LEU . 13.7 tp -75.43 140.76 43.1 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 127.684 2.394 . . . . 0.0 111.51 -177.099 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 47.1 mp0 -67.53 150.88 48.26 Favored 'General case' 0 CA--C 1.543 0.683 0 O-C-N 120.569 -1.332 . . . . 0.0 111.977 178.396 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 21.2 m -87.08 149.58 4.06 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.075 0 C-N-CA 122.915 0.486 . . . . 0.0 111.054 174.588 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . 0.434 ' SG ' ' NZ ' ' A' ' 35' ' ' LYS . 46.9 t -70.89 134.72 47.5 Favored 'General case' 0 CA--C 1.538 0.493 0 O-C-N 121.621 -0.675 . . . . 0.0 110.782 177.035 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 3.7 mpt_? -71.75 -33.39 68.62 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 125.521 1.528 . . . . 0.0 112.721 -178.09 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 34.9 mt-10 -73.91 -38.0 64.46 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 123.731 0.812 . . . . 0.0 110.498 178.539 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 76.8 t80 -63.15 -28.7 70.24 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 124.804 1.242 . . . . 0.0 111.922 177.237 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 53.4 mm-40 -64.04 -19.97 65.59 Favored 'General case' 0 N--CA 1.477 0.9 0 N-CA-C 112.982 0.734 . . . . 0.0 112.982 175.978 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 6.8 mpt_? -110.8 9.36 22.59 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 125.987 1.715 . . . . 0.0 111.865 177.732 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 58.47 35.05 77.92 Favored Glycine 0 CA--C 1.533 1.186 0 C-N-CA 125.065 1.317 . . . . 0.0 114.094 -179.831 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 6.4 t -129.24 8.81 5.58 Favored 'General case' 0 N--CA 1.478 0.959 0 N-CA-C 114.51 1.3 . . . . 0.0 114.51 -175.76 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 12.4 t -60.34 136.66 58.11 Favored 'General case' 0 CA--C 1.55 0.962 0 C-N-CA 123.555 0.742 . . . . 0.0 111.305 177.61 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 33.1 m -80.6 -1.96 44.36 Favored 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 115.984 1.846 . . . . 0.0 115.984 -176.302 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 23.1 mtm-85 -134.21 151.71 76.94 Favored Pre-proline 0 N--CA 1.479 0.991 0 C-N-CA 124.971 1.308 . . . . 0.0 113.277 -174.702 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 89.7 Cg_endo -71.22 167.7 25.45 Favored 'Trans proline' 0 CA--C 1.544 0.983 0 C-N-CA 122.553 2.169 . . . . 0.0 109.924 172.306 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -53.16 -28.52 26.69 Favored 'General case' 0 N--CA 1.475 0.808 0 N-CA-C 114.518 1.303 . . . . 0.0 114.518 178.776 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 12.4 p -75.99 -14.81 60.23 Favored 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 115.024 1.49 . . . . 0.0 115.024 179.057 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -121.42 -18.39 7.31 Favored 'General case' 0 N--CA 1.476 0.843 0 N-CA-C 116.711 2.115 . . . . 0.0 116.711 -173.122 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 2.9 t -72.81 172.23 11.2 Favored 'General case' 0 CA--C 1.55 0.966 0 N-CA-C 116.349 1.981 . . . . 0.0 116.349 -176.763 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.434 ' NZ ' ' SG ' ' A' ' 19' ' ' CYS . 7.0 ptpp? -75.2 -22.69 57.82 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 129.543 3.137 . . . . 0.0 115.274 -178.347 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 11.5 m-85 -144.08 176.36 9.36 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 126.678 1.991 . . . . 0.0 110.268 -176.632 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -77.26 147.57 36.23 Favored 'General case' 0 CA--C 1.548 0.894 0 O-C-N 121.137 -0.977 . . . . 0.0 113.428 -176.577 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 55.0 m170 -120.68 87.36 41.85 Favored Pre-proline 0 CA--C 1.552 1.037 0 C-N-CA 125.843 1.657 . . . . 0.0 110.623 179.854 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_endo -61.57 146.57 96.8 Favored 'Trans proline' 0 CA--C 1.539 0.768 0 C-N-CA 123.552 2.835 . . . . 0.0 115.014 -177.683 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 53.6 p -84.64 -174.7 5.42 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 125.148 1.379 . . . . 0.0 112.266 175.714 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -60.75 -22.12 63.71 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 125.712 1.605 . . . . 0.0 113.67 174.355 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 66.7 p -109.16 -19.75 13.23 Favored 'General case' 0 N--CA 1.478 0.94 0 N-CA-C 114.413 1.264 . . . . 0.0 114.413 179.444 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 98.4 m -60.51 129.87 43.77 Favored 'General case' 0 CA--C 1.542 0.667 0 CA-C-N 119.723 1.147 . . . . 0.0 112.54 179.296 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 48.6 tt0 -83.46 133.76 34.89 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 124.815 1.246 . . . . 0.0 110.395 178.904 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 21.5 t -116.9 141.94 32.9 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.929 0 C-N-CA 125.525 1.53 . . . . 0.0 109.939 -177.719 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 74.5 mm-40 -142.63 125.67 16.29 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 125.239 1.416 . . . . 0.0 111.303 -179.175 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 63.6 t30 42.17 38.16 1.06 Allowed 'General case' 0 CA--C 1.555 1.152 0 N-CA-C 116.708 2.114 . . . . 0.0 116.708 175.718 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 88.62 14.9 60.74 Favored Glycine 0 CA--C 1.536 1.398 0 O-C-N 120.869 -1.144 . . . . 0.0 115.082 -179.656 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 48.3 mtt-85 -139.82 168.48 19.73 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 126.341 1.857 . . . . 0.0 112.099 -178.988 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 3.5 m -139.85 138.17 38.6 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.539 0 C-N-CA 126.947 2.099 . . . . 0.0 109.491 179.636 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 70.8 mt -86.21 135.66 24.57 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.783 0 O-C-N 120.992 -1.068 . . . . 0.0 109.451 179.955 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -80.75 150.08 29.4 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 123.66 0.784 . . . . 0.0 112.454 178.687 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 7.5 t -70.09 94.16 0.86 Allowed 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 126.183 1.793 . . . . 0.0 110.135 -179.479 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 29.5 p90 -56.41 -37.66 70.48 Favored 'General case' 0 N--CA 1.471 0.587 0 O-C-N 121.069 -1.019 . . . . 0.0 112.118 -179.738 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 74.4 m-20 -60.45 -29.16 68.85 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 123.452 0.701 . . . . 0.0 112.276 177.623 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 47.8 p -71.14 -37.87 72.27 Favored 'General case' 0 N--CA 1.471 0.58 0 O-C-N 121.079 -1.013 . . . . 0.0 111.757 177.035 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 69.8 mt -74.16 -42.82 59.32 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.416 1.086 . . . . 0.0 111.876 176.74 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 31.2 mmmt -74.13 -11.96 60.45 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 124.766 1.227 . . . . 0.0 113.795 179.836 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 80.48 41.22 11.65 Favored Glycine 0 CA--C 1.536 1.355 0 C-N-CA 124.449 1.023 . . . . 