data_2jv1_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 2jv1 _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 44.6 t . . . . . 0 N--CA 1.481 1.119 0 N-CA-C 112.315 0.487 . . . . 0.0 112.315 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -95.19 -52.95 3.97 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-N 119.478 1.035 . . . . 0.0 111.702 164.399 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 68.9 tp60 -64.18 -33.81 76.65 Favored 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 113.087 0.773 . . . . 0.0 113.087 -169.268 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 98.2 m -85.78 -28.17 24.72 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 119.5 1.045 . . . . 0.0 113.387 176.46 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 45.4 t -97.38 -60.1 1.65 Allowed 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 123.385 0.674 . . . . 0.0 112.65 -171.382 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 35.6 m -73.49 -41.71 62.75 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 125.748 1.619 . . . . 0.0 110.141 -179.157 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.4 t -102.49 -163.39 1.0 Allowed 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 124.045 0.938 . . . . 0.0 111.189 165.328 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 35.0 mt -108.25 145.1 15.73 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.743 0 C-N-CA 125.8 1.64 . . . . 0.0 110.499 175.916 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 10.2 p -133.32 163.83 28.45 Favored 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 112.957 0.725 . . . . 0.0 112.957 169.186 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 65.6 p -101.52 161.97 13.24 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 124.514 1.126 . . . . 0.0 113.703 176.519 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 52.5 mt -62.56 -34.37 76.81 Favored 'General case' 0 CA--C 1.539 0.532 0 O-C-N 121.308 -0.87 . . . . 0.0 111.696 171.0 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 91.2 t80 -63.61 -32.84 74.44 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 124.056 0.942 . . . . 0.0 112.748 173.356 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 91.6 mt-30 -73.62 -39.82 64.25 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-O 118.293 -0.861 . . . . 0.0 111.682 171.673 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 84.7 mt -59.82 -34.08 72.61 Favored 'General case' 0 N--CA 1.476 0.857 0 CA-C-N 119.825 1.193 . . . . 0.0 112.175 173.448 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 26.5 tt0 -60.56 -24.29 65.3 Favored 'General case' 0 CA--C 1.548 0.892 0 N-CA-C 113.326 0.861 . . . . 0.0 113.326 178.854 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 30.7 t30 -65.59 -25.65 67.5 Favored 'General case' 0 CA--C 1.546 0.799 0 O-C-N 121.046 -1.034 . . . . 0.0 113.058 173.837 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 97.0 m-85 -99.11 2.5 46.06 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 125.404 1.482 . . . . 0.0 113.899 -174.515 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 57.6 m . . . . . 0 CA--C 1.543 0.683 0 C-N-CA 123.871 0.868 . . . . 0.0 112.768 165.358 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 2.9 p-10 . . . . . 0 CA--C 1.538 0.512 0 N-CA-C 112.548 0.573 . . . . 0.0 112.548 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 30.2 mm-40 -153.79 168.58 25.82 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 125.084 1.354 . . . . 0.0 112.007 -168.147 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 80.0 m-70 -82.61 129.06 34.87 Favored 'General case' 0 CA--C 1.545 0.765 0 N-CA-C 109.241 -0.652 . . . . 0.0 109.241 155.289 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 79.7 mt -142.37 125.19 16.03 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 126.74 2.016 . . . . 0.0 108.977 -177.355 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 79.0 m -132.43 143.98 50.17 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 124.943 1.297 . . . . 0.0 111.392 -174.222 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 55.42 -122.52 26.77 Favored Glycine 0 N--CA 1.474 1.218 0 C-N-CA 124.923 1.249 . . . . 0.0 113.861 168.037 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 22.2 m -61.73 -33.43 74.02 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 123.747 0.819 . . . . 0.0 111.554 -179.644 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 20.9 m80 -72.69 -37.65 67.78 Favored 'General case' 0 CA--C 1.538 0.502 0 O-C-N 121.249 -0.907 . . . . 0.0 111.279 178.826 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 51.9 tp -63.12 -48.37 78.81 Favored 'General case' 0 N--CA 1.467 0.416 0 C-N-CA 124.056 0.943 . . . . 0.0 111.003 170.801 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 55.4 t -63.49 -37.74 80.38 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.87 0 C-N-CA 123.473 0.709 . . . . 0.0 111.946 178.743 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -66.5 -47.77 71.92 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 124.169 0.987 . . . . 0.0 111.839 174.207 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.69 -44.71 96.19 Favored 'General case' 0 CA--C 1.536 0.436 0 O-C-N 121.772 -0.58 . . . . 0.0 111.892 178.077 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 48.6 tp -58.55 -50.88 72.18 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 124.408 1.083 . . . . 0.0 110.858 174.932 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 50.8 t80 -56.92 -39.02 73.69 Favored 'General case' 0 CA--C 1.544 0.725 0 N-CA-C 113.286 0.847 . . . . 0.0 113.286 174.652 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 77.1 mt -71.12 -33.58 70.25 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 123.725 0.81 . . . . 0.0 112.878 177.94 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 42.5 t -68.31 -43.13 84.65 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.967 0 C-N-CA 124.067 0.947 . . . . 0.0 111.093 172.144 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 66.6 m -83.9 -29.31 27.27 Favored 'General case' 0 N--CA 1.471 0.625 0 N-CA-C 114.304 1.224 . . . . 0.0 114.304 -174.063 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 70.47 -159.23 53.63 Favored Glycine 0 CA--C 1.532 1.114 0 C-N-CA 124.653 1.12 . . . . 0.0 112.281 -170.721 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -64.1 -10.63 23.65 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 124.851 1.261 . . . . 0.0 114.185 -179.506 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 23.1 ttp85 -58.26 -31.62 67.6 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 125.287 1.435 . . . . 0.0 112.993 173.105 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 86.29 -176.65 48.59 Favored Glycine 0 CA--C 1.532 1.147 0 C-N-CA 124.412 1.006 . . . . 0.0 114.148 -179.671 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 49.5 p90 -163.91 172.67 13.65 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 124.654 1.181 . . . . 0.0 112.938 -164.091 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 91.5 t80 . . . . . 0 CA--C 1.538 0.486 0 C-N-CA 125.417 1.487 . . . . 0.0 110.048 166.219 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 78.3 t . . . . . 0 N--CA 1.477 0.907 0 CA-C-O 119.432 -0.318 . . . . 0.0 111.454 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -67.42 -48.57 66.92 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 118.343 0.519 . . . . 0.0 110.222 -178.886 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 22.2 tt0 -61.16 -55.84 27.64 Favored 'General case' 0 N--CA 1.466 0.357 0 C-N-CA 124.775 1.23 . . . . 0.0 111.284 -179.716 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 78.1 m -68.76 -19.76 64.34 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 114.271 1.211 . . . . 0.0 114.271 -175.129 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 17.9 t -90.44 -41.24 11.56 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 124.398 1.079 . . . . 0.0 112.893 176.946 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 1.4 t -79.61 -37.68 35.6 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 123.632 0.773 . . . . 0.0 112.413 179.15 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 10.3 t -107.63 -149.96 0.44 Allowed 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 125.907 1.683 . . . . 0.0 109.637 169.098 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 27.1 pt -123.08 149.35 26.81 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.444 0 C-N-CA 125.61 1.564 . . . . 0.0 111.481 177.092 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 58.2 m -128.18 162.86 25.96 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 125.399 1.48 . . . . 0.0 111.005 172.453 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 99.5 p -114.47 165.29 12.89 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 124.748 1.219 . . . . 0.0 112.698 -178.415 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 61.1 mt -62.0 -33.41 74.27 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 123.245 0.618 . . . . 0.0 111.756 173.522 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 88.7 t80 -67.26 -34.46 77.47 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 123.566 0.746 . . . . 0.0 113.0 172.806 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 38.9 mt-30 -72.19 -38.17 69.14 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-O 118.768 -0.634 . . . . 0.0 111.052 173.321 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 85.9 mt -60.58 -40.82 93.1 Favored 'General case' 0 CA--C 1.538 0.498 0 CA-C-N 119.128 0.877 . . . . 0.0 111.476 169.03 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 25.7 tt0 -65.45 -33.62 76.36 Favored 'General case' 0 CA--C 1.543 0.709 0 CA-C-N 118.517 0.598 . . . . 0.0 112.406 177.844 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 34.3 t30 -65.15 -22.94 66.99 Favored 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 123.755 0.822 . . . . 0.0 113.032 173.228 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 13.9 m-85 -87.41 -6.59 58.38 Favored 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 124.908 1.283 . . . . 0.0 113.636 176.069 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 70.2 m . . . . . 0 N--CA 1.473 0.71 0 O-C-N 120.914 -1.116 . . . . 0.0 113.518 177.302 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 7.4 m-80 . . . . . 0 CA--C 1.537 0.452 0 CA-C-O 121.135 0.493 . . . . 0.0 111.536 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 38.3 mt-30 -145.58 158.71 43.81 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 125.565 1.546 . . . . 0.0 110.617 -173.877 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 99.5 m-70 -82.34 130.19 35.04 Favored 'General case' 0 CA--C 1.539 0.535 0 N-CA-C 108.289 -1.004 . . . . 0.0 108.289 158.305 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 85.2 mt -138.02 121.53 17.25 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 124.582 1.153 . . . . 0.0 109.732 -173.8 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 33.5 m -131.22 135.19 47.16 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.741 1.216 . . . . 0.0 110.476 -172.91 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 50.42 -120.7 8.92 Favored Glycine 0 CA--C 1.529 0.914 0 C-N-CA 125.163 1.363 . . . . 0.0 114.526 168.54 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 25.2 p -62.02 -32.52 73.02 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 124.484 1.114 . . . . 0.0 113.063 -179.686 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 94.0 m-70 -68.98 -38.62 79.45 Favored 'General case' 0 CA--C 1.538 0.519 0 O-C-N 121.172 -0.955 . . . . 0.0 111.385 175.269 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 8.7 tt -64.0 -48.98 74.25 Favored 'General case' 0 C--N 1.344 0.355 0 CA-C-O 118.875 -0.583 . . . . 0.0 110.552 171.459 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 53.9 t -59.85 -40.5 82.91 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.994 0 C-N-CA 123.234 0.614 . . . . 0.0 111.841 179.864 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -63.4 -49.9 71.96 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 123.676 0.79 . . . . 0.0 111.807 175.404 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.01 -45.98 91.23 Favored 'General case' 0 CA--C 1.539 0.523 0 O-C-N 121.79 -0.569 . . . . 0.0 111.564 178.957 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 40.4 tp -58.26 -51.53 69.4 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 125.619 1.567 . . . . 0.0 111.395 177.857 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 68.7 t80 -55.44 -42.59 74.41 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 123.762 0.825 . . . . 0.0 112.652 174.454 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 87.7 mt -73.7 -32.19 63.8 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 123.951 0.9 . . . . 0.0 113.179 -179.31 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 34.5 t -69.1 -45.25 80.17 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.885 0 C-N-CA 124.025 0.93 . . . . 0.0 110.341 171.883 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 74.0 m -77.06 -35.39 56.71 Favored 'General case' 0 N--CA 1.468 0.44 0 N-CA-C 113.385 0.883 . . . . 0.0 113.385 -175.181 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 62.58 -129.79 42.61 Favored Glycine 0 CA--C 1.532 1.094 0 C-N-CA 123.982 0.801 . . . . 0.0 111.254 -175.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -66.57 -14.36 62.26 Favored 'General case' 0 CA--C 1.546 0.802 0 N-CA-C 114.073 1.138 . . . . 0.0 114.073 179.344 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 84.5 mtm180 -69.09 -24.64 64.16 Favored 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 113.672 0.989 . . . . 0.0 113.672 -177.457 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 69.09 -175.48 31.86 Favored Glycine 0 N--CA 1.472 1.064 0 C-N-CA 124.027 0.822 . . . . 0.0 112.446 -170.697 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 44.2 p90 -154.11 157.66 39.26 Favored 'General case' 0 CA--C 1.539 0.545 0 N-CA-C 115.187 1.551 . . . . 0.0 115.187 -174.367 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 91.6 t80 . . . . . 0 CA--C 1.538 0.486 0 C-N-CA 126.476 1.911 . . . . 0.0 109.981 161.514 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 70.5 t . . . . . 0 N--CA 1.479 1.016 0 N-CA-C 111.781 0.289 . . . . 0.0 111.781 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -83.18 -50.23 8.66 Favored 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 123.779 0.832 . . . . 0.0 110.898 171.357 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 31.7 tt0 -64.7 -45.93 84.53 Favored 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 123.6 0.76 . . . . 0.0 112.298 -169.386 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 11.6 m -67.36 -17.89 64.93 Favored 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 113.501 0.926 . . . . 0.0 113.501 175.983 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 28.1 t -95.21 -42.56 8.5 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 124.396 1.078 . . . . 0.0 112.293 -176.506 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 54.3 p -87.2 -33.21 19.42 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 126.002 1.721 . . . . 0.0 112.571 -178.823 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 7.8 t -109.79 -170.25 1.62 Allowed 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 124.805 1.242 . . . . 0.0 110.103 165.797 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 11.8 tt -101.76 147.04 9.01 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.629 0 C-N-CA 125.28 1.432 . . . . 0.0 110.093 173.614 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 16.7 p -140.61 157.91 44.76 Favored 'General case' 0 N--CA 1.474 0.772 0 N-CA-C 112.974 0.731 . . . . 0.0 112.974 176.985 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 83.8 p -104.29 157.57 17.05 Favored 'General case' 0 N--CA 1.469 0.492 0 N-CA-C 114.361 1.245 . . . . 0.0 114.361 -173.916 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 62.5 mt -58.26 -32.53 68.46 Favored 'General case' 0 N--CA 1.47 0.526 0 O-C-N 121.633 -0.667 . . . . 0.0 111.675 173.203 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 84.6 t80 -66.21 -29.68 70.0 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 124.379 1.072 . . . . 0.0 113.685 172.754 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 89.0 mt-30 -81.23 -32.25 33.49 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 124.08 0.952 . . . . 0.0 111.07 174.636 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 8.4 mp -62.88 -42.67 99.85 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 123.437 0.695 . . . . 0.0 111.491 167.75 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 29.4 tt0 -62.64 -25.02 67.91 Favored 'General case' 0 CA--C 1.545 0.766 0 N-CA-C 113.532 0.938 . . . . 0.0 113.532 -177.357 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 24.8 t30 -55.03 -27.51 45.05 Favored 'General case' 0 CA--C 1.547 0.827 0 C-N-CA 124.281 1.032 . . . . 0.0 113.22 173.805 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 97.8 m-85 -97.58 0.87 48.14 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 125.443 1.497 . . . . 0.0 114.487 -176.458 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 65.2 m . . . . . 0 N--CA 1.474 0.726 0 O-C-N 121.369 -0.832 . . . . 0.0 112.818 174.261 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 52.3 p-10 . . . . . 0 CA--C 1.543 0.704 0 N-CA-C 112.975 0.732 . . . . 0.0 112.975 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 41.3 mt-30 -151.05 161.34 42.91 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 125.532 1.533 . . . . 0.0 110.845 -167.018 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 98.4 m-70 -89.85 128.72 36.23 Favored 'General case' 0 CA--C 1.54 0.57 0 N-CA-C 109.297 -0.631 . . . . 0.0 109.297 159.691 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 90.8 mt -141.1 126.6 18.82 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 125.246 1.418 . . . . 0.0 109.577 -172.653 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 39.9 m -128.65 135.9 49.93 Favored 'General case' 0 N--CA 1.466 0.334 0 C-N-CA 124.516 1.126 . . . . 0.0 110.967 -175.218 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 49.68 -117.02 4.19 Favored Glycine 0 CA--C 1.529 0.916 0 C-N-CA 125.415 1.484 . . . . 0.0 113.694 168.365 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 22.3 m -59.56 -32.92 70.79 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 124.609 1.164 . . . . 0.0 112.931 -179.389 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 94.0 m-70 -72.26 -37.64 69.04 Favored 'General case' 0 CA--C 1.539 0.547 0 O-C-N 121.23 -0.919 . . . . 0.0 111.423 177.129 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 59.8 tp -67.11 -43.12 83.26 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 123.155 0.582 . . . . 0.0 110.99 171.981 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 40.4 t -60.17 -42.76 91.32 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.907 0 C-N-CA 124.335 1.054 . . . . 0.0 111.915 175.589 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -63.42 -47.31 82.5 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 123.65 0.78 . . . . 0.0 111.337 173.717 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.6 -42.83 99.42 Favored 'General case' 0 CA--C 1.541 0.606 0 O-C-N 121.303 -0.873 . . . . 0.0 112.446 178.439 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 28.7 mt -57.75 -50.56 72.83 Favored 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 124.124 0.969 . . . . 0.0 110.931 174.453 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 80.5 t80 -55.94 -41.16 74.21 Favored 'General case' 0 CA--C 1.541 0.632 0 N-CA-C 112.997 0.74 . . . . 0.0 112.997 175.007 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 88.2 mt -73.8 -35.97 64.97 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 123.834 0.854 . . . . 0.0 113.234 179.73 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 26.1 t -66.96 -44.29 88.67 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.948 0 C-N-CA 124.687 1.195 . . . . 0.0 110.542 173.84 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 71.0 m -77.62 -32.15 53.3 Favored 'General case' 0 CA--C 1.537 0.449 0 N-CA-C 112.803 0.668 . . . . 0.0 112.803 -176.235 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 68.62 -113.88 5.57 Favored Glycine 0 CA--C 1.529 0.926 0 C-N-CA 124.406 1.003 . . . . 0.0 111.814 173.055 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 37.6 mm-40 -71.09 -21.55 62.21 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 123.853 0.861 . . . . 0.0 112.711 174.882 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 83.6 mtm180 -75.18 155.49 36.86 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 124.923 1.289 . . . . 0.0 111.215 174.534 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . -74.89 179.63 44.37 Favored Glycine 0 CA--C 1.53 1.017 0 C-N-CA 124.246 0.927 . . . . 0.0 111.253 168.087 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 32.2 p90 -154.42 171.24 19.65 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 124.416 1.086 . . . . 0.0 112.61 -177.255 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 76.9 t80 . . . . . 0 CA--C 1.539 0.544 0 C-N-CA 125.348 1.459 . . . . 0.0 111.582 178.59 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 54.8 t . . . . . 0 N--CA 1.48 1.066 0 CA-C-O 119.17 -0.443 . . . . 0.0 110.782 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -62.77 -43.99 97.35 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 118.705 0.684 . . . . 0.0 110.572 178.925 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 16.9 tt0 -56.78 -55.68 31.24 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 123.961 0.904 . . . . 0.0 111.25 175.44 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -80.03 -16.92 54.08 Favored 'General case' 0 CA--C 1.541 0.608 0 N-CA-C 114.558 1.318 . . . . 0.0 114.558 -172.209 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 38.4 t -99.33 -50.47 4.11 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 124.127 0.971 . . . . 0.0 112.513 -176.817 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 29.8 m -78.99 -39.83 33.16 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 124.611 1.164 . . . . 0.0 110.726 -178.059 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 10.5 t -104.24 -154.54 0.51 Allowed 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 124.236 1.014 . . . . 0.0 109.908 159.419 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 29.8 pt -112.4 161.47 11.17 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.651 0 C-N-CA 126.117 1.767 . . . . 0.0 111.595 175.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 1.6 p -147.08 169.34 19.46 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 123.457 0.703 . . . . 0.0 112.477 165.015 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 70.5 m -112.32 154.19 26.07 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 124.048 0.939 . . . . 0.0 112.956 -170.104 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 62.2 mt -59.09 -29.95 67.73 Favored 'General case' 0 N--CA 1.468 0.456 0 O-C-N 121.197 -0.94 . . . . 0.0 112.189 176.757 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 79.2 t80 -67.48 -26.37 66.33 Favored 'General case' 0 CA--C 1.545 0.77 0 N-CA-C 113.889 1.07 . . . . 0.0 113.889 171.97 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 59.9 mt-30 -77.85 -40.43 40.23 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 123.517 0.727 . . . . 0.0 109.655 171.719 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 9.2 mp -57.47 -39.93 77.45 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 118.401 0.546 . . . . 0.0 111.459 169.571 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -64.7 -37.35 87.31 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 124.307 1.043 . . . . 0.0 112.34 175.854 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 21.8 t30 -66.76 -27.63 67.75 Favored 'General case' 0 CA--C 1.545 0.762 0 O-C-N 121.213 -0.929 . . . . 0.0 112.732 172.721 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 18.9 m-85 -85.31 -4.02 59.02 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 125.14 1.376 . . . . 0.0 113.638 177.699 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 79.2 m . . . . . 0 CA--C 1.541 0.619 0 O-C-N 120.8 -1.188 . . . . 0.0 112.718 172.596 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 5.4 p-10 . . . . . 0 N--CA 1.469 0.513 0 CA-C-O 120.671 0.272 . . . . 0.0 111.618 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 38.9 mt-30 -149.25 163.63 37.1 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 124.429 1.091 . . . . 0.0 111.045 -171.625 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 96.0 m-70 -88.49 126.38 35.22 Favored 'General case' 0 CA--C 1.542 0.641 0 N-CA-C 107.991 -1.114 . . . . 0.0 107.991 154.411 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 85.1 mt -136.64 129.21 30.38 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 125.383 1.473 . . . . 0.0 109.008 -179.979 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 60.2 m -131.67 137.09 48.17 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 124.434 1.094 . . . . 0.0 110.788 -173.614 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 49.37 -120.23 7.21 Favored Glycine 0 N--CA 1.47 0.935 0 C-N-CA 125.06 1.315 . . . . 0.0 113.897 169.648 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 26.9 m -59.28 -31.3 68.99 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 124.81 1.244 . . . . 0.0 112.668 -178.167 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 96.8 m-70 -73.35 -35.96 66.07 Favored 'General case' 0 CA--C 1.541 0.603 0 O-C-N 121.317 -0.864 . . . . 0.0 111.561 177.697 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 32.9 tp -70.3 -40.8 74.04 Favored 'General case' 0 CA--C 1.536 0.44 0 O-C-N 121.667 -0.646 . . . . 0.0 111.392 171.237 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 56.1 t -58.61 -43.48 87.46 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.159 0 C-N-CA 123.569 0.748 . . . . 0.0 111.546 173.093 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -64.41 -45.92 85.48 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 123.703 0.801 . . . . 0.0 111.572 175.194 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.06 -44.31 96.95 Favored 'General case' 0 CA--C 1.541 0.606 0 O-C-N 121.592 -0.693 . . . . 0.0 112.141 178.438 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 34.5 mt -58.51 -48.13 81.82 Favored 'General case' 0 N--CA 1.464 0.253 0 C-N-CA 124.264 1.025 . . . . 0.0 110.876 174.257 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 90.7 t80 -57.63 -38.9 75.78 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-N 118.821 0.737 . . . . 0.0 112.495 175.465 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 84.6 mt -75.78 -36.75 59.71 Favored 'General case' 0 CA--C 1.538 0.483 0 N-CA-C 113.405 0.891 . . . . 0.0 113.405 179.573 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 55.2 t -70.74 -40.4 76.8 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.007 0 C-N-CA 123.695 0.798 . . . . 0.0 110.954 175.796 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 63.3 m -92.95 -23.81 18.6 Favored 'General case' 0 N--CA 1.471 0.604 0 N-CA-C 114.465 1.283 . . . . 0.0 114.465 -172.911 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 63.15 -142.26 47.25 Favored Glycine 0 CA--C 1.531 1.087 0 C-N-CA 124.118 0.866 . . . . 0.0 112.365 -175.829 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -63.52 -12.9 35.97 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 125.626 1.57 . . . . 0.0 114.46 -177.459 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 75.2 mtp180 -59.57 -38.81 82.13 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 124.28 1.032 . . . . 0.0 113.128 178.752 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 82.1 -179.62 53.19 Favored Glycine 0 CA--C 1.536 1.358 0 C-N-CA 124.484 1.04 . . . . 0.0 112.193 -161.994 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 34.9 p90 -157.74 157.92 34.33 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 124.339 1.056 . . . . 0.0 113.653 -169.945 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 81.5 t80 . . . . . 0 CA--C 1.537 0.47 0 C-N-CA 126.084 1.754 . . . . 0.0 110.84 166.187 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 60.0 t . . . . . 0 N--CA 1.475 0.823 0 CA-C-O 119.922 -0.085 . . . . 0.0 111.05 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 35.7 mm-40 -71.94 -44.75 63.09 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-O 118.684 -0.674 . . . . 0.0 111.041 173.281 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 5.5 tt0 -59.43 -53.6 56.33 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 119.253 0.933 . . . . 0.0 111.281 -178.914 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 57.2 m -60.17 -27.6 67.24 Favored 'General case' 0 CA--C 1.535 0.395 0 N-CA-C 113.793 1.035 . . . . 0.0 113.793 -177.571 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 24.9 t -102.37 -41.0 6.48 Favored 'General case' 0 CA--C 1.538 0.508 0 N-CA-C 113.622 0.971 . . . . 0.0 113.622 -170.772 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 59.4 p -84.62 -25.55 28.49 Favored 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 124.166 0.986 . . . . 0.0 112.683 176.989 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 79.8 p -126.06 -139.54 0.27 Allowed 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 125.669 1.588 . . . . 0.0 109.194 166.369 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 38.4 pt -123.46 161.4 25.56 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.524 0 C-N-CA 125.017 1.327 . . . . 0.0 110.844 177.184 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 29.0 p -141.54 156.04 45.74 Favored 'General case' 0 C--O 1.237 0.422 0 C-N-CA 123.354 0.662 . . . . 0.0 112.67 172.421 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 58.5 p -96.42 160.55 14.35 Favored 'General case' 0 N--CA 1.467 0.377 0 N-CA-C 113.343 0.868 . . . . 0.0 113.343 -176.314 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 65.7 mt -61.76 -33.38 73.96 Favored 'General case' 0 CA--C 1.539 0.522 0 O-C-N 121.366 -0.834 . . . . 0.0 111.843 173.066 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 89.5 t80 -66.68 -32.12 73.22 Favored 'General case' 0 CA--C 1.543 0.702 0 N-CA-C 113.066 0.765 . . . . 0.0 113.066 172.665 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 80.4 mt-30 -73.12 -37.76 66.55 Favored 'General case' 0 N--CA 1.466 0.352 0 O-C-N 121.442 -0.786 . . . . 0.0 111.186 171.671 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 46.5 mt -60.4 -40.01 89.4 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 119.413 1.006 . . . . 