0.0 114.052 178.462 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 48.4 ttp180 -127.06 -18.65 4.55 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 126.264 1.826 . . . . 0.0 114.834 -176.694 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 8.4 t -67.46 151.18 47.84 Favored 'General case' 0 CA--C 1.548 0.87 0 CA-C-N 119.286 0.948 . . . . 0.0 112.538 -179.818 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 88.4 p -149.13 2.43 0.57 Allowed 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 126.167 1.787 . . . . 0.0 114.036 -179.603 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 86.3 mtm-85 -88.45 175.12 7.74 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 126.551 1.941 . . . . 0.0 112.56 179.783 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -138.8 24.53 2.6 Favored 'General case' 0 CA--C 1.551 1.01 0 C-N-CA 126.772 2.029 . . . . 0.0 109.749 174.02 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 6.7 p-10 -147.54 10.89 0.97 Allowed 'General case' 0 CA--C 1.547 0.85 0 N-CA-C 115.577 1.695 . . . . 0.0 115.577 -173.789 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 3.8 m -50.03 148.17 3.5 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.805 1.242 . . . . 0.0 113.495 -178.355 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 22.6 mtmt -78.29 6.94 7.19 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 123.152 0.581 . . . . 0.0 111.918 173.485 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 58.0 m-85 -127.55 150.85 49.51 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 126.698 1.999 . . . . 0.0 111.214 -174.149 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -79.17 126.89 31.33 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 124.048 0.939 . . . . 0.0 113.285 -175.445 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 38.1 m170 -75.5 115.49 46.15 Favored Pre-proline 0 CA--C 1.548 0.872 0 N-CA-C 106.717 -1.586 . . . . 0.0 106.717 170.496 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 81.7 Cg_exo -53.2 122.52 11.31 Favored 'Trans proline' 0 CA--C 1.543 0.955 0 C-N-CA 123.659 2.906 . . . . 0.0 115.146 -175.552 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_endo -77.91 155.03 30.2 Favored 'Trans proline' 0 CA--C 1.542 0.908 0 C-N-CA 122.226 1.951 . . . . 0.0 111.119 177.5 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 80.4 Cg_exo -45.32 -37.12 13.68 Favored 'Trans proline' 0 CA--C 1.538 0.724 0 C-N-CA 124.306 3.337 . . . . 0.0 115.848 179.214 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 76.4 m80 -78.66 -13.21 59.94 Favored 'General case' 0 N--CA 1.474 0.729 0 N-CA-C 115.336 1.606 . . . . 0.0 115.336 -179.898 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.433 HD13 HD21 ' A' ' 16' ' ' LEU . 50.8 mt -118.7 -9.64 10.16 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.617 1.167 . . . . 0.0 113.252 177.732 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 56.3 mtpt -55.84 -39.2 71.08 Favored 'General case' 0 N--CA 1.481 1.096 0 CA-C-N 120.293 1.406 . . . . 0.0 110.098 171.209 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 20.4 m -62.63 -41.44 99.02 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 124.423 1.089 . . . . 0.0 111.463 175.026 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 47.2 tp60 -66.2 -42.34 88.94 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 124.311 1.044 . . . . 0.0 110.929 178.185 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 27.6 mt -67.74 -42.3 82.07 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-O 118.516 -0.754 . . . . 0.0 112.597 178.054 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 3.1 pt-20 -64.01 -36.83 85.28 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-N 119.869 1.213 . . . . 0.0 111.056 175.665 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 64.2 mt -63.06 -42.91 98.43 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.721 0 CA-C-N 118.97 0.805 . . . . 0.0 109.812 175.332 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 60.0 m-20 -60.97 -48.14 83.2 Favored 'General case' 0 CA--C 1.545 0.783 0 CA-C-N 118.495 0.589 . . . . 0.0 110.28 175.724 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -59.95 -46.25 94.46 Favored Glycine 0 N--CA 1.471 0.991 0 C-N-CA 124.955 1.265 . . . . 0.0 112.51 179.076 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 58.2 mtp180 -60.46 -13.53 14.15 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 125.832 1.653 . . . . 0.0 113.653 175.692 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 53.8 m-80 -114.42 7.57 16.33 Favored 'General case' 0 CA--C 1.553 1.084 0 C-N-CA 125.977 1.711 . . . . 0.0 112.462 177.738 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 28.7 t30 -121.35 -36.8 3.02 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 126.148 1.779 . . . . 0.0 112.221 179.609 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 68.9 mt -81.5 4.18 22.14 Favored 'General case' 0 CA--C 1.551 1.012 0 C-N-CA 126.422 1.889 . . . . 0.0 113.202 178.585 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 41.3 pt -57.62 157.71 1.42 Allowed 'Isoleucine or valine' 0 C--O 1.238 0.466 0 C-N-CA 127.679 2.391 . . . . 0.0 114.968 -177.916 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 5.9 tp-100 -59.76 138.81 57.67 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 124.991 1.316 . . . . 0.0 110.412 175.895 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 6.2 pt20 -147.96 2.91 0.7 Allowed 'General case' 0 CA--C 1.547 0.844 0 N-CA-C 114.827 1.417 . . . . 0.0 114.827 -176.066 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 63.7 tttp -64.77 144.18 57.43 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 124.786 1.234 . . . . 0.0 111.068 176.353 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 44.8 t30 . . . . . 0 CA--C 1.544 0.733 0 C-N-CA 124.429 1.092 . . . . 0.0 112.443 178.744 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.6 mmt . . . . . 0 CA--C 1.544 0.713 0 N-CA-C 113.217 0.821 . . . . 0.0 113.217 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -139.21 14.73 2.61 Favored 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 125.995 1.718 . . . . 0.0 113.31 -179.283 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 30.4 m -67.04 -15.38 19.55 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.145 0 C-N-CA 125.209 1.404 . . . . 0.0 114.527 -179.561 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 85.0 p -151.56 167.1 29.14 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 126.032 1.733 . . . . 0.0 111.711 179.582 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 27.2 m -131.06 2.03 2.02 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.263 0 C-N-CA 124.938 1.295 . . . . 0.0 114.277 -178.242 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 36.0 p -144.31 153.9 56.52 Favored Pre-proline 0 N--CA 1.48 1.047 0 C-N-CA 125.691 1.596 . . . . 0.0 111.047 178.199 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 95.9 Cg_endo -71.71 175.31 9.77 Favored 'Trans proline' 0 CA--C 1.54 0.81 0 C-N-CA 123.427 2.751 . . . . 0.0 112.852 179.596 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 50.3 pt -67.77 -8.59 9.0 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.022 0 N-CA-C 114.662 1.356 . . . . 0.0 114.662 178.928 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 19.8 mmm180 -57.41 117.84 4.54 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 125.955 1.702 . . . . 0.0 113.287 -179.505 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -63.54 -28.88 70.25 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 123.394 0.678 . . . . 0.0 111.637 175.169 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 32.6 p -74.18 5.55 4.32 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 126.071 1.748 . . . . 