0.0 111.227 169.824 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -63.98 -40.12 95.68 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 124.285 1.034 . . . . 0.0 112.316 176.16 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 18.5 t30 -60.98 -28.57 69.1 Favored 'General case' 0 CA--C 1.548 0.873 0 O-C-N 121.226 -0.921 . . . . 0.0 112.797 174.538 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 22.4 m-85 -92.38 4.15 53.99 Favored 'General case' 0 CA--C 1.547 0.827 0 C-N-CA 125.063 1.345 . . . . 0.0 114.316 177.438 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 83.4 m . . . . . 0 N--CA 1.471 0.617 0 O-C-N 120.737 -1.227 . . . . 0.0 112.526 166.327 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 12.7 m-80 . . . . . 0 CA--C 1.536 0.431 0 CA-C-O 120.905 0.383 . . . . 0.0 111.638 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 41.0 mt-30 -147.15 160.35 42.54 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 124.834 1.254 . . . . 0.0 111.283 -178.528 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 92.8 m-70 -79.97 130.1 35.01 Favored 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 108.399 -0.963 . . . . 0.0 108.399 153.139 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 88.4 mt -143.36 126.21 16.17 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 125.213 1.405 . . . . 0.0 109.661 -176.892 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 66.4 m -135.41 144.15 46.36 Favored 'General case' 0 N--CA 1.468 0.428 0 C-N-CA 125.337 1.455 . . . . 0.0 110.35 -178.034 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 55.4 -124.55 33.59 Favored Glycine 0 N--CA 1.473 1.102 0 C-N-CA 124.495 1.045 . . . . 0.0 113.953 165.843 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 22.5 p -59.02 -37.12 76.19 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 124.765 1.226 . . . . 0.0 112.755 179.064 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 26.3 m80 -67.36 -38.77 85.31 Favored 'General case' 0 CA--C 1.54 0.576 0 O-C-N 121.171 -0.956 . . . . 0.0 111.577 177.219 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 51.5 tp -68.92 -43.24 75.54 Favored 'General case' 0 N--CA 1.465 0.325 0 O-C-N 121.667 -0.646 . . . . 0.0 111.388 173.387 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 6.4 t -56.88 -43.74 80.86 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.908 0 C-N-CA 124.463 1.105 . . . . 0.0 111.393 174.369 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 30.2 mm-40 -66.75 -44.56 81.15 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 124.1 0.96 . . . . 0.0 111.979 175.169 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -63.43 -45.1 92.49 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-N 118.969 0.804 . . . . 0.0 112.32 179.652 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 40.8 mt -57.44 -52.33 65.83 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 124.145 0.978 . . . . 0.0 110.408 172.058 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 87.9 t80 -55.8 -38.76 70.38 Favored 'General case' 0 CA--C 1.546 0.813 0 CA-C-N 119.321 0.964 . . . . 0.0 113.268 176.989 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 74.2 mt -72.2 -36.14 69.11 Favored 'General case' 0 N--CA 1.47 0.545 0 N-CA-C 113.224 0.824 . . . . 0.0 113.224 178.085 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 58.3 t -74.01 -38.73 49.93 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.133 0 C-N-CA 123.365 0.666 . . . . 0.0 111.53 175.307 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 60.8 m -90.34 -22.75 21.37 Favored 'General case' 0 N--CA 1.473 0.689 0 N-CA-C 114.666 1.358 . . . . 0.0 114.666 -172.906 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 65.99 -145.2 47.65 Favored Glycine 0 CA--C 1.532 1.129 0 C-N-CA 124.171 0.891 . . . . 0.0 112.202 -173.66 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -67.21 -12.37 59.88 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 124.602 1.161 . . . . 0.0 114.044 -178.642 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 76.2 mtp85 -63.85 -33.87 76.67 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 124.17 0.988 . . . . 0.0 113.235 178.832 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 77.01 -170.42 55.13 Favored Glycine 0 CA--C 1.531 1.033 0 C-N-CA 124.476 1.036 . . . . 0.0 113.096 -170.747 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 45.9 p90 -154.66 170.66 21.02 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 125.079 1.352 . . . . 0.0 112.729 -169.109 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 43.3 p90 . . . . . 0 CA--C 1.542 0.667 0 C-N-CA 125.263 1.425 . . . . 0.0 111.042 169.011 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 38.3 t . . . . . 0 N--CA 1.48 1.067 0 N-CA-C 111.793 0.294 . . . . 0.0 111.793 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -68.72 -8.65 44.71 Favored 'General case' 0 CA--C 1.545 0.764 0 N-CA-C 114.5 1.296 . . . . 0.0 114.5 178.379 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 71.5 tp60 -101.46 -55.74 2.46 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 124.191 0.996 . . . . 0.0 110.101 168.695 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 72.5 m -68.66 -28.69 67.1 Favored 'General case' 0 N--CA 1.468 0.436 0 N-CA-C 115.084 1.513 . . . . 0.0 115.084 -171.483 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 22.1 t -90.34 -45.2 9.18 Favored 'General case' 0 N--CA 1.476 0.839 0 N-CA-C 112.989 0.737 . . . . 0.0 112.989 -167.055 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 18.2 p -89.07 -53.97 4.33 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 126.001 1.721 . . . . 0.0 110.986 -177.785 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.9 t -87.69 -160.6 0.63 Allowed 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 124.65 1.18 . . . . 0.0 110.535 164.523 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 2.1 pp -105.03 167.81 2.79 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.535 0 C-N-CA 124.728 1.211 . . . . 0.0 111.98 175.494 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 20.5 p -147.99 160.09 43.2 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 123.71 0.804 . . . . 0.0 112.198 166.576 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 12.5 m -106.57 154.57 20.7 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 124.419 1.088 . . . . 0.0 111.988 -171.488 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 30.4 mt -61.32 -33.45 73.63 Favored 'General case' 0 N--CA 1.47 0.531 0 O-C-N 121.346 -0.846 . . . . 0.0 112.026 178.896 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 59.3 m-85 -60.73 -32.45 71.72 Favored 'General case' 0 CA--C 1.541 0.609 0 N-CA-C 113.565 0.95 . . . . 0.0 113.565 171.976 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 21.3 mm100 -81.6 -31.79 32.34 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 124.373 1.069 . . . . 0.0 110.992 176.707 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 64.1 mt -64.85 -37.73 88.62 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-N 119.23 0.923 . . . . 0.0 111.692 169.186 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 26.7 tt0 -63.07 -27.05 69.13 Favored 'General case' 0 CA--C 1.546 0.825 0 N-CA-C 113.194 0.813 . . . . 0.0 113.194 179.245 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 25.1 t30 -58.73 -24.88 62.32 Favored 'General case' 0 CA--C 1.547 0.841 0 O-C-N 121.103 -0.998 . . . . 0.0 112.91 172.963 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 85.7 m-85 -102.7 9.36 39.23 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 126.074 1.749 . . . . 0.0 113.464 -178.726 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 69.1 m . . . . . 0 CA--C 1.539 0.551 0 O-C-N 120.916 -1.115 . . . . 0.0 111.558 164.337 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 7.3 p30 . . . . . 0 CA--C 1.536 0.42 0 CA-C-O 120.768 0.318 . . . . 0.0 110.773 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 49.4 mm-40 -153.72 163.56 39.81 Favored 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 123.842 0.857 . . . . 0.0 111.882 -162.787 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 99.2 m-70 -78.86 129.28 34.39 Favored 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 109.088 -0.708 . . . . 0.0 109.088 161.823 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 79.6 mt -144.97 132.64 20.99 Favored 'General case' 0 N--CA 1.465 0.294 0 C-N-CA 125.743 1.617 . . . . 0.0 109.079 -174.674 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 2.7 t -153.16 152.96 31.84 Favored 'General case' 0 N--CA 1.467 0.382 0 O-C-N 121.488 -0.757 . . . . 0.0 111.893 -176.898 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 49.69 -126.05 19.89 Favored Glycine 0 N--CA 1.47 0.954 0 C-N-CA 124.794 1.188 . . . . 0.0 113.596 177.751 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 15.1 m -60.28 -31.53 70.32 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 124.765 1.226 . . . . 0.0 112.761 -179.637 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 98.2 m-70 -73.87 -35.53 64.74 Favored 'General case' 0 CA--C 1.539 0.537 0 O-C-N 120.994 -1.066 . . . . 0.0 111.667 178.18 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 33.9 tp -68.81 -43.26 75.96 Favored 'General case' 0 N--CA 1.467 0.405 0 O-C-N 121.485 -0.759 . . . . 0.0 110.753 171.844 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 50.6 t -58.54 -41.38 81.76 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.018 0 C-N-CA 123.81 0.844 . . . . 0.0 111.595 173.249 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -66.26 -44.4 83.73 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 123.885 0.874 . . . . 0.0 112.295 175.336 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.66 -44.72 96.42 Favored 'General case' 0 CA--C 1.54 0.578 0 O-C-N 121.614 -0.679 . . . . 0.0 112.088 177.171 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 30.3 mt -56.16 -50.89 69.88 Favored 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 124.204 1.002 . . . . 0.0 111.169 172.177 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 67.5 t80 -56.24 -40.53 74.28 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 113.081 0.771 . . . . 0.0 113.081 176.017 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 89.7 mt -76.99 -33.5 57.58 Favored 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 113.546 0.943 . . . . 0.0 113.546 -179.408 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 38.7 t -69.95 -44.74 78.34 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.879 0 C-N-CA 124.189 0.995 . . . . 0.0 110.828 173.033 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 76.2 m -85.25 -33.18 22.24 Favored 'General case' 0 N--CA 1.466 0.371 0 N-CA-C 113.4 0.889 . . . . 0.0 113.4 -172.76 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 64.44 -135.25 39.06 Favored Glycine 0 CA--C 1.531 1.071 0 C-N-CA 124.229 0.919 . . . . 0.0 111.659 -177.928 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 30.0 tt0 -64.5 -16.81 63.16 Favored 'General case' 0 CA--C 1.549 0.906 0 C-N-CA 124.9 1.28 . . . . 0.0 113.503 -179.511 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 82.6 mtm180 -61.06 -32.51 72.15 Favored 'General case' 0 N--CA 1.473 0.69 0 N-CA-C 113.642 0.979 . . . . 0.0 113.642 179.965 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 85.39 173.36 49.64 Favored Glycine 0 CA--C 1.533 1.175 0 C-N-CA 124.748 1.166 . . . . 0.0 112.21 -169.388 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 51.1 p90 -159.0 166.81 30.92 Favored 'General case' 0 N--CA 1.47 0.545 0 N-CA-C 113.886 1.069 . . . . 0.0 113.886 -170.432 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 31.3 m-85 . . . . . 0 CA--C 1.541 0.608 0 C-N-CA 127.078 2.151 . . . . 0.0 110.711 178.467 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 4.5 t . . . . . 0 N--CA 1.48 1.059 0 N-CA-C 112.252 0.464 . . . . 0.0 112.252 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -74.3 -11.05 60.16 Favored 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 113.856 1.058 . . . . 0.0 113.856 -179.69 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 60.5 tp60 -98.74 -53.61 3.25 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 123.811 0.844 . . . . 0.0 109.8 166.268 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 32.9 m -61.37 -33.54 73.82 Favored 'General case' 0 N--CA 1.466 0.333 0 N-CA-C 114.542 1.312 . . . . 0.0 114.542 -171.242 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 23.6 t -91.98 -41.92 10.29 Favored 'General case' 0 CA--C 1.537 0.448 0 O-C-N 121.955 -0.465 . . . . 0.0 111.681 -176.632 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 21.4 m -69.27 -34.77 75.26 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 126.409 1.884 . . . . 0.0 112.532 179.942 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 11.6 t -145.14 -162.56 1.53 Allowed 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 125.525 1.53 . . . . 0.0 110.593 -178.287 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 82.1 mt -80.76 135.93 24.24 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.614 0 O-C-N 120.691 -1.255 . . . . 0.0 109.958 172.38 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 21.0 p -119.13 157.2 28.37 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-O 121.718 0.77 . . . . 0.0 111.255 161.641 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 62.2 m -102.97 153.9 19.76 Favored 'General case' 0 N--CA 1.466 0.36 0 C-N-CA 123.659 0.784 . . . . 0.0 112.726 -173.86 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 57.1 mt -59.96 -32.73 71.08 Favored 'General case' 0 N--CA 1.467 0.416 0 O-C-N 121.388 -0.82 . . . . 0.0 112.034 178.995 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 84.6 m-85 -67.55 -29.08 68.37 Favored 'General case' 0 CA--C 1.54 0.594 0 N-CA-C 113.909 1.077 . . . . 0.0 113.909 172.962 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 92.6 mt-30 -75.87 -39.87 55.64 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 123.707 0.803 . . . . 0.0 110.292 172.829 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 94.2 mt -58.54 -41.31 85.24 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-N 118.454 0.57 . . . . 0.0 110.964 170.127 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -65.28 -40.48 93.91 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 124.575 1.15 . . . . 0.0 112.174 177.27 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 35.1 t30 -63.72 -23.88 67.55 Favored 'General case' 0 CA--C 1.548 0.903 0 O-C-N 121.246 -0.909 . . . . 0.0 112.69 172.949 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -90.05 3.95 51.74 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 125.587 1.555 . . . . 0.0 114.658 175.976 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 83.1 m . . . . . 0 CA--C 1.541 0.605 0 C-N-CA 123.533 0.733 . . . . 0.0 112.807 169.718 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 15.2 m-20 . . . . . 0 CA--C 1.544 0.727 0 CA-C-O 121.021 0.439 . . . . 0.0 111.983 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 68.4 mm-40 -152.19 166.87 30.38 Favored 'General case' 0 N--CA 1.471 0.604 0 O-C-N 121.232 -0.918 . . . . 0.0 113.068 -158.462 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 17.5 m-70 -78.6 133.46 37.29 Favored 'General case' 0 CA--C 1.544 0.741 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 154.915 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 77.7 mt -145.83 127.39 15.11 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 126.743 2.017 . . . . 0.0 109.137 -176.009 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 84.2 m -132.74 147.41 52.32 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 124.629 1.172 . . . . 0.0 110.696 -177.683 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 55.39 -128.26 43.93 Favored Glycine 0 N--CA 1.469 0.876 0 C-N-CA 124.832 1.206 . . . . 0.0 113.965 165.474 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 14.3 m -58.42 -34.22 70.54 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 124.395 1.078 . . . . 0.0 112.641 179.916 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 79.2 m-70 -77.44 -27.06 52.04 Favored 'General case' 0 CA--C 1.54 0.562 0 O-C-N 121.292 -0.88 . . . . 0.0 112.918 177.566 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 38.9 tp -71.85 -43.4 65.57 Favored 'General case' 0 N--CA 1.47 0.567 0 O-C-N 121.135 -0.978 . . . . 0.0 111.124 167.386 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 42.1 t -57.8 -41.64 80.19 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.992 0 C-N-CA 123.556 0.743 . . . . 0.0 111.603 172.971 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 44.2 tt0 -62.33 -49.32 76.07 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 125.395 1.478 . . . . 0.0 111.822 173.324 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -63.46 -45.19 91.96 Favored 'General case' 0 CA--C 1.541 0.606 0 O-C-N 121.681 -0.637 . . . . 0.0 112.391 -179.269 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 52.0 mt -54.45 -56.37 19.4 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 124.135 0.974 . . . . 0.0 110.392 171.95 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 74.0 t80 -52.9 -41.38 64.34 Favored 'General case' 0 CA--C 1.542 0.669 0 N-CA-C 113.371 0.878 . . . . 0.0 113.371 177.38 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 86.3 mt -73.46 -34.53 65.43 Favored 'General case' 0 CA--C 1.537 0.479 0 N-CA-C 113.884 1.068 . . . . 0.0 113.884 179.569 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 54.2 t -72.25 -39.97 64.94 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.049 0 CA-C-N 118.7 0.682 . . . . 0.0 110.834 173.417 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 73.4 m -79.85 -28.68 40.03 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 124.38 1.072 . . . . 0.0 113.72 -176.089 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 65.1 -111.43 4.18 Favored Glycine 0 CA--C 1.528 0.899 0 C-N-CA 124.472 1.035 . . . . 0.0 112.082 175.504 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -71.93 -21.0 61.67 Favored 'General case' 0 CA--C 1.544 0.73 0 N-CA-C 113.82 1.045 . . . . 0.0 113.82 175.101 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 84.6 mtp180 -78.63 157.79 28.59 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 124.752 1.221 . . . . 0.0 111.272 175.449 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . -81.83 -167.23 38.85 Favored Glycine 0 CA--C 1.529 0.921 0 C-N-CA 124.092 0.853 . . . . 0.0 111.778 170.676 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 43.7 p90 -156.64 152.17 26.82 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 125.384 1.474 . . . . 0.0 112.162 178.067 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 58.9 m-85 . . . . . 0 CA--C 1.543 0.698 0 N-CA-C 114.313 1.227 . . . . 0.0 114.313 -172.414 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 61.4 t . . . . . 0 N--CA 1.48 1.07 0 CA-C-O 119.614 -0.231 . . . . 0.0 111.562 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -72.49 -45.49 59.19 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 118.499 0.591 . . . . 0.0 110.311 173.404 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 70.6 tp60 -59.88 -47.76 84.43 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 123.127 0.571 . . . . 0.0 111.745 178.979 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 73.1 m -72.0 -30.86 65.67 Favored 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 114.794 1.405 . . . . 0.0 114.794 -177.778 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 22.3 t -103.46 -41.77 5.89 Favored 'General case' 0 N--CA 1.47 0.574 0 N-CA-C 113.711 1.004 . . . . 0.0 113.711 -169.638 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 33.8 m -81.93 -38.01 25.9 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 124.127 0.971 . . . . 0.0 110.911 177.591 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 11.0 t -111.35 -152.58 0.5 Allowed 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 125.055 1.342 . . . . 0.0 110.422 166.073 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 45.3 pt -108.81 158.43 8.64 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.543 0 C-N-CA 125.474 1.51 . . . . 0.0 111.104 170.388 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 21.1 p -137.86 156.09 48.28 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 123.791 0.836 . . . . 0.0 112.588 171.233 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 59.7 p -93.56 165.41 12.75 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 124.456 1.103 . . . . 0.0 112.979 173.942 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 72.7 mt -63.61 -34.05 76.96 Favored 'General case' 0 CA--C 1.537 0.454 0 O-C-N 121.369 -0.832 . . . . 0.0 111.798 171.976 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 91.4 t80 -64.07 -34.97 79.24 Favored 'General case' 0 CA--C 1.544 0.721 0 O-C-N 121.598 -0.689 . . . . 0.0 112.687 171.893 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 91.4 mt-30 -73.77 -32.91 64.04 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-O 118.537 -0.744 . . . . 0.0 112.218 174.022 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 92.4 mt -57.96 -48.84 78.75 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-N 119.612 1.096 . . . . 0.0 110.283 165.989 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 29.3 tt0 -63.75 -30.83 71.88 Favored 'General case' 0 CA--C 1.544 0.74 0 N-CA-C 113.338 0.866 . . . . 0.0 113.338 179.904 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 18.0 t30 -60.29 -27.76 67.55 Favored 'General case' 0 CA--C 1.544 0.74 0 O-C-N 121.131 -0.981 . . . . 0.0 113.231 178.346 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 40.8 m-85 -93.96 8.04 42.83 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 125.604 1.561 . . . . 0.0 113.223 176.071 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 56.2 m . . . . . 0 CA--C 1.541 0.628 0 C-N-CA 125.51 1.524 . . . . 0.0 112.619 174.713 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.537 0.471 0 CA-C-O 120.614 0.245 . . . . 0.0 111.394 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 21.5 mm100 -146.28 163.94 33.92 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 124.542 1.137 . . . . 0.0 111.244 -159.81 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 96.7 m-70 -80.79 131.75 35.44 Favored 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 108.885 -0.783 . . . . 0.0 108.885 157.743 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 77.0 mt -144.37 128.58 17.73 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 125.878 1.671 . . . . 0.0 108.895 -178.937 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 85.4 m -137.08 148.0 46.45 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 125.067 1.347 . . . . 0.0 110.569 -177.614 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 56.03 -128.54 45.78 Favored Glycine 0 CA--C 1.531 1.047 0 C-N-CA 124.762 1.172 . . . . 0.0 114.245 165.095 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 25.5 p -56.54 -42.78 79.08 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 124.524 1.129 . . . . 0.0 112.599 179.935 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 73.4 m-70 -70.57 -29.61 66.1 Favored 'General case' 0 CA--C 1.541 0.616 0 O-C-N 121.142 -0.974 . . . . 0.0 113.304 176.473 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 55.0 tp -67.7 -47.14 70.25 Favored 'General case' 0 N--CA 1.469 0.507 0 O-C-N 121.299 -0.876 . . . . 0.0 111.215 169.265 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 76.4 t -60.25 -39.62 81.26 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.016 0 C-N-CA 123.248 0.619 . . . . 0.0 111.211 175.931 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 44.3 tt0 -62.02 -50.06 73.57 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 125.464 1.506 . . . . 0.0 111.594 174.759 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -63.94 -45.36 89.53 Favored 'General case' 0 N--CA 1.469 0.501 0 O-C-N 121.628 -0.67 . . . . 0.0 112.066 178.985 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 33.5 tp -60.12 -44.56 94.78 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 124.722 1.209 . . . . 0.0 111.234 177.133 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 74.4 t80 -61.65 -37.36 83.72 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 124.126 0.97 . . . . 0.0 113.011 171.359 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 65.5 mt -71.11 -28.38 64.26 Favored 'General case' 0 N--CA 1.471 0.602 0 O-C-N 120.754 -1.216 . . . . 0.0 113.1 177.396 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 96.7 t -80.6 -39.74 18.7 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.152 0 C-N-CA 123.703 0.801 . . . . 0.0 111.478 173.283 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 72.6 m -124.06 -1.02 8.31 Favored 'General case' 0 N--CA 1.479 0.987 0 N-CA-C 116.281 1.956 . . . . 0.0 116.281 -162.216 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . -63.0 -22.15 64.45 Favored Glycine 0 N--CA 1.476 1.308 0 CA-C-N 119.707 1.14 . . . . 0.0 115.837 -165.167 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 35.2 mm-40 -74.47 -23.91 58.96 Favored 'General case' 0 CA--C 1.547 0.837 0 CA-C-N 118.416 1.108 . . . . 0.0 112.897 172.574 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 74.3 mtt180 -102.48 -39.36 7.16 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 125.857 1.663 . . . . 0.0 113.132 -177.503 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 99.97 148.49 22.72 Favored Glycine 0 CA--C 1.534 1.278 0 C-N-CA 125.775 1.655 . . . . 0.0 112.159 -166.694 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 39.8 p90 -133.49 167.88 19.64 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 125.288 1.435 . . . . 0.0 113.238 -175.053 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 98.1 m-85 . . . . . 0 CA--C 1.538 0.515 0 C-N-CA 125.89 1.676 . . . . 0.0 110.713 173.734 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 27.2 t . . . . . 0 N--CA 1.482 1.166 0 N-CA-C 112.449 0.537 . . . . 0.0 112.449 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 3.5 pm0 -72.15 -5.17 33.65 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 125.37 1.468 . . . . 0.0 113.957 -177.789 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 57.1 tp60 -104.18 -53.93 2.64 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 124.508 1.123 . . . . 0.0 110.076 165.849 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 1.8 t -81.12 -17.73 48.9 Favored 'General case' 0 N--CA 1.469 0.477 0 N-CA-C 114.67 1.359 . . . . 0.0 114.67 -165.457 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 27.4 t -87.93 -37.48 16.39 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 123.231 0.612 . . . . 0.0 112.139 -179.947 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 16.7 p -88.94 -52.65 4.98 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 126.71 2.004 . . . . 0.0 111.363 -178.916 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 14.2 t -102.37 -149.91 0.4 Allowed 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 125.778 1.631 . . . . 0.0 109.889 168.044 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 48.0 pt -113.12 160.89 12.44 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.659 0 C-N-CA 125.165 1.386 . . . . 0.0 111.882 178.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 15.5 p -139.48 163.2 33.15 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 123.99 0.916 . . . . 0.0 112.108 164.358 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 6.9 t -108.25 162.02 14.47 Favored 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 124.214 1.006 . . . . 0.0 112.925 179.852 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 6.7 mp -61.69 -32.3 72.49 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 124.412 1.085 . . . . 0.0 110.783 176.542 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 86.1 m-85 -65.3 -25.85 67.81 Favored 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 113.45 0.907 . . . . 0.0 113.45 173.932 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 75.2 mt-30 -82.32 -38.79 23.77 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 124.408 1.083 . . . . 0.0 110.921 172.887 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 85.3 mt -59.75 -38.07 80.72 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 119.257 0.935 . . . . 0.0 111.364 170.349 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 -64.95 -21.47 66.84 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 124.778 1.231 . . . . 0.0 113.022 173.184 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 21.9 t30 -82.91 -28.47 29.93 Favored 'General case' 0 CA--C 1.547 0.843 0 O-C-N 121.06 -1.025 . . . . 0.0 112.995 172.419 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 23.5 m-85 -78.36 -23.31 46.98 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 124.133 0.973 . . . . 0.0 113.198 171.234 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 14.0 t . . . . . 0 N--CA 1.47 0.527 0 C-N-CA 124.537 1.135 . . . . 0.0 111.434 160.529 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.542 0.654 0 N-CA-C 112.228 0.455 . . . . 0.0 112.228 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 39.9 mt-30 -145.42 161.52 39.48 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 123.747 0.819 . . . . 0.0 111.769 -163.43 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 97.8 m-70 -81.29 130.57 35.09 Favored 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 108.45 -0.944 . . . . 0.0 108.45 157.235 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 89.8 mt -147.37 138.42 23.69 Favored 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 125.133 1.373 . . . . 0.0 108.501 -177.604 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 3.6 t -149.64 154.85 39.27 Favored 'General case' 0 C--O 1.236 0.351 0 O-C-N 121.575 -0.703 . . . . 0.0 112.25 -178.462 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 54.11 -129.81 43.23 Favored Glycine 0 CA--C 1.53 0.986 0 C-N-CA 125.711 1.624 . . . . 0.0 113.668 174.334 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 33.4 p -57.75 -40.19 79.13 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 124.41 1.084 . . . . 0.0 112.821 -179.621 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 73.7 m-70 -71.57 -28.99 64.22 Favored 'General case' 0 CA--C 1.54 0.585 0 O-C-N 120.951 -1.093 . . . . 0.0 113.108 178.308 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 45.7 tp -70.22 -44.73 67.98 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 119.037 0.835 . . . . 0.0 111.449 169.9 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 76.3 t -62.55 -37.99 80.29 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.056 0 C-N-CA 122.961 0.504 . . . . 