0.0 114.238 177.29 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 19.0 ptpt -51.07 -31.82 20.05 Favored 'General case' 0 N--CA 1.481 1.108 0 CA-C-N 120.555 1.525 . . . . 0.0 114.859 -179.424 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -78.93 -24.71 43.83 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 123.945 0.898 . . . . 0.0 112.992 176.945 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 71.3 mt -98.08 -18.3 18.61 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 126.536 1.934 . . . . 0.0 114.659 -177.119 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 6.5 m -77.19 77.76 3.73 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 124.508 1.123 . . . . 0.0 110.68 -178.01 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -75.7 143.43 42.13 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 129.022 2.929 . . . . 0.0 111.843 -177.758 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 52.3 mt-10 -71.08 151.29 44.67 Favored 'General case' 0 N--CA 1.472 0.651 0 O-C-N 120.695 -1.253 . . . . 0.0 112.386 177.212 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 15.7 m -84.11 155.79 3.66 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.03 0 C-N-CA 123.277 0.631 . . . . 0.0 111.286 174.04 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 52.8 t -75.59 133.34 40.95 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-O 121.852 0.834 . . . . 0.0 111.199 176.924 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 3.1 mpt_? -69.59 -26.62 64.54 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 124.716 1.207 . . . . 0.0 112.91 -178.876 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -82.79 -36.54 25.53 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 122.966 0.506 . . . . 0.0 109.906 177.353 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 61.3 t80 -65.27 -34.41 78.27 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 124.245 1.018 . . . . 0.0 110.344 175.161 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 12.0 mm100 -63.11 -14.2 45.62 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 124.527 1.131 . . . . 0.0 112.86 173.791 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 81.9 mtt85 -119.16 10.17 11.99 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 127.091 2.156 . . . . 0.0 112.083 -179.845 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 57.34 35.14 70.01 Favored Glycine 0 CA--C 1.534 1.26 0 C-N-CA 125.528 1.537 . . . . 0.0 114.304 -179.637 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 4.8 t -134.65 6.08 3.45 Favored 'General case' 0 N--CA 1.477 0.91 0 N-CA-C 115.205 1.557 . . . . 0.0 115.205 -174.604 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 17.6 t -58.82 128.65 38.28 Favored 'General case' 0 CA--C 1.547 0.835 0 O-C-N 120.938 -1.101 . . . . 0.0 111.037 177.374 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 78.5 p -83.92 6.55 21.31 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 125.616 1.567 . . . . 0.0 114.346 -178.371 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 61.6 mtm-85 -131.35 145.22 56.7 Favored Pre-proline 0 N--CA 1.471 0.618 0 C-N-CA 125.421 1.488 . . . . 0.0 113.979 -172.991 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 98.1 Cg_endo -70.29 166.19 29.08 Favored 'Trans proline' 0 CA--C 1.544 1.001 0 C-N-CA 122.225 1.95 . . . . 0.0 109.816 171.074 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -54.28 -29.23 46.44 Favored 'General case' 0 N--CA 1.476 0.843 0 O-C-N 121.142 -0.973 . . . . 0.0 113.423 176.692 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 30.6 p -73.82 -13.22 60.9 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 125.873 1.669 . . . . 0.0 115.092 178.9 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 29.9 mm-40 -115.94 -29.85 6.23 Favored 'General case' 0 N--CA 1.478 0.926 0 N-CA-C 115.182 1.549 . . . . 0.0 115.182 -177.073 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 4.1 t -65.12 166.5 9.48 Favored 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 115.499 1.666 . . . . 0.0 115.499 -173.883 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.36 -13.03 47.67 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 127.391 2.277 . . . . 0.0 112.524 -179.324 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 57.8 m-85 -137.67 175.97 9.12 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 126.383 1.873 . . . . 0.0 110.237 -179.296 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -83.55 150.89 25.67 Favored 'General case' 0 CA--C 1.544 0.726 0 N-CA-C 113.725 1.009 . . . . 0.0 113.725 -177.487 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 66.0 m170 -122.19 85.85 46.99 Favored Pre-proline 0 CA--C 1.55 0.975 0 C-N-CA 126.116 1.766 . . . . 0.0 111.001 -179.624 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_endo -63.09 144.93 93.52 Favored 'Trans proline' 0 C--N 1.351 0.709 0 C-N-CA 123.402 2.735 . . . . 0.0 114.694 -177.841 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 59.9 p -82.83 -175.76 5.96 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 124.608 1.163 . . . . 0.0 111.906 174.909 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 75.2 mmtt -61.1 -19.91 62.02 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 125.497 1.519 . . . . 0.0 113.481 173.524 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 68.6 p -109.17 -18.22 13.67 Favored 'General case' 0 N--CA 1.477 0.884 0 N-CA-C 114.863 1.431 . . . . 0.0 114.863 -179.594 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 91.2 m -62.74 139.66 58.69 Favored 'General case' 0 CA--C 1.543 0.694 0 CA-C-N 119.576 1.08 . . . . 0.0 113.723 -179.61 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 47.2 tp60 -80.76 130.03 34.85 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 125.422 1.489 . . . . 0.0 110.371 178.235 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 9.9 t -126.52 137.2 58.53 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.022 0 C-N-CA 125.324 1.45 . . . . 0.0 110.509 -178.012 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -147.07 130.89 17.04 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 125.293 1.437 . . . . 0.0 111.745 178.512 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 62.2 t30 40.12 38.85 0.55 Allowed 'General case' 0 CA--C 1.553 1.065 0 C-N-CA 127.211 2.204 . . . . 0.0 116.758 176.802 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 90.12 11.54 62.96 Favored Glycine 0 CA--C 1.537 1.42 0 O-C-N 121.016 -1.053 . . . . 0.0 115.299 179.41 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 44.7 mtm180 -135.91 164.36 28.13 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 125.622 1.569 . . . . 0.0 112.038 179.78 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 8.2 m -139.29 149.19 23.09 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.573 0 C-N-CA 127.581 2.352 . . . . 0.0 109.413 -179.628 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 40.2 mt -97.54 129.42 47.69 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.913 0 O-C-N 121.018 -1.051 . . . . 0.0 110.651 -177.527 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -74.58 145.76 43.1 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 124.125 0.97 . . . . 0.0 111.406 177.206 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 13.2 t -69.47 99.61 1.27 Allowed 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 124.828 1.251 . . . . 0.0 113.175 -176.683 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 41.3 p90 -61.89 -38.92 90.15 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 115.157 -0.929 . . . . 0.0 110.29 175.299 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 65.9 m-20 -60.79 -41.3 95.3 Favored 'General case' 0 CA--C 1.54 0.577 0 O-C-N 121.787 -0.571 . . . . 0.0 110.836 176.78 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 43.8 t -65.09 -41.76 94.72 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-N 119.548 1.067 . . . . 