0.0 111.558 174.932 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -62.37 -51.0 69.33 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 125.593 1.557 . . . . 0.0 111.149 173.95 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.88 -45.44 93.76 Favored 'General case' 0 CA--C 1.542 0.635 0 O-C-N 121.809 -0.557 . . . . 0.0 111.74 179.264 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 31.0 tp -59.44 -47.48 85.31 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 124.835 1.254 . . . . 0.0 111.228 176.762 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 56.2 t80 -58.24 -43.04 87.62 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 123.978 0.911 . . . . 0.0 113.109 172.304 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 77.1 mt -70.65 -34.45 72.05 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 113.154 0.798 . . . . 0.0 113.154 -179.502 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 41.2 t -70.27 -43.27 78.69 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.011 0 C-N-CA 123.787 0.835 . . . . 0.0 111.146 172.099 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 44.6 t -81.0 -30.23 35.01 Favored 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 114.394 1.257 . . . . 0.0 114.394 -173.157 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 67.93 -147.1 47.52 Favored Glycine 0 CA--C 1.533 1.173 0 C-N-CA 124.604 1.097 . . . . 0.0 112.348 -172.992 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -69.7 -13.57 62.36 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 124.879 1.271 . . . . 0.0 113.616 -177.744 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 40.6 mtp85 -59.05 -37.24 76.54 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 124.773 1.229 . . . . 0.0 113.948 -173.67 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 90.98 150.4 24.87 Favored Glycine 0 CA--C 1.536 1.365 0 C-N-CA 124.94 1.257 . . . . 0.0 113.515 -176.141 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 35.2 p90 -137.46 159.94 40.53 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 125.086 1.354 . . . . 0.0 112.605 -171.448 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 69.5 t80 . . . . . 0 CA--C 1.539 0.555 0 C-N-CA 124.811 1.245 . . . . 0.0 110.125 165.791 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 98.5 t . . . . . 0 N--CA 1.477 0.905 0 CA-C-O 118.411 -0.804 . . . . 0.0 111.425 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -57.86 -46.54 84.67 Favored 'General case' 0 N--CA 1.472 0.674 0 CA-C-N 119.894 1.225 . . . . 0.0 110.398 174.546 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 8.3 tp-100 -64.2 -56.31 15.6 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 124.051 0.94 . . . . 0.0 111.04 178.96 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 4.2 t -79.62 -15.12 58.19 Favored 'General case' 0 N--CA 1.469 0.518 0 N-CA-C 114.777 1.399 . . . . 0.0 114.777 -169.027 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 14.0 t -92.99 -31.09 15.01 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 123.602 0.761 . . . . 0.0 112.606 178.347 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 56.4 p -94.44 -43.2 8.48 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 124.076 0.95 . . . . 0.0 112.144 175.856 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 60.4 m -108.64 -140.69 0.38 Allowed 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 126.203 1.801 . . . . 0.0 109.162 167.486 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 30.2 pt -127.81 163.04 32.38 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.974 0 C-N-CA 124.945 1.298 . . . . 0.0 112.508 -174.96 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 18.7 p -145.76 165.71 28.02 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 125.399 1.479 . . . . 0.0 110.88 167.297 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 95.3 p -111.56 164.1 13.35 Favored 'General case' 0 N--CA 1.467 0.416 0 C-N-CA 124.474 1.11 . . . . 0.0 112.093 177.461 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 70.7 mt -59.64 -32.49 70.49 Favored 'General case' 0 CA--C 1.537 0.447 0 O-C-N 121.576 -0.703 . . . . 0.0 111.489 170.56 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 62.2 m-85 -69.69 -29.09 66.43 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 125.21 1.404 . . . . 0.0 113.047 175.541 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 16.8 mm100 -75.6 -39.65 57.64 Favored 'General case' 0 N--CA 1.467 0.419 0 O-C-N 121.703 -0.623 . . . . 0.0 111.339 168.873 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 87.5 mt -62.15 -34.63 76.75 Favored 'General case' 0 N--CA 1.473 0.702 0 CA-C-N 119.492 1.042 . . . . 0.0 111.693 172.558 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -61.19 -30.11 70.21 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 124.199 0.999 . . . . 0.0 112.335 174.6 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 13.8 t-20 -72.7 -22.56 60.88 Favored 'General case' 0 CA--C 1.548 0.892 0 O-C-N 121.401 -0.812 . . . . 0.0 112.857 175.394 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 27.8 m-85 -85.25 -9.56 57.58 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 124.833 1.253 . . . . 0.0 113.736 173.188 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 61.3 m . . . . . 0 CA--C 1.543 0.699 0 CA-C-N 119.543 1.065 . . . . 0.0 112.409 172.186 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 11.4 p30 . . . . . 0 CA--C 1.539 0.53 0 CA-C-O 121.304 0.573 . . . . 0.0 111.709 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 40.4 mt-30 -150.25 164.58 35.37 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.615 1.166 . . . . 0.0 111.09 -165.712 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 98.7 m-70 -86.78 132.54 33.82 Favored 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 108.462 -0.94 . . . . 0.0 108.462 153.527 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 89.2 mt -145.82 143.16 29.47 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 125.566 1.546 . . . . 0.0 108.767 -179.211 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 2.0 t -148.3 149.51 31.97 Favored 'General case' 0 N--CA 1.466 0.344 0 N-CA-C 112.608 0.595 . . . . 0.0 112.608 -173.185 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 44.2 -125.9 5.99 Favored Glycine 0 N--CA 1.471 1.006 0 C-N-CA 126.271 1.891 . . . . 0.0 114.349 173.641 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 19.8 m -60.13 -30.75 69.49 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 124.549 1.139 . . . . 0.0 113.021 -178.249 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 78.7 m-70 -78.63 -28.11 45.53 Favored 'General case' 0 CA--C 1.538 0.516 0 O-C-N 120.891 -1.131 . . . . 0.0 112.661 176.631 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 6.8 tt -68.21 -45.24 73.88 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 119.445 1.02 . . . . 0.0 110.644 165.884 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 73.3 t -57.56 -41.31 78.76 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.007 0 C-N-CA 123.631 0.772 . . . . 0.0 111.749 174.985 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 45.4 tt0 -61.56 -51.08 70.05 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 125.236 1.414 . . . . 0.0 111.279 174.293 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.43 -46.44 90.08 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 123.275 0.63 . . . . 0.0 111.547 179.09 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 51.5 tp -57.48 -53.52 57.19 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 126.185 1.794 . . . . 0.0 111.118 177.246 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 52.4 t80 -53.91 -43.56 69.81 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 123.656 0.783 . . . . 0.0 112.531 174.166 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 81.7 mt -70.24 -35.03 73.55 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 124.002 0.921 . . . . 0.0 113.065 179.726 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 37.1 t -65.09 -44.64 95.65 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.908 0 C-N-CA 124.369 1.068 . . . . 0.0 110.669 170.987 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 64.3 m -75.52 -28.61 59.18 Favored 'General case' 0 CA--C 1.541 0.607 0 N-CA-C 113.539 0.94 . . . . 0.0 113.539 -177.226 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 68.69 -116.5 7.43 Favored Glycine 0 CA--C 1.528 0.888 0 C-N-CA 124.646 1.117 . . . . 0.0 111.792 175.793 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 1.7 pm0 -73.21 -20.28 60.91 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 124.2 1.0 . . . . 0.0 113.474 174.196 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 76.9 mtp180 -74.32 147.27 42.42 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 124.227 1.011 . . . . 0.0 110.346 173.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . -76.78 -173.81 38.46 Favored Glycine 0 CA--C 1.53 1.013 0 C-N-CA 123.496 0.57 . . . . 0.0 111.937 167.607 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 42.8 p90 -149.01 153.74 38.32 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.192 0.997 . . . . 0.0 113.651 178.752 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 61.3 t80 . . . . . 0 CA--C 1.54 0.575 0 C-N-CA 125.394 1.478 . . . . 0.0 109.645 159.699 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 53.1 t . . . . . 0 N--CA 1.48 1.036 0 N-CA-C 112.608 0.596 . . . . 0.0 112.608 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -88.47 -43.45 11.44 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 118.568 0.622 . . . . 0.0 111.3 169.419 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 43.3 tp60 -63.91 -40.72 97.14 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 123.354 0.662 . . . . 0.0 112.725 -171.022 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 11.9 t -77.87 -13.39 59.9 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 118.953 0.797 . . . . 0.0 112.982 175.527 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 17.1 t -84.77 -40.08 17.67 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.05 0.94 . . . . 0.0 112.25 175.059 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 47.1 p -87.25 -48.41 8.04 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 124.937 1.295 . . . . 0.0 111.928 178.194 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 10.3 t -97.92 -146.89 0.31 Allowed 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 125.55 1.54 . . . . 0.0 109.996 166.753 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 31.0 pt -124.31 164.27 22.92 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.865 0 C-N-CA 125.915 1.686 . . . . 0.0 112.488 -177.522 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 19.7 p -149.26 173.33 13.6 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 125.264 1.425 . . . . 0.0 110.993 166.05 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 2.8 m -131.14 164.11 26.2 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 124.225 1.01 . . . . 0.0 111.473 -170.929 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 30.4 mt -62.33 -39.44 93.08 Favored 'General case' 0 N--CA 1.468 0.458 0 O-C-N 121.292 -0.88 . . . . 0.0 111.755 -175.521 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 20.2 p90 -65.68 -31.26 72.17 Favored 'General case' 0 N--CA 1.471 0.581 0 O-C-N 121.277 -0.889 . . . . 0.0 113.27 173.685 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 49.4 mt-30 -76.48 -31.16 57.6 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 123.475 0.71 . . . . 0.0 111.516 176.617 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 80.5 mt -66.52 -43.7 84.52 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 123.996 0.918 . . . . 0.0 111.062 168.459 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 31.8 tt0 -61.3 -23.64 65.84 Favored 'General case' 0 CA--C 1.547 0.83 0 N-CA-C 113.536 0.939 . . . . 0.0 113.536 -178.22 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 22.1 t30 -55.14 -28.43 52.68 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 124.404 1.082 . . . . 0.0 113.539 171.867 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 97.8 m-85 -93.35 5.71 50.63 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.819 1.648 . . . . 0.0 113.646 -178.404 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 68.7 m . . . . . 0 N--CA 1.469 0.512 0 C-N-CA 125.862 1.665 . . . . 0.0 113.886 178.724 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 5.9 p-10 . . . . . 0 N--CA 1.469 0.522 0 N-CA-C 112.611 0.597 . . . . 0.0 112.611 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 43.2 mt-30 -148.2 165.26 31.45 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 125.45 1.5 . . . . 0.0 110.77 -177.578 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 96.1 m-70 -89.02 128.31 35.71 Favored 'General case' 0 CA--C 1.542 0.655 0 N-CA-C 108.178 -1.045 . . . . 0.0 108.178 156.236 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 74.5 mt -140.53 131.49 26.11 Favored 'General case' 0 N--CA 1.466 0.356 0 C-N-CA 124.738 1.215 . . . . 0.0 109.414 -176.884 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 57.0 m -125.94 136.82 53.46 Favored 'General case' 0 N--CA 1.467 0.4 0 C-N-CA 124.72 1.208 . . . . 0.0 110.726 -175.667 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 47.3 -118.02 3.67 Favored Glycine 0 N--CA 1.473 1.145 0 C-N-CA 125.404 1.478 . . . . 0.0 114.564 164.976 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 21.0 p -57.95 -35.9 71.78 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 124.563 1.145 . . . . 0.0 113.254 178.932 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 86.6 m-70 -76.33 -27.93 56.71 Favored 'General case' 0 CA--C 1.542 0.645 0 O-C-N 120.756 -1.215 . . . . 0.0 112.775 176.353 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 8.2 tt -67.03 -46.1 75.47 Favored 'General case' 0 N--CA 1.468 0.434 0 O-C-N 121.24 -0.912 . . . . 0.0 110.78 166.385 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 55.0 t -62.95 -36.39 75.5 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.142 0 C-N-CA 123.622 0.769 . . . . 0.0 111.638 177.543 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 44.2 tt0 -62.48 -51.03 69.07 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 125.503 1.521 . . . . 0.0 111.217 172.548 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.94 -46.42 90.77 Favored 'General case' 0 CA--C 1.539 0.542 0 O-C-N 121.777 -0.577 . . . . 0.0 111.797 177.543 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 53.8 tp -56.29 -49.25 74.78 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 125.688 1.595 . . . . 0.0 111.432 177.069 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 44.6 t80 -58.61 -42.55 88.41 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 123.628 0.771 . . . . 0.0 113.003 173.436 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 83.1 mt -74.6 -31.4 62.02 Favored 'General case' 0 N--CA 1.473 0.682 0 N-CA-C 113.208 0.818 . . . . 0.0 113.208 -177.845 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 41.4 t -67.27 -46.85 83.06 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.877 0 C-N-CA 124.333 1.053 . . . . 0.0 110.474 171.913 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 72.1 m -93.31 -24.96 17.95 Favored 'General case' 0 N--CA 1.469 0.497 0 N-CA-C 114.587 1.329 . . . . 0.0 114.587 -168.147 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 64.65 -136.46 38.87 Favored Glycine 0 CA--C 1.532 1.147 0 C-N-CA 124.478 1.037 . . . . 0.0 112.696 177.444 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -63.3 -17.47 62.56 Favored 'General case' 0 CA--C 1.544 0.728 0 N-CA-C 114.659 1.355 . . . . 0.0 114.659 -177.727 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 83.3 mtm180 -61.71 -31.52 71.68 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 124.506 1.122 . . . . 0.0 113.301 -177.952 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 79.41 166.87 33.01 Favored Glycine 0 CA--C 1.533 1.205 0 C-N-CA 124.403 1.002 . . . . 0.0 113.515 -177.03 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 47.7 p90 -152.7 165.47 35.18 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 124.584 1.154 . . . . 0.0 113.694 -168.15 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 87.4 t80 . . . . . 0 CA--C 1.542 0.638 0 C-N-CA 125.15 1.38 . . . . 0.0 110.287 166.543 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 84.5 t . . . . . 0 N--CA 1.481 1.114 0 CA-C-O 119.347 -0.359 . . . . 0.0 111.539 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 44.1 tt0 -83.99 -53.7 5.38 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 118.431 0.559 . . . . 0.0 110.262 168.429 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 31.7 tt0 -64.81 -41.38 95.83 Favored 'General case' 0 CA--C 1.535 0.367 0 N-CA-C 113.275 0.842 . . . . 0.0 113.275 -165.448 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 4.5 t -85.24 -10.37 56.62 Favored 'General case' 0 N--CA 1.476 0.851 0 CA-C-N 119.907 1.231 . . . . 0.0 113.298 179.768 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 21.7 t -89.98 -34.55 15.95 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 124.863 1.265 . . . . 0.0 111.907 176.243 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 46.2 p -95.94 -45.33 6.98 Favored 'General case' 0 N--CA 1.478 0.925 0 C-N-CA 126.106 1.762 . . . . 0.0 112.518 179.151 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.6 t -104.42 -161.11 0.8 Allowed 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 125.177 1.391 . . . . 0.0 110.029 166.394 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 7.8 tt -113.45 154.06 14.9 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.903 0 C-N-CA 125.685 1.594 . . . . 0.0 111.289 -177.63 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 14.8 p -141.6 162.33 35.75 Favored 'General case' 0 N--CA 1.475 0.779 0 O-C-N 121.259 -0.9 . . . . 0.0 113.154 173.436 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 83.3 p -104.87 166.91 10.06 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 125.429 1.492 . . . . 0.0 113.1 -177.846 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 62.2 mt -63.83 -37.99 89.45 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 123.72 0.808 . . . . 0.0 111.87 174.419 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 20.8 p90 -68.4 -32.56 72.71 Favored 'General case' 0 N--CA 1.469 0.499 0 N-CA-C 113.296 0.85 . . . . 0.0 113.296 175.048 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 16.7 mm100 -70.57 -35.06 72.85 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-O 119.069 -0.491 . . . . 0.0 111.885 172.314 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 88.9 mt -66.94 -37.07 83.63 Favored 'General case' 0 N--CA 1.472 0.674 0 CA-C-N 119.15 0.886 . . . . 0.0 112.226 170.926 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -62.69 -25.6 68.24 Favored 'General case' 0 CA--C 1.543 0.694 0 N-CA-C 113.335 0.865 . . . . 0.0 113.335 -178.73 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 25.9 t30 -53.93 -28.5 37.38 Favored 'General case' 0 CA--C 1.548 0.877 0 C-N-CA 124.287 1.035 . . . . 0.0 113.347 171.74 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 98.7 m-85 -96.77 2.89 52.44 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 125.8 1.64 . . . . 0.0 114.19 -175.43 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 70.0 m . . . . . 0 CA--C 1.544 0.748 0 N-CA-C 113.418 0.895 . . . . 0.0 113.418 174.194 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 3.3 m120 . . . . . 0 N--CA 1.469 0.5 0 CA-C-O 120.797 0.332 . . . . 0.0 111.654 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 90.4 mt-30 -146.15 157.92 43.85 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 124.921 1.288 . . . . 0.0 110.569 -177.767 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 96.8 m-70 -86.26 131.08 34.31 Favored 'General case' 0 CA--C 1.541 0.615 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 162.67 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 83.5 mt -145.53 134.2 22.21 Favored 'General case' 0 N--CA 1.464 0.244 0 C-N-CA 124.899 1.28 . . . . 0.0 109.493 -168.652 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 2.0 t -151.12 153.31 34.77 Favored 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 123.857 0.863 . . . . 0.0 111.517 -176.601 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 48.14 -126.11 14.02 Favored Glycine 0 CA--C 1.532 1.116 0 C-N-CA 125.115 1.341 . . . . 0.0 113.707 176.137 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 19.4 m -60.19 -31.49 70.18 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 124.359 1.064 . . . . 0.0 112.938 -179.001 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 99.2 m-70 -74.41 -35.46 63.42 Favored 'General case' 0 CA--C 1.54 0.589 0 O-C-N 121.157 -0.964 . . . . 0.0 111.918 178.021 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 60.0 tp -67.32 -43.03 82.62 Favored 'General case' 0 N--CA 1.47 0.551 0 O-C-N 121.749 -0.594 . . . . 0.0 111.23 170.43 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 42.7 t -59.91 -42.16 88.38 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.951 0 C-N-CA 124.151 0.98 . . . . 0.0 111.583 174.448 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -64.66 -46.1 83.9 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 124.215 1.006 . . . . 0.0 111.828 174.596 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.3 -46.27 90.45 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 123.27 0.628 . . . . 0.0 112.319 177.641 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 42.3 mt -56.55 -51.95 66.63 Favored 'General case' 0 N--CA 1.466 0.34 0 C-N-CA 124.003 0.921 . . . . 0.0 111.191 173.584 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 59.1 t80 -54.25 -43.18 70.69 Favored 'General case' 0 CA--C 1.542 0.658 0 N-CA-C 112.767 0.655 . . . . 0.0 112.767 176.298 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 91.2 mt -74.05 -36.66 64.39 Favored 'General case' 0 N--CA 1.469 0.494 0 N-CA-C 113.516 0.932 . . . . 0.0 113.516 -179.664 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 33.4 t -66.65 -43.96 90.02 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.958 0 C-N-CA 124.358 1.063 . . . . 0.0 110.637 174.206 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 79.1 m -79.78 -30.61 40.71 Favored 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 113.262 0.838 . . . . 0.0 113.262 -175.291 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 69.21 -113.32 5.08 Favored Glycine 0 CA--C 1.53 0.989 0 C-N-CA 124.489 1.042 . . . . 0.0 111.836 173.041 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 39.7 mm-40 -71.54 -22.38 61.77 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 123.884 0.874 . . . . 0.0 112.819 174.882 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 84.0 mtm180 -75.27 154.25 37.54 Favored 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 124.749 1.22 . . . . 0.0 110.954 175.137 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . -77.72 -174.21 41.71 Favored Glycine 0 N--CA 1.472 1.047 0 C-N-CA 123.814 0.721 . . . . 0.0 111.692 169.321 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 55.1 p90 -157.73 165.5 35.23 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 124.835 1.254 . . . . 0.0 112.7 178.912 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 88.6 t80 . . . . . 0 N--CA 1.466 0.333 0 C-N-CA 124.867 1.267 . . . . 0.0 111.504 170.25 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 91.0 t . . . . . 0 N--CA 1.479 0.986 0 N-CA-C 109.73 -0.47 . . . . 0.0 109.73 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 59.8 tt0 -55.8 -47.9 76.33 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 123.976 0.91 . . . . 0.0 111.355 174.831 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 20.6 tt0 -62.75 -48.33 79.63 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 123.01 0.524 . . . . 0.0 111.492 -179.238 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 65.9 m -63.63 -34.37 77.68 Favored 'General case' 0 N--CA 1.466 0.373 0 N-CA-C 113.766 1.024 . . . . 0.0 113.766 178.643 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 74.7 m -77.25 -38.61 50.7 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.753 0.821 . . . . 0.0 112.277 -179.013 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 78.9 p -95.97 -23.08 17.01 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 124.87 1.268 . . . . 0.0 113.74 -174.186 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.2 t -141.95 -169.3 2.89 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 125.599 1.56 . . . . 0.0 111.154 -177.844 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 38.0 mm -86.24 133.93 28.57 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.704 0 O-C-N 120.696 -1.253 . . . . 0.0 109.793 175.87 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 16.1 p -127.11 163.53 23.6 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 124.193 0.997 . . . . 0.0 112.163 170.908 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 96.5 p -108.28 158.64 17.3 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 124.259 1.024 . . . . 0.0 112.959 -177.581 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 55.6 mt -64.22 -34.18 77.51 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 123.738 0.815 . . . . 0.0 111.391 173.402 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 82.5 t80 -62.66 -35.83 80.89 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 123.756 0.823 . . . . 0.0 113.149 172.474 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 37.1 mt-30 -73.72 -32.76 64.04 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-O 118.502 -0.761 . . . . 0.0 112.121 173.775 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 81.7 mt -65.16 -40.4 94.27 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 119.594 1.088 . . . . 0.0 111.707 168.526 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -60.81 -26.93 67.66 Favored 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 113.478 0.918 . . . . 0.0 113.478 -177.1 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 18.9 t30 -55.34 -27.76 49.33 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 123.921 0.888 . . . . 0.0 113.323 172.522 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 97.0 m-85 -98.79 5.48 47.47 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 125.838 1.655 . . . . 0.0 114.251 -175.451 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 73.5 m . . . . . 0 CA--C 1.543 0.68 0 C-N-CA 123.719 0.808 . . . . 0.0 113.09 169.936 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 55.3 m-20 . . . . . 0 CA--C 1.538 0.514 0 CA-C-O 120.176 0.036 . . . . 0.0 110.935 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 28.9 mm-40 -149.69 167.92 25.08 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 124.1 0.96 . . . . 0.0 112.48 -165.359 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 88.1 m-70 -79.16 138.88 38.06 Favored 'General case' 0 CA--C 1.542 0.646 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 155.092 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 43.1 mt -151.17 136.17 17.42 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 124.78 1.232 . . . . 0.0 108.61 -175.617 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 2.3 t -155.41 153.97 31.21 Favored 'General case' 0 CA--C 1.534 0.328 0 O-C-N 121.549 -0.719 . . . . 0.0 112.343 -176.357 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 54.32 -130.97 45.5 Favored Glycine 0 CA--C 1.532 1.149 0 C-N-CA 125.195 1.379 . . . . 0.0 113.617 175.034 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 25.4 p -57.59 -38.0 74.15 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 124.353 1.061 . . . . 0.0 112.803 178.323 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 73.4 m-70 -71.95 -29.51 64.34 Favored 'General case' 0 CA--C 1.544 0.735 0 O-C-N 121.107 -0.995 . . . . 0.0 112.801 177.533 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 9.7 tt -66.74 -47.19 73.06 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 119.527 1.058 . . . . 0.0 110.877 168.123 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 58.3 t -61.87 -38.78 81.42 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.897 0 C-N-CA 123.239 0.616 . . . . 0.0 111.403 178.971 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -61.73 -51.86 66.62 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 125.709 1.604 . . . . 0.0 111.509 172.425 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.58 -46.16 91.07 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 123.231 0.612 . . . . 0.0 112.01 179.608 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 46.7 tp -58.19 -51.67 68.79 Favored 'General case' 0 CA--C 1.53 0.182 0 C-N-CA 124.807 1.243 . . . . 0.0 111.014 176.699 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 56.8 t80 -54.37 -42.59 70.5 Favored 'General case' 0 CA--C 1.543 0.678 0 N-CA-C 112.868 0.692 . . . . 0.0 112.868 174.262 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 83.0 mt -71.53 -34.68 70.26 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 124.093 0.957 . . . . 0.0 113.163 178.911 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 25.2 t -64.47 -44.42 96.99 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.844 0 C-N-CA 124.534 1.133 . . . . 0.0 110.419 171.277 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 79.4 m -72.61 -34.08 67.13 Favored 'General case' 0 CA--C 1.538 0.513 0 N-CA-C 113.129 0.789 . . . . 0.0 113.129 -178.651 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 69.78 -111.63 3.96 Favored Glycine 0 CA--C 1.529 0.927 0 C-N-CA 124.743 1.163 . . . . 0.0 111.797 173.619 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -70.16 -26.65 64.02 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 124.33 1.052 . . . . 0.0 112.061 174.955 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 83.6 mtm180 -72.44 154.37 40.91 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 124.886 1.274 . . . . 0.0 111.137 176.211 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . -79.86 -167.61 35.47 Favored Glycine 0 N--CA 1.471 0.977 0 C-N-CA 124.255 0.931 . . . . 0.0 111.353 167.817 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 52.9 p90 -159.53 162.85 35.53 Favored 'General case' 0 CA--C 1.538 0.506 0 N-CA-C 113.789 1.033 . . . . 0.0 113.789 179.248 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 83.1 t80 . . . . . 0 CA--C 1.541 0.612 0 C-N-CA 125.733 1.613 . . . . 0.0 110.025 168.908 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 29.5 t . . . . . 0 N--CA 1.48 1.043 0 CA-C-O 119.321 -0.371 . . . . 0.0 110.723 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 46.6 tt0 -62.65 -47.62 82.89 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 118.623 0.647 . . . . 