0.0 111.347 177.269 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 31.1 mt -65.41 -41.9 93.13 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 124.009 0.923 . . . . 0.0 112.923 176.492 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 31.4 mmmt -78.33 -12.59 60.01 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 124.948 1.299 . . . . 0.0 113.753 179.325 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 84.03 39.27 9.45 Favored Glycine 0 CA--C 1.536 1.395 0 C-N-CA 124.639 1.114 . . . . 0.0 114.078 179.281 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 50.4 tpt85 -123.09 -23.3 4.97 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 126.44 1.896 . . . . 0.0 114.879 -177.075 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 6.5 t -64.24 131.5 47.56 Favored 'General case' 0 CA--C 1.543 0.709 0 CA-C-N 119.437 1.017 . . . . 0.0 112.895 -176.829 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 48.4 m -141.86 12.0 2.04 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 126.765 2.026 . . . . 0.0 112.234 179.868 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 76.2 mtm-85 -73.48 155.95 38.71 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 125.741 1.617 . . . . 0.0 113.341 -178.135 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 35.7 mm-40 -111.95 -2.31 15.17 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 125.796 1.638 . . . . 0.0 112.275 176.398 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 28.6 m120 -143.13 32.43 1.36 Allowed 'General case' 0 CA--C 1.552 1.02 0 C-N-CA 127.303 2.241 . . . . 0.0 110.916 -177.749 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 8.0 t -51.76 132.79 31.61 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 125.973 1.709 . . . . 0.0 112.219 -177.465 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 26.1 mtmt -90.12 4.08 51.46 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 124.42 1.088 . . . . 0.0 113.365 -179.297 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 85.3 m-85 -120.91 148.85 43.5 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 122.052 0.93 . . . . 0.0 112.375 -174.409 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -73.01 114.27 10.97 Favored 'General case' 0 N--CA 1.464 0.271 0 C-N-CA 123.896 0.878 . . . . 0.0 111.566 -176.879 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 13.2 m170 -71.37 114.61 29.34 Favored Pre-proline 0 CA--C 1.548 0.87 0 N-CA-C 107.382 -1.34 . . . . 0.0 107.382 174.557 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 65.9 Cg_exo -48.74 116.45 2.14 Favored 'Trans proline' 0 CA--C 1.542 0.921 0 C-N-CA 124.611 3.54 . . . . 0.0 116.975 -174.096 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -75.99 149.36 32.71 Favored 'Trans proline' 0 CA--C 1.545 1.044 0 C-N-CA 122.265 1.977 . . . . 0.0 110.518 174.937 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_exo -46.16 -41.04 21.79 Favored 'Trans proline' 0 CA--C 1.537 0.674 0 C-N-CA 124.068 3.179 . . . . 0.0 115.685 -179.789 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 13.8 t-80 -69.38 -17.28 63.66 Favored 'General case' 0 N--CA 1.474 0.765 0 N-CA-C 114.984 1.476 . . . . 0.0 114.984 179.761 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 93.2 mt -112.85 -16.95 12.63 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 124.367 1.067 . . . . 0.0 113.029 178.197 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 54.7 mtpt -54.56 -37.43 65.45 Favored 'General case' 0 N--CA 1.478 0.973 0 CA-C-N 119.791 1.178 . . . . 0.0 111.623 174.798 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 21.9 m -62.24 -41.76 98.72 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 123.731 0.812 . . . . 0.0 111.495 176.469 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 16.5 mm100 -69.67 -45.33 68.6 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 123.734 0.814 . . . . 0.0 110.898 178.324 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 89.4 mt -62.69 -46.2 89.25 Favored 'General case' 0 N--CA 1.466 0.345 0 C-N-CA 124.077 0.951 . . . . 0.0 112.423 178.738 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -64.91 -36.94 85.98 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-N 119.651 1.114 . . . . 0.0 112.28 178.97 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 63.7 mt -65.21 -45.43 93.82 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.707 0 CA-C-N 118.803 0.729 . . . . 0.0 110.064 176.176 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 24.5 m-80 -64.01 -38.82 92.48 Favored 'General case' 0 CA--C 1.54 0.587 0 O-C-N 121.627 -0.67 . . . . 0.0 111.456 176.645 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -66.23 -49.92 54.28 Favored Glycine 0 CA--C 1.529 0.907 0 C-N-CA 123.948 0.785 . . . . 0.0 111.959 177.977 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 72.6 mtp85 -54.88 -33.8 62.32 Favored 'General case' 0 N--CA 1.48 1.035 0 CA-C-N 118.806 1.303 . . . . 0.0 112.953 178.223 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 35.9 m-80 -76.09 -2.15 29.45 Favored 'General case' 0 CA--C 1.552 1.049 0 C-N-CA 125.016 1.326 . . . . 0.0 114.173 176.423 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 53.0 m-80 -126.84 -35.3 2.31 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 125.332 1.453 . . . . 0.0 113.679 -179.94 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -78.08 -11.83 59.94 Favored 'General case' 0 CA--C 1.546 0.803 0 CA-C-N 119.381 0.991 . . . . 0.0 113.199 176.869 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 23.7 pt 0.95 68.31 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.483 1.18 0 C-N-CA 131.092 3.757 . . . . 0.0 117.376 -178.717 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 44.6 tt0 -156.37 161.79 40.11 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 126.767 2.027 . . . . 0.0 109.987 179.677 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -139.44 160.82 38.94 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 125.632 1.573 . . . . 0.0 112.389 -179.988 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 60.8 tttp -62.07 -35.04 77.45 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 125.193 1.397 . . . . 0.0 114.258 -178.727 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 48.4 t-20 . . . . . 0 CA--C 1.54 0.593 0 C-N-CA 125.099 1.359 . . . . 0.0 111.64 -179.547 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.541 0.615 0 N-CA-C 113.964 1.098 . . . . 0.0 113.964 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -55.29 -23.66 24.37 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 125.433 1.493 . . . . 0.0 114.572 -179.643 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 34.5 m -62.08 -17.6 18.11 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.878 0 C-N-CA 125.19 1.396 . . . . 0.0 113.75 176.986 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 47.4 m -57.71 -15.68 8.61 Favored 'General case' 0 N--CA 1.476 0.836 0 N-CA-C 115.157 1.54 . . . . 0.0 115.157 -179.692 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 27.5 m -60.32 -23.63 28.47 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.987 0 C-N-CA 124.586 1.154 . . . . 0.0 113.856 178.192 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 18.0 p -140.52 105.7 6.47 Favored Pre-proline 0 N--CA 1.475 0.805 0 C-N-CA 125.037 1.335 . . . . 0.0 110.591 178.811 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 94.9 Cg_endo -73.26 -14.16 25.6 Favored 'Trans proline' 0 C--N 1.352 0.761 0 C-N-CA 123.488 2.792 . . . . 0.0 115.207 -177.092 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 19.3 pt -56.97 -17.51 5.69 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.927 0 C-N-CA 126.035 1.734 . . . . 0.0 114.486 -179.171 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 37.0 mtt180 -58.06 -32.98 68.54 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 125.555 1.542 . . . . 0.0 111.665 176.281 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -72.96 -12.6 61.0 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 125.502 1.521 . . . . 0.0 113.774 178.201 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 38.7 p -124.57 5.23 8.26 Favored 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 125.682 1.593 . . . . 0.0 113.56 -179.179 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 83.0 tttt -43.21 -41.98 4.07 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 126.919 2.088 . . . . 0.0 115.335 -178.284 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 1.8 p90 -91.8 -8.22 47.32 Favored 'General case' 0 N--CA 1.474 0.73 0 N-CA-C 114.468 1.284 . . . . 0.0 114.468 -178.773 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 88.4 mt -95.84 -18.19 20.56 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 125.688 1.595 . . . . 0.0 114.766 -175.849 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 2.5 m -75.44 77.35 2.49 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 124.454 1.102 . . . . 0.0 111.898 -178.604 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -75.86 144.63 41.1 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 127.178 2.191 . . . . 0.0 111.534 -179.822 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 11.5 mt-10 -73.57 151.11 41.03 Favored 'General case' 0 N--CA 1.472 0.668 0 O-C-N 120.563 -1.336 . . . . 0.0 111.402 176.014 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 12.3 m -82.82 145.88 7.85 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.789 0 N-CA-C 108.543 -0.91 . . . . 0.0 108.543 173.237 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 42.0 t -60.21 127.52 32.25 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-O 121.687 0.756 . . . . 0.0 111.213 179.643 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.439 ' H ' ' HD2' ' A' ' 20' ' ' ARG . 3.6 mpt_? -60.06 -31.69 70.23 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 124.976 1.311 . . . . 0.0 112.94 -176.585 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 28.9 mm-40 -81.44 -34.86 31.23 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 123.343 0.657 . . . . 0.0 110.777 177.782 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 51.3 t80 -63.99 -24.92 67.9 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 124.364 1.066 . . . . 0.0 111.383 173.942 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 80.7 mt-30 -58.86 -23.9 61.45 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 123.533 0.733 . . . . 0.0 112.919 176.003 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -117.24 13.06 14.56 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 125.508 1.523 . . . . 0.0 111.943 176.895 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 62.06 37.5 94.55 Favored Glycine 0 CA--C 1.533 1.204 0 C-N-CA 125.014 1.293 . . . . 0.0 113.986 -178.937 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 7.2 t -127.24 18.46 7.03 Favored 'General case' 0 N--CA 1.479 1.001 0 N-CA-C 114.688 1.366 . . . . 0.0 114.688 -176.28 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 14.5 t -67.32 172.04 5.26 Favored 'General case' 0 CA--C 1.558 1.279 0 O-C-N 121.572 -0.705 . . . . 0.0 110.319 172.733 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 90.4 p -132.26 8.48 4.33 Favored 'General case' 0 N--CA 1.477 0.897 0 N-CA-C 115.088 1.514 . . . . 0.0 115.088 -176.001 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 62.3 mtm-85 -133.23 146.84 62.64 Favored Pre-proline 0 N--CA 1.471 0.62 0 C-N-CA 125.557 1.543 . . . . 0.0 112.424 -178.098 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 77.6 Cg_endo -69.28 166.74 25.96 Favored 'Trans proline' 0 CA--C 1.543 0.963 0 C-N-CA 121.95 1.767 . . . . 0.0 109.61 171.352 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -53.9 -30.98 48.49 Favored 'General case' 0 N--CA 1.477 0.879 0 O-C-N 121.034 -1.041 . . . . 0.0 112.91 176.781 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 40.5 p -72.94 -6.52 45.79 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 125.93 1.692 . . . . 0.0 115.015 178.637 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 18.5 mt-10 -128.08 -24.17 3.2 Favored 'General case' 0 N--CA 1.477 0.907 0 N-CA-C 115.333 1.605 . . . . 0.0 115.333 -177.773 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 3.1 t -70.18 166.28 20.3 Favored 'General case' 0 CA--C 1.546 0.791 0 N-CA-C 114.979 1.474 . . . . 0.0 114.979 -176.556 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 13.2 mmmm -83.37 -11.42 57.64 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 127.057 2.143 . . . . 0.0 113.1 179.557 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 77.0 m-85 -140.43 173.79 11.16 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 126.417 1.887 . . . . 0.0 110.763 -178.125 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -80.17 152.94 28.93 Favored 'General case' 0 CA--C 1.545 0.778 0 O-C-N 121.224 -0.923 . . . . 0.0 113.224 -178.642 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 61.3 m170 -127.04 90.16 50.13 Favored Pre-proline 0 CA--C 1.552 1.039 0 C-N-CA 125.718 1.607 . . . . 0.0 110.307 179.398 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 33.9 Cg_endo -63.19 165.76 16.31 Favored 'Trans proline' 0 CA--C 1.541 0.85 0 C-N-CA 123.685 2.923 . . . . 0.0 114.903 -178.223 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 85.7 p -128.1 -174.22 3.15 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 126.385 1.874 . . . . 0.0 112.687 178.928 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 61.9 pttt -38.53 -37.51 0.32 Allowed 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 128.823 2.849 . . . . 0.0 117.902 -178.216 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 33.1 p -109.19 -16.4 14.09 Favored 'General case' 0 N--CA 1.476 0.842 0 N-CA-C 115.028 1.492 . . . . 0.0 115.028 -177.898 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 80.4 m -61.21 128.3 35.73 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 124.319 1.048 . . . . 0.0 113.33 -177.764 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 44.6 tt0 -81.71 128.96 34.53 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 125.329 1.452 . . . . 0.0 110.008 178.105 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 17.6 t -122.42 134.07 66.74 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.918 0 C-N-CA 125.489 1.515 . . . . 0.0 109.663 -178.226 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -142.92 130.83 21.64 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 125.142 1.377 . . . . 0.0 110.703 -179.576 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 46.1 36.14 2.95 Favored 'General case' 0 CA--C 1.555 1.148 0 C-N-CA 126.177 1.791 . . . . 0.0 115.169 179.47 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 80.54 19.41 68.62 Favored Glycine 0 CA--C 1.537 1.429 0 O-C-N 120.969 -1.082 . . . . 0.0 114.66 -179.592 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 45.3 mtt180 -137.14 161.25 36.66 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 125.901 1.68 . . . . 0.0 111.179 -179.292 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 3.0 m -138.17 137.75 43.96 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.512 0 C-N-CA 127.143 2.177 . . . . 0.0 109.647 -176.877 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 75.8 mt -87.67 131.04 36.37 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.743 0 O-C-N 121.083 -1.011 . . . . 0.0 109.294 179.273 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -73.84 149.27 41.71 Favored 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 123.91 0.884 . . . . 