0.0 111.078 174.085 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 63.1 tp60 -63.26 -37.11 85.97 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 123.005 0.522 . . . . 0.0 112.095 -177.426 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 78.2 m -85.64 -29.3 24.15 Favored 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 114.607 1.336 . . . . 0.0 114.607 -179.828 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 41.7 t -98.48 -57.16 2.26 Favored 'General case' 0 N--CA 1.473 0.724 0 N-CA-C 113.272 0.841 . . . . 0.0 113.272 -166.301 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 36.5 p -88.7 -33.02 17.69 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 124.178 0.991 . . . . 0.0 111.914 179.228 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.0 t -94.13 -162.61 0.96 Allowed 'General case' 0 CA--C 1.551 0.982 0 C-N-CA 123.531 0.733 . . . . 0.0 110.935 158.396 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 12.0 tt -118.22 146.55 22.6 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.907 0 C-N-CA 125.926 1.69 . . . . 0.0 111.048 174.95 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 14.9 p -132.45 159.23 39.95 Favored 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 113.122 0.786 . . . . 0.0 113.122 177.675 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 52.6 m -99.72 154.03 18.63 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 125.315 1.446 . . . . 0.0 112.186 -179.612 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 43.9 mt -59.37 -33.13 70.81 Favored 'General case' 0 N--CA 1.472 0.653 0 O-C-N 120.86 -1.15 . . . . 0.0 112.042 173.487 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 83.2 t80 -62.41 -30.69 71.4 Favored 'General case' 0 CA--C 1.546 0.804 0 N-CA-C 113.368 0.877 . . . . 0.0 113.368 171.673 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 94.0 mt-30 -80.15 -33.95 38.08 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 123.83 0.852 . . . . 0.0 111.365 174.895 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 56.3 mt -56.93 -48.49 78.15 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 118.841 0.746 . . . . 0.0 110.397 166.444 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -66.19 -31.7 72.69 Favored 'General case' 0 CA--C 1.544 0.712 0 N-CA-C 112.853 0.686 . . . . 0.0 112.853 179.279 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 32.8 t30 -62.9 -27.25 69.24 Favored 'General case' 0 CA--C 1.55 0.973 0 O-C-N 120.965 -1.084 . . . . 0.0 113.24 176.035 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 10.9 m-85 -80.6 -4.19 53.19 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 124.697 1.199 . . . . 0.0 113.894 172.324 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 72.1 m . . . . . 0 N--CA 1.472 0.627 0 C-N-CA 124.905 1.282 . . . . 0.0 113.738 178.286 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.466 0.351 0 CA-C-O 120.977 0.418 . . . . 0.0 111.201 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 47.9 mm-40 -149.11 155.07 40.15 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 124.293 1.037 . . . . 0.0 110.694 -161.685 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 97.7 m-70 -87.69 122.95 32.0 Favored 'General case' 0 CA--C 1.539 0.552 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 164.545 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 77.5 mt -140.71 130.83 24.81 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 125.869 1.668 . . . . 0.0 109.139 -172.086 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 64.8 m -134.17 143.16 47.74 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 125.024 1.33 . . . . 0.0 111.091 -175.374 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 55.61 -125.66 37.31 Favored Glycine 0 N--CA 1.472 1.099 0 C-N-CA 124.763 1.173 . . . . 0.0 114.427 166.225 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 24.5 p -62.57 -34.57 77.24 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 124.382 1.073 . . . . 0.0 112.607 179.34 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 24.7 m80 -68.13 -38.7 82.5 Favored 'General case' 0 CA--C 1.541 0.622 0 O-C-N 121.275 -0.89 . . . . 0.0 111.422 176.038 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 50.4 tp -63.8 -49.43 72.91 Favored 'General case' 0 N--CA 1.464 0.272 0 C-N-CA 123.469 0.708 . . . . 0.0 111.172 170.889 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 47.8 t -58.32 -39.94 76.04 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.905 0 C-N-CA 123.093 0.557 . . . . 0.0 111.83 177.938 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -64.68 -49.75 69.71 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 123.786 0.835 . . . . 0.0 111.82 175.384 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.9 -46.89 88.86 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 123.34 0.656 . . . . 0.0 111.932 179.362 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 52.4 tp -56.0 -50.71 70.11 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 126.365 1.866 . . . . 0.0 111.409 175.482 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 91.4 t80 -61.14 -40.09 92.53 Favored 'General case' 0 CA--C 1.54 0.572 0 N-CA-C 112.998 0.74 . . . . 0.0 112.998 175.093 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 79.0 mt -72.7 -36.05 67.76 Favored 'General case' 0 N--CA 1.471 0.621 0 N-CA-C 113.284 0.846 . . . . 0.0 113.284 -179.828 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 25.5 t -63.31 -45.86 97.09 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.081 0 C-N-CA 123.43 0.692 . . . . 0.0 110.45 171.408 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 69.7 m -83.6 -19.18 35.97 Favored 'General case' 0 CA--C 1.54 0.576 0 N-CA-C 114.193 1.183 . . . . 0.0 114.193 -173.685 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 76.44 -126.09 7.98 Favored Glycine 0 CA--C 1.53 1.019 0 C-N-CA 124.724 1.154 . . . . 0.0 111.574 174.146 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -72.5 -13.39 61.41 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 123.78 0.832 . . . . 0.0 113.121 175.677 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 87.7 mtm180 -71.07 159.16 35.22 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 124.645 1.178 . . . . 0.0 112.511 178.504 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . -91.76 157.72 24.64 Favored Glycine 0 CA--C 1.528 0.873 0 C-N-CA 125.631 1.586 . . . . 0.0 112.246 174.981 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 49.1 p90 -127.42 151.8 48.35 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 125.255 1.422 . . . . 0.0 112.757 -178.553 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 30.2 t80 . . . . . 0 CA--C 1.542 0.646 0 C-N-CA 126.38 1.872 . . . . 0.0 110.267 165.413 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 91.3 t . . . . . 0 N--CA 1.477 0.922 0 N-CA-C 110.441 -0.207 . . . . 0.0 110.441 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -62.33 -44.01 97.5 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 124.855 1.262 . . . . 0.0 111.359 176.731 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 17.5 tt0 -61.96 -56.44 19.18 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.074 0.949 . . . . 0.0 110.138 177.763 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 70.3 m -56.1 -33.43 65.08 Favored 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 113.759 1.022 . . . . 0.0 113.759 -179.728 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 12.6 t -91.38 -34.84 14.71 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 124.251 1.02 . . . . 0.0 113.691 -171.77 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 43.2 p -108.43 -26.08 10.65 Favored 'General case' 0 N--CA 1.482 1.134 0 N-CA-C 114.485 1.291 . . . . 0.0 114.485 -176.149 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 95.8 p -115.41 -131.28 0.32 Allowed 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 124.43 1.092 . . . . 0.0 109.129 162.337 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 10.0 tt -135.22 149.54 28.9 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 C-N-CA 125.219 1.408 . . . . 0.0 110.46 -177.95 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 15.6 p -140.26 157.19 45.97 Favored 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 113.427 0.899 . . . . 0.0 113.427 178.062 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 22.8 t -100.16 158.8 15.59 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-O 122.254 1.026 . . . . 0.0 113.151 178.271 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 52.7 mt -63.38 -33.92 76.6 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 123.847 0.859 . . . . 0.0 110.947 170.838 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 77.2 t80 -63.06 -29.58 70.92 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 124.103 0.961 . . . . 0.0 112.962 173.481 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 98.5 mt-30 -81.55 -38.88 25.49 Favored 'General case' 0 N--CA 1.467 0.381 0 C-N-CA 123.769 0.828 . . . . 0.0 110.736 176.101 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 86.8 mt -59.23 -36.06 74.75 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-N 119.135 0.88 . . . . 0.0 111.96 170.128 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -59.57 -26.98 65.86 Favored 'General case' 0 CA--C 1.546 0.799 0 N-CA-C 113.462 0.912 . . . . 0.0 113.462 178.722 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 26.4 t30 -60.86 -24.51 65.97 Favored 'General case' 0 CA--C 1.55 0.978 0 O-C-N 120.903 -1.123 . . . . 0.0 113.119 173.654 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 84.2 m-85 -98.47 5.96 47.59 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 126.429 1.892 . . . . 0.0 113.247 -178.079 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 71.1 m . . . . . 0 CA--C 1.543 0.674 0 C-N-CA 123.881 0.872 . . . . 0.0 112.753 166.12 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.541 0.597 0 N-CA-C 113.417 0.895 . . . . 0.0 113.417 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 38.5 mt-30 -147.4 163.04 37.73 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 124.961 1.305 . . . . 0.0 111.434 -168.427 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 98.2 m-70 -80.11 132.68 35.99 Favored 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 109.02 -0.733 . . . . 0.0 109.02 156.74 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 76.5 mt -148.21 139.13 23.14 Favored 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 125.327 1.451 . . . . 0.0 109.082 -176.464 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 2.8 t -159.14 155.7 27.7 Favored 'General case' 0 N--CA 1.468 0.474 0 O-C-N 121.587 -0.695 . . . . 0.0 111.904 -177.472 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 54.1 -135.17 44.02 Favored Glycine 0 CA--C 1.53 1.004 0 C-N-CA 124.922 1.249 . . . . 0.0 113.593 175.072 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 20.0 m -58.15 -33.02 68.73 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 124.056 0.942 . . . . 0.0 112.552 -179.712 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 76.2 m-70 -75.67 -28.76 58.83 Favored 'General case' 0 CA--C 1.543 0.688 0 O-C-N 121.102 -0.999 . . . . 0.0 112.85 178.565 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 9.3 tt -66.15 -46.52 77.19 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 119.312 0.96 . . . . 0.0 110.757 166.198 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 95.4 t -62.36 -38.93 82.45 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.766 0 C-N-CA 122.906 0.482 . . . . 0.0 111.396 179.364 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -62.13 -51.27 68.55 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 125.751 1.62 . . . . 0.0 111.691 172.234 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.04 -46.09 92.14 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 123.159 0.584 . . . . 0.0 111.913 179.151 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 58.5 tp -57.59 -53.19 60.96 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 124.66 1.184 . . . . 0.0 110.84 175.858 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 38.6 t80 -53.73 -41.42 67.05 Favored 'General case' 0 CA--C 1.543 0.693 0 N-CA-C 112.886 0.699 . . . . 0.0 112.886 175.308 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 83.2 mt -72.93 -33.08 65.72 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 124.203 1.001 . . . . 0.0 113.457 178.813 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 25.6 t -65.83 -43.91 93.07 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.922 0 C-N-CA 124.343 1.057 . . . . 0.0 110.344 170.78 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 69.5 m -73.07 -39.56 65.78 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 122.952 0.501 . . . . 0.0 112.335 -178.206 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 62.83 -104.35 0.78 Allowed Glycine 0 CA--C 1.533 1.176 0 C-N-CA 124.244 0.926 . . . . 0.0 112.059 174.006 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -77.05 -21.42 54.51 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 124.362 1.065 . . . . 0.0 113.854 175.045 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 1.4 mpp_? -73.52 154.01 40.05 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 123.528 0.731 . . . . 0.0 109.985 166.866 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . -77.4 -171.31 35.75 Favored Glycine 0 CA--C 1.534 1.267 0 C-N-CA 124.154 0.883 . . . . 0.0 111.248 166.101 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 43.8 p90 -156.53 162.96 39.9 Favored 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 113.969 1.1 . . . . 0.0 113.969 179.405 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 92.0 t80 . . . . . 0 CA--C 1.537 0.474 0 C-N-CA 125.436 1.494 . . . . 0.0 110.412 169.584 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 61.5 t . . . . . 0 N--CA 1.481 1.075 0 CA-C-O 119.285 -0.388 . . . . 0.0 110.971 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 79.5 mm-40 -72.13 -43.32 64.89 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 118.761 0.71 . . . . 0.0 111.149 171.912 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 66.3 tp60 -63.08 -36.24 82.93 Favored 'General case' 0 CA--C 1.534 0.34 0 O-C-N 121.744 -0.598 . . . . 0.0 112.135 -178.794 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 68.3 m -85.77 -29.8 23.55 Favored 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 114.575 1.324 . . . . 0.0 114.575 179.641 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 17.6 t -107.47 -41.67 5.01 Favored 'General case' 0 N--CA 1.473 0.698 0 N-CA-C 113.59 0.959 . . . . 0.0 113.59 -169.53 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 44.3 m -84.54 -46.34 11.69 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 125.013 1.325 . . . . 0.0 109.596 176.132 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 31.4 m -96.8 -162.74 0.98 Allowed 'General case' 0 CA--C 1.55 0.961 0 C-N-CA 124.643 1.177 . . . . 0.0 111.278 166.63 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 12.1 tt -111.38 148.3 14.74 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.944 0 C-N-CA 125.469 1.508 . . . . 0.0 110.154 170.996 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 14.7 p -135.5 163.12 30.81 Favored 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 113.554 0.946 . . . . 