0.0 111.926 177.694 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 8.0 t -67.38 95.64 0.46 Allowed 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 125.19 1.396 . . . . 0.0 111.681 -177.909 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 22.2 p90 -58.16 -36.63 73.3 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 123.673 0.789 . . . . 0.0 111.176 177.817 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 73.1 m-20 -61.02 -34.89 75.55 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 123.099 0.56 . . . . 0.0 111.863 177.137 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 25.3 p -68.51 -41.61 79.74 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-N 119.019 0.827 . . . . 0.0 111.666 177.4 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 38.5 mt -71.5 -40.24 70.32 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 125.183 1.393 . . . . 0.0 113.187 178.165 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . 0.428 ' HA ' ' HE2' ' A' ' 58' ' ' LYS . 11.3 mmpt? -83.46 -10.23 58.5 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 124.794 1.238 . . . . 0.0 114.122 -179.21 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 82.02 39.19 11.88 Favored Glycine 0 CA--C 1.536 1.396 0 C-N-CA 124.319 0.961 . . . . 0.0 114.725 177.773 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 6.9 tpm_? -124.41 -9.78 7.47 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 126.186 1.794 . . . . 0.0 113.863 -178.272 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -56.76 125.12 20.93 Favored 'General case' 0 CA--C 1.544 0.712 0 CA-C-N 119.22 0.918 . . . . 0.0 112.544 -177.349 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 14.7 m -137.93 32.08 2.44 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 126.282 1.833 . . . . 0.0 111.875 -174.658 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 84.0 mtm-85 -130.71 174.11 10.26 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 126.38 1.872 . . . . 0.0 113.418 -175.694 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 76.5 mm-40 -137.83 23.23 2.86 Favored 'General case' 0 CA--C 1.555 1.142 0 C-N-CA 127.65 2.38 . . . . 0.0 109.219 174.075 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 5.5 p-10 -151.67 21.73 0.7 Allowed 'General case' 0 CA--C 1.549 0.94 0 C-N-CA 126.11 1.764 . . . . 0.0 115.075 -171.386 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 38.9 m -51.21 145.01 8.51 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 124.205 1.002 . . . . 0.0 113.696 -178.254 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 24.6 mtmt -88.81 7.79 32.29 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 123.817 0.847 . . . . 0.0 111.682 173.375 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 63.7 m-85 -127.14 148.72 50.16 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 125.818 1.647 . . . . 0.0 111.641 -172.488 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -74.17 117.19 15.69 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 124.168 0.987 . . . . 0.0 113.06 -175.951 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 6.3 m170 -65.21 129.96 94.62 Favored Pre-proline 0 CA--C 1.547 0.835 0 N-CA-C 106.612 -1.625 . . . . 0.0 106.612 170.776 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 83.3 Cg_endo -72.11 120.6 6.91 Favored 'Trans proline' 0 CA--C 1.545 1.057 0 C-N-CA 122.562 2.175 . . . . 0.0 113.142 -172.338 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -75.66 150.85 35.92 Favored 'Trans proline' 0 CA--C 1.541 0.87 0 C-N-CA 122.884 2.39 . . . . 0.0 111.063 178.021 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 84.9 Cg_exo -47.23 -39.01 26.64 Favored 'Trans proline' 0 CA--C 1.537 0.668 0 C-N-CA 123.863 3.042 . . . . 0.0 115.257 179.592 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 7.5 t-80 -69.36 -17.72 63.72 Favored 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 115.057 1.503 . . . . 0.0 115.057 179.452 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 93.4 mt -114.55 -15.61 11.99 Favored 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 124.854 1.262 . . . . 0.0 112.953 178.224 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 57.0 mtpt -54.89 -35.4 64.07 Favored 'General case' 0 N--CA 1.477 0.876 0 CA-C-N 119.736 1.153 . . . . 0.0 111.149 173.591 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 15.3 m -63.3 -41.23 98.94 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 123.902 0.881 . . . . 0.0 111.699 175.917 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 91.0 mm-40 -70.4 -44.44 67.98 Favored 'General case' 0 N--CA 1.468 0.452 0 O-C-N 121.268 -0.895 . . . . 0.0 111.05 177.281 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 95.5 mt -62.5 -40.48 96.86 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 123.748 0.819 . . . . 0.0 111.529 177.629 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 8.2 mm-40 -52.02 -56.12 16.28 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 124.884 1.274 . . . . 0.0 110.639 174.331 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 72.9 mt -68.79 -45.66 80.62 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.25 0 C-N-CA 125.798 1.639 . . . . 0.0 111.977 -173.781 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 38.5 m-80 -64.25 -34.64 78.57 Favored 'General case' 0 CA--C 1.542 0.645 0 CA-C-N 119.069 0.85 . . . . 0.0 111.501 175.878 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -70.25 -52.16 19.01 Favored Glycine 0 CA--C 1.528 0.886 0 C-N-CA 123.684 0.659 . . . . 0.0 111.663 176.738 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 53.0 mtp180 -58.04 -36.18 72.38 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 124.66 1.184 . . . . 0.0 112.485 177.869 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 88.3 m-20 -66.94 -9.59 40.06 Favored 'General case' 0 CA--C 1.551 0.994 0 N-CA-C 113.918 1.081 . . . . 0.0 113.918 175.438 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 58.3 m-80 -120.99 -19.71 7.12 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 125.578 1.551 . . . . 0.0 113.147 178.907 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 47.1 tp -65.28 -24.55 67.34 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 125.814 1.646 . . . . 0.0 112.796 177.826 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 31.2 pt -55.74 150.39 2.63 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.544 0 C-N-CA 127.134 2.173 . . . . 0.0 113.192 178.088 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 78.1 mt-30 -130.74 8.73 4.92 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 125.504 1.521 . . . . 0.0 113.492 -178.932 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 14.5 pt20 -71.13 166.63 21.04 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 125.111 1.364 . . . . 0.0 113.408 178.982 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 8.7 mptt -135.73 160.31 38.93 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 126.23 1.812 . . . . 0.0 110.947 178.31 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 47.2 t-20 . . . . . 0 CA--C 1.542 0.64 0 C-N-CA 125.267 1.427 . . . . 0.0 111.465 -179.841 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.6 ttt . . . . . 0 CA--C 1.545 0.757 0 N-CA-C 112.834 0.679 . . . . 0.0 112.834 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -118.91 5.79 11.41 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 126.09 1.756 . . . . 0.0 113.344 179.722 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 26.9 m -130.4 6.38 2.16 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.197 0 C-N-CA 126.344 1.857 . . . . 0.0 113.02 -179.218 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 63.3 p -121.88 -0.37 9.58 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 125.94 1.696 . . . . 0.0 114.758 -176.995 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 27.4 m -132.44 24.16 1.42 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.199 0 C-N-CA 126.358 1.863 . . . . 0.0 112.497 -178.743 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 41.0 p -58.66 153.46 40.96 Favored Pre-proline 0 N--CA 1.477 0.898 0 C-N-CA 126.307 1.843 . . . . 0.0 113.08 179.739 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -64.0 -15.7 50.69 Favored 'Trans proline' 0 CA--C 1.539 0.749 0 C-N-CA 123.156 2.57 . . . . 0.0 115.311 -178.705 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 45.1 pt -79.19 33.56 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.547 0.848 0 C-N-CA 126.16 1.784 . . . . 0.0 113.987 179.872 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 6.9 mmp_? -52.63 127.35 22.67 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 125.218 1.407 . . . . 0.0 110.856 178.136 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -62.85 145.42 55.1 Favored 'General case' 0 CA--C 1.543 0.696 0 CA-C-O 121.698 0.761 . . . . 0.0 113.001 -179.947 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 32.4 p -134.73 -0.67 2.83 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 126.25 1.82 . . . . 0.0 112.797 177.331 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 20.9 ttmt -54.23 -44.98 72.18 Favored 'General case' 0 N--CA 1.478 0.974 0 CA-C-N 120.077 1.308 . . . . 0.0 111.701 178.41 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -69.54 -25.43 64.01 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 124.541 1.137 . . . . 0.0 113.376 178.003 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 94.7 mt -91.93 -17.52 25.06 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 126.061 1.744 . . . . 0.0 114.762 -177.32 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 17.1 m -78.49 74.7 5.02 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 124.567 1.147 . . . . 0.0 111.534 -177.717 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.5 HD21 HD13 ' A' ' 75' ' ' LEU . 10.4 tp -75.8 147.63 39.05 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 127.399 2.28 . . . . 0.0 112.039 -178.647 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 9.5 mt-10 -73.46 150.84 41.35 Favored 'General case' 0 N--CA 1.473 0.684 0 O-C-N 120.54 -1.35 . . . . 0.0 113.095 179.351 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 17.9 m -82.67 153.25 3.93 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.768 0 C-N-CA 122.833 0.453 . . . . 0.0 111.212 175.201 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 48.2 t -74.29 135.43 42.6 Favored 'General case' 0 CA--C 1.539 0.526 0 N-CA-C 109.766 -0.457 . . . . 0.0 109.766 174.911 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 5.3 mpt_? -71.99 -41.21 67.93 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 125.203 1.401 . . . . 0.0 112.856 -177.087 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 17.1 mm-40 -72.69 -33.72 66.7 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 124.414 1.086 . . . . 0.0 111.773 179.969 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 83.5 t80 -62.18 -26.62 68.44 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 124.093 0.957 . . . . 0.0 111.759 175.29 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 77.4 mm-40 -60.61 -20.92 61.96 Favored 'General case' 0 N--CA 1.478 0.926 0 N-CA-C 113.637 0.977 . . . . 0.0 113.637 176.79 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -117.06 13.72 14.85 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 125.693 1.597 . . . . 0.0 112.106 177.083 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 59.14 36.8 90.2 Favored Glycine 0 CA--C 1.533 1.203 0 C-N-CA 125.092 1.329 . . . . 0.0 114.145 -179.78 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 7.2 t -127.54 13.18 7.0 Favored 'General case' 0 N--CA 1.479 1.01 0 N-CA-C 114.48 1.289 . . . . 0.0 114.48 -175.941 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 27.9 t -62.96 137.6 58.31 Favored 'General case' 0 CA--C 1.551 1.004 0 O-C-N 121.435 -0.79 . . . . 0.0 111.749 177.283 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 32.7 m -77.46 -2.99 38.14 Favored 'General case' 0 N--CA 1.475 0.814 0 N-CA-C 115.604 1.705 . . . . 0.0 115.604 -177.501 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 87.3 mtt180 -135.25 148.23 65.49 Favored Pre-proline 0 N--CA 1.475 0.797 0 C-N-CA 125.687 1.595 . . . . 0.0 112.561 -176.825 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -68.96 166.09 27.77 Favored 'Trans proline' 0 CA--C 1.543 0.959 0 C-N-CA 122.241 1.961 . . . . 0.0 110.132 173.348 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 7.4 p-10 -53.51 -28.66 32.34 Favored 'General case' 0 N--CA 1.475 0.792 0 N-CA-C 114.18 1.178 . . . . 0.0 114.18 178.817 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 12.6 p -77.94 -8.91 58.76 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 125.809 1.644 . . . . 0.0 115.02 178.452 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 39.5 mm-40 -124.9 -19.97 5.1 Favored 'General case' 0 N--CA 1.477 0.895 0 N-CA-C 116.315 1.968 . . . . 0.0 116.315 -172.908 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 4.7 t -69.73 170.13 11.53 Favored 'General case' 0 CA--C 1.551 1.011 0 N-CA-C 114.988 1.477 . . . . 0.0 114.988 -177.05 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -89.15 -6.99 56.56 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 127.877 2.471 . . . . 0.0 113.785 -179.762 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 56.2 m-85 -140.41 169.73 17.12 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 126.23 1.812 . . . . 0.0 110.507 178.328 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -78.61 145.93 34.43 Favored 'General case' 0 CA--C 1.548 0.866 0 O-C-N 121.12 -0.987 . . . . 0.0 113.3 -176.753 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 21.4 m170 -120.38 89.23 43.56 Favored Pre-proline 0 CA--C 1.555 1.141 0 C-N-CA 126.047 1.739 . . . . 0.0 110.535 -178.386 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -67.2 173.24 8.84 Favored 'Trans proline' 0 CA--C 1.542 0.924 0 C-N-CA 123.789 2.993 . . . . 0.0 114.943 -178.651 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 73.8 p -129.28 -178.9 4.85 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 126.089 1.756 . . . . 0.0 111.234 175.212 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 29.9 mtpp -49.89 -31.73 12.86 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 126.42 1.888 . . . . 0.0 115.203 -179.884 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 17.5 m -92.76 -25.63 18.09 Favored 'General case' 0 N--CA 1.477 0.913 0 N-CA-C 114.324 1.231 . . . . 0.0 114.324 -178.619 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 59.2 m -63.16 143.06 58.12 Favored 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 114.615 1.339 . . . . 0.0 114.615 -176.793 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 22.2 mt-30 -85.04 132.33 34.34 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 124.944 1.298 . . . . 0.0 110.844 176.689 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 12.8 t -129.11 135.28 62.36 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.731 0 C-N-CA 124.919 1.288 . . . . 0.0 110.677 -178.454 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -146.31 131.88 18.79 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 125.057 1.343 . . . . 0.0 111.234 178.218 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 63.0 t30 41.98 37.71 0.89 Allowed 'General case' 0 CA--C 1.553 1.076 0 C-N-CA 126.835 2.054 . . . . 0.0 116.379 177.405 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 85.78 16.17 64.1 Favored Glycine 0 CA--C 1.536 1.386 0 O-C-N 120.944 -1.098 . . . . 0.0 114.987 -179.751 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 66.5 mtt180 -136.02 161.15 36.47 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 125.6 1.56 . . . . 0.0 111.388 -179.633 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 3.1 m -139.21 144.24 29.64 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.62 0 C-N-CA 127.433 2.293 . . . . 0.0 109.562 -176.965 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 8.7 mt -94.81 126.72 47.18 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.764 0 O-C-N 121.385 -0.822 . . . . 0.0 110.811 -176.746 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -71.15 147.53 48.27 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 124.311 1.045 . . . . 0.0 112.032 178.186 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 23.7 t -70.27 99.87 1.61 Allowed 'General case' 0 C--O 1.24 0.563 0 C-N-CA 125.06 1.344 . . . . 0.0 112.301 -177.894 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 41.0 p90 -61.68 -38.18 86.84 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 115.413 -0.812 . . . . 0.0 110.316 175.531 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 62.2 m-20 -60.72 -44.33 96.77 Favored 'General case' 0 CA--C 1.539 0.545 0 O-C-N 121.856 -0.527 . . . . 0.0 110.444 176.402 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 37.7 t -64.48 -42.91 95.59 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 119.761 1.164 . . . . 0.0 111.447 177.51 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 30.7 mt -62.13 -40.46 96.0 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 124.179 0.992 . . . . 0.0 113.049 176.625 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 31.2 mmmt -83.19 -9.46 59.15 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 124.99 1.316 . . . . 0.0 113.856 179.266 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 81.82 38.36 14.04 Favored Glycine 0 CA--C 1.536 1.402 0 C-N-CA 124.642 1.115 . . . . 0.0 114.269 179.281 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 19.7 tpp180 -120.46 -22.4 6.47 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 126.568 1.947 . . . . 0.0 114.67 -176.893 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 5.4 t -66.25 144.79 56.39 Favored 'General case' 0 CA--C 1.546 0.789 0 CA-C-N 119.277 0.944 . . . . 0.0 113.372 -177.391 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 86.6 p -153.68 9.07 0.39 Allowed 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 126.799 2.04 . . . . 0.0 113.164 179.682 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 76.4 mtm-85 -67.82 162.89 23.02 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 126.137 1.775 . . . . 0.0 113.969 -178.349 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -122.97 8.29 9.3 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 126.376 1.87 . . . . 0.0 112.181 176.512 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -152.34 33.15 0.52 Allowed 'General case' 0 CA--C 1.551 1.012 0 C-N-CA 127.885 2.474 . . . . 0.0 110.053 -179.712 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 7.0 t -51.17 125.61 14.42 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 125.636 1.574 . . . . 0.0 112.276 -176.679 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 32.2 mtmt -84.8 8.15 18.26 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 124.742 1.217 . . . . 0.0 114.137 -176.971 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 89.0 m-85 -128.61 157.74 40.43 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 125.696 1.598 . . . . 0.0 111.488 -177.066 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -79.5 114.02 18.11 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 124.122 0.969 . . . . 0.0 112.289 -177.015 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 10.4 m170 -68.62 119.17 66.97 Favored Pre-proline 0 CA--C 1.545 0.764 0 N-CA-C 105.7 -1.963 . . . . 0.0 105.7 170.966 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -71.46 128.86 14.99 Favored 'Trans proline' 0 CA--C 1.542 0.906 0 C-N-CA 121.865 1.71 . . . . 0.0 114.556 -169.906 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 97.6 Cg_endo -78.69 155.22 27.3 Favored 'Trans proline' 0 CA--C 1.543 0.929 0 C-N-CA 123.403 2.735 . . . . 0.0 112.116 178.751 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 82.9 Cg_exo -45.97 -39.81 19.91 Favored 'Trans proline' 0 CA--C 1.54 0.782 0 C-N-CA 124.454 3.436 . . . . 0.0 115.976 179.385 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 18.3 m-70 -71.48 -15.71 62.33 Favored 'General case' 0 N--CA 1.477 0.89 0 N-CA-C 114.965 1.468 . . . . 0.0 114.965 179.356 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.5 HD13 HD21 ' A' ' 16' ' ' LEU . 78.6 mt -115.36 -18.06 11.13 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 124.468 1.107 . . . . 0.0 113.109 -179.776 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 59.2 mtpt -54.56 -38.23 66.41 Favored 'General case' 0 N--CA 1.476 0.849 0 CA-C-N 119.661 1.119 . . . . 0.0 111.328 173.872 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 25.0 m -62.58 -42.66 99.69 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 124.115 0.966 . . . . 0.0 111.673 176.235 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 89.4 mm-40 -67.25 -44.58 79.05 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 123.739 0.815 . . . . 0.0 110.807 178.323 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 93.2 mt -62.24 -46.54 88.41 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 123.992 0.917 . . . . 0.0 112.341 178.417 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -65.14 -30.48 71.41 Favored 'General case' 0 N--CA 1.476 0.838 0 CA-C-N 120.044 1.293 . . . . 0.0 113.191 178.863 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 64.1 mt -71.73 -43.49 70.04 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.757 0 O-C-N 121.367 -0.833 . . . . 0.0 109.583 175.744 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 22.8 m-80 -64.96 -33.72 76.7 Favored 'General case' 0 CA--C 1.542 0.654 0 O-C-N 121.683 -0.636 . . . . 0.0 111.289 174.826 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -62.86 -48.32 81.89 Favored Glycine 0 CA--C 1.528 0.848 0 C-N-CA 124.518 1.056 . . . . 0.0 111.414 177.193 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' ARG . . . . . . . . . . . . . 82.2 mtt85 -55.21 -32.7 62.46 Favored 'General case' 0 N--CA 1.482 1.128 0 CA-C-N 118.477 1.139 . . . . 0.0 112.926 175.833 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 17.0 t-20 -78.7 -9.25 59.34 Favored 'General case' 0 CA--C 1.552 1.034 0 C-N-CA 125.105 1.362 . . . . 0.0 114.13 178.582 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 63.7 m-80 -126.13 -25.93 3.47 Favored 'General case' 0 N--CA 1.476 0.868 0 N-CA-C 114.923 1.453 . . . . 0.0 114.923 -177.399 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 95.0 mt -78.25 43.83 0.47 Allowed 'General case' 0 CA--C 1.551 1.018 0 C-N-CA 126.459 1.904 . . . . 0.0 111.574 176.877 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 97.3 mt -60.64 -28.21 42.27 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.823 0 C-N-CA 127.107 2.163 . . . . 0.0 112.986 -177.129 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 1.9 tm0? -139.12 133.84 32.06 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.643 1.177 . . . . 0.0 110.585 179.141 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 6.6 tp-100 -50.68 -29.6 11.6 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 126.373 1.869 . . . . 0.0 115.415 -177.572 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 59.8 mttp -62.05 -22.24 65.59 Favored 'General case' 0 N--CA 1.476 0.866 0 N-CA-C 114.76 1.393 . . . . 0.0 114.76 179.724 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 32.6 t-20 . . . . . 0 N--CA 1.471 0.608 0 CA-C-N 119.635 1.107 . . . . 0.0 112.974 179.129 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_