0.0 113.554 179.911 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 36.2 t -103.0 156.45 17.66 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 124.46 1.104 . . . . 0.0 112.6 177.07 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 69.0 mt -60.12 -30.0 69.0 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 123.977 0.911 . . . . 0.0 111.606 169.964 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 77.2 t80 -65.07 -27.39 68.74 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 123.997 0.919 . . . . 0.0 113.287 171.66 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 86.9 mt-30 -85.32 -33.16 22.15 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 124.061 0.944 . . . . 0.0 110.826 175.685 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 9.5 mp -56.18 -47.52 78.16 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 118.555 0.616 . . . . 0.0 110.749 165.274 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -66.35 -31.22 71.87 Favored 'General case' 0 CA--C 1.546 0.79 0 N-CA-C 112.817 0.673 . . . . 0.0 112.817 177.68 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 24.3 t30 -64.36 -26.94 68.69 Favored 'General case' 0 CA--C 1.547 0.856 0 O-C-N 120.953 -1.092 . . . . 0.0 112.902 173.934 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 10.7 m-85 -85.03 8.07 19.16 Favored 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 125.329 1.452 . . . . 0.0 114.02 171.901 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 73.3 m . . . . . 0 N--CA 1.472 0.629 0 C-N-CA 125.153 1.381 . . . . 0.0 113.408 175.556 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 44.4 p-10 . . . . . 0 CA--C 1.542 0.657 0 N-CA-C 113.541 0.941 . . . . 0.0 113.541 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 44.8 mt-30 -150.86 158.9 44.72 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 125.796 1.638 . . . . 0.0 110.953 -172.334 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 96.9 m-70 -87.52 127.78 35.24 Favored 'General case' 0 CA--C 1.54 0.59 0 N-CA-C 108.963 -0.754 . . . . 0.0 108.963 159.989 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 87.4 mt -140.62 131.41 25.84 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 125.876 1.67 . . . . 0.0 108.715 -173.476 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 71.7 m -138.07 146.23 42.7 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 124.483 1.113 . . . . 0.0 111.56 -172.861 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 55.57 -131.67 49.33 Favored Glycine 0 N--CA 1.471 0.978 0 C-N-CA 124.961 1.267 . . . . 0.0 114.208 165.262 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 22.6 m -59.13 -33.17 70.55 Favored 'General case' 0 N--CA 1.468 0.465 0 C-N-CA 124.241 1.016 . . . . 0.0 112.375 -179.543 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 75.2 m-70 -75.88 -27.8 57.89 Favored 'General case' 0 CA--C 1.542 0.639 0 O-C-N 121.065 -1.022 . . . . 0.0 112.813 176.336 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 54.9 tp -70.15 -46.79 63.98 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-N 119.104 0.865 . . . . 0.0 110.604 167.26 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 74.4 t -55.93 -43.0 73.41 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.306 0 CA-C-N 118.744 0.702 . . . . 0.0 111.43 174.675 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -60.45 -48.99 79.37 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 125.442 1.497 . . . . 0.0 111.477 173.039 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.35 -42.87 99.4 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 123.467 0.707 . . . . 0.0 112.673 179.215 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -52.71 -55.16 24.69 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-N 119.432 1.014 . . . . 0.0 110.58 172.576 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 70.6 t80 -60.21 -35.12 74.71 Favored 'General case' 0 CA--C 1.543 0.691 0 N-CA-C 113.471 0.915 . . . . 0.0 113.471 178.753 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 83.9 mt -74.93 -34.07 62.05 Favored 'General case' 0 N--CA 1.472 0.649 0 N-CA-C 113.524 0.935 . . . . 0.0 113.524 177.43 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 49.5 t -71.16 -42.89 75.58 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.918 0 C-N-CA 123.812 0.845 . . . . 0.0 110.765 174.544 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 70.2 m -102.67 -24.63 13.74 Favored 'General case' 0 N--CA 1.468 0.463 0 N-CA-C 114.771 1.397 . . . . 0.0 114.771 -165.76 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 64.59 -140.6 42.93 Favored Glycine 0 CA--C 1.534 1.231 0 C-N-CA 124.094 0.854 . . . . 0.0 112.315 -178.536 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 57.3 mp0 -65.03 -11.87 44.03 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 125.732 1.613 . . . . 0.0 114.19 -178.412 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 82.6 mtm180 -61.95 -28.79 69.79 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 124.195 0.998 . . . . 0.0 113.322 177.662 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 81.04 162.35 28.23 Favored Glycine 0 CA--C 1.532 1.155 0 C-N-CA 124.53 1.062 . . . . 0.0 112.918 -178.195 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 54.7 p90 -143.54 158.75 43.41 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 125.201 1.4 . . . . 0.0 113.48 -169.501 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 78.3 m-85 . . . . . 0 CA--C 1.54 0.587 0 C-N-CA 126.573 1.949 . . . . 0.0 110.648 169.912 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 56.1 t . . . . . 0 N--CA 1.48 1.07 0 N-CA-C 112.08 0.4 . . . . 0.0 112.08 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 14.4 mm-40 -82.84 -56.25 3.93 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 118.286 0.493 . . . . 0.0 110.618 167.333 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 1.2 tm0? -60.86 -46.41 90.71 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 123.035 0.534 . . . . 0.0 112.237 -166.673 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 70.4 m -76.65 -21.41 55.49 Favored 'General case' 0 N--CA 1.467 0.398 0 N-CA-C 114.289 1.218 . . . . 0.0 114.289 -177.339 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 10.6 t -100.69 -32.3 10.8 Favored 'General case' 0 CA--C 1.541 0.598 0 N-CA-C 113.244 0.831 . . . . 0.0 113.244 -173.851 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 44.5 p -95.76 -14.63 23.16 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 125.211 1.404 . . . . 0.0 113.429 176.586 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 84.3 p -144.34 -174.49 4.32 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 125.546 1.538 . . . . 0.0 110.173 174.279 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 16.9 tt -91.38 138.05 20.54 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.817 0 O-C-N 120.614 -1.304 . . . . 0.0 110.388 178.652 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 8.7 p -132.29 159.05 40.25 Favored 'General case' 0 N--CA 1.469 0.51 0 O-C-N 121.207 -0.933 . . . . 0.0 113.014 178.547 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 36.7 m -106.96 162.32 13.94 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 124.787 1.235 . . . . 0.0 111.145 -175.852 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 24.8 mt -59.32 -33.0 70.58 Favored 'General case' 0 CA--C 1.535 0.393 0 O-C-N 121.164 -0.96 . . . . 0.0 110.934 172.108 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 89.3 t80 -60.15 -33.16 71.78 Favored 'General case' 0 CA--C 1.546 0.815 0 N-CA-C 113.821 1.045 . . . . 0.0 113.821 170.68 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 14.0 mm100 -75.18 -33.92 61.5 Favored 'General case' 0 N--CA 1.471 0.589 0 O-C-N 121.537 -0.727 . . . . 0.0 111.217 174.941 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 93.2 mt -65.85 -44.33 85.8 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-N 118.307 0.503 . . . . 0.0 111.165 170.45 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -68.67 -26.83 65.51 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 125.325 1.45 . . . . 0.0 112.94 -177.078 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 18.6 t30 -52.73 -32.65 44.18 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 124.922 1.289 . . . . 0.0 113.771 179.773 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 84.3 m-85 -96.1 0.37 51.32 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 125.112 1.365 . . . . 0.0 114.365 -177.366 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 88.8 m . . . . . 0 CA--C 1.542 0.635 0 N-CA-C 114.333 1.234 . . . . 0.0 114.333 178.941 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 44.2 p-10 . . . . . 0 CA--C 1.543 0.698 0 CA-C-O 121.401 0.619 . . . . 0.0 112.403 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 41.4 mt-30 -148.34 162.55 39.3 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.039 0.936 . . . . 0.0 111.625 -160.535 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 95.7 m-70 -88.26 132.63 34.31 Favored 'General case' 0 CA--C 1.54 0.57 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 157.689 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 91.5 mt -144.43 132.5 21.6 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 125.347 1.459 . . . . 0.0 109.406 -174.668 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 62.6 m -139.52 151.2 45.94 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 125.159 1.384 . . . . 0.0 110.641 -175.909 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 57.78 -133.14 52.79 Favored Glycine 0 N--CA 1.473 1.112 0 C-N-CA 124.499 1.047 . . . . 0.0 114.466 165.558 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 13.5 t -59.1 -39.41 82.14 Favored 'General case' 0 N--CA 1.472 0.645 0 O-C-N 121.928 -0.748 . . . . 0.0 111.776 -179.875 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 22.1 m-70 -67.39 -29.56 69.1 Favored 'General case' 0 CA--C 1.544 0.716 0 O-C-N 120.524 -1.36 . . . . 0.0 112.62 178.285 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 55.9 tp -69.46 -40.32 77.21 Favored 'General case' 0 CA--C 1.54 0.572 0 O-C-N 121.524 -0.735 . . . . 0.0 111.508 169.753 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 85.5 t -60.87 -45.49 98.07 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.269 0 C-N-CA 123.101 0.56 . . . . 0.0 110.794 172.926 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -61.26 -48.1 82.98 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 124.039 0.936 . . . . 0.0 111.138 177.639 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.48 -47.59 84.95 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 118.499 0.59 . . . . 0.0 111.686 -179.612 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 61.6 tp -55.3 -52.67 62.71 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 124.57 1.148 . . . . 0.0 111.571 176.164 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 25.9 t80 -57.55 -42.27 82.64 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 123.733 0.813 . . . . 0.0 112.629 175.863 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 81.8 mt -74.95 -32.25 61.69 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 124.145 0.978 . . . . 0.0 113.195 -177.678 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 26.8 t -66.08 -47.42 85.0 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 C-N-CA 123.882 0.873 . . . . 0.0 110.405 171.563 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 85.7 m -84.1 -27.46 28.19 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 113.059 0.763 . . . . 0.0 113.059 -172.2 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 69.1 -118.33 8.65 Favored Glycine 0 N--CA 1.468 0.786 0 C-N-CA 124.837 1.208 . . . . 0.0 112.221 169.141 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -70.58 -19.53 62.85 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 124.38 1.072 . . . . 0.0 113.702 175.591 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 89.3 mtm180 -72.59 158.77 35.04 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 124.976 1.31 . . . . 0.0 111.524 177.433 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . -78.22 147.62 31.86 Favored Glycine 0 N--CA 1.467 0.745 0 N-CA-C 110.939 -0.864 . . . . 0.0 110.939 175.152 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 52.6 p90 -128.02 160.1 32.96 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 124.141 0.976 . . . . 0.0 113.054 179.572 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 27.6 t80 . . . . . 0 CA--C 1.536 0.404 0 C-N-CA 124.818 1.247 . . . . 0.0 110.67 175.376 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 82.9 t . . . . . 0 N--CA 1.478 0.963 0 CA-C-O 119.195 -0.431 . . . . 0.0 111.422 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -70.63 -42.79 70.42 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-N 119.108 0.867 . . . . 0.0 111.15 176.02 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 71.0 tp60 -58.96 -42.83 90.84 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 123.172 0.589 . . . . 0.0 111.647 -179.62 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 97.9 m -76.1 -31.35 58.66 Favored 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 114.487 1.292 . . . . 0.0 114.487 177.707 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 30.3 t -98.06 -43.5 7.02 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 113.468 0.914 . . . . 0.0 113.468 -167.852 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 64.3 m -88.97 -38.47 14.43 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 125.216 1.406 . . . . 0.0 110.926 179.81 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 9.5 t -107.91 -155.86 0.56 Allowed 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 124.923 1.289 . . . . 0.0 110.758 167.561 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 29.8 pt -107.81 152.39 9.55 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.565 0 C-N-CA 125.715 1.606 . . . . 0.0 111.609 172.912 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 14.0 p -139.57 164.21 30.52 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 123.799 0.84 . . . . 0.0 112.276 171.997 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 32.8 t -107.23 156.65 18.62 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 124.111 0.964 . . . . 0.0 113.068 179.251 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 62.9 mt -60.21 -33.08 71.74 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 124.176 0.991 . . . . 0.0 111.081 170.051 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 79.9 t80 -61.85 -28.6 69.6 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 124.685 1.194 . . . . 0.0 113.287 172.241 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 86.1 mt-30 -82.1 -39.56 23.19 Favored 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 123.642 0.777 . . . . 0.0 110.955 174.033 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 40.5 mt -58.16 -37.52 74.86 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-N 118.905 0.775 . . . . 0.0 112.218 172.662 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -59.01 -30.81 68.27 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 124.271 1.028 . . . . 0.0 113.181 179.216 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 89.0 m-20 -66.46 -18.78 65.55 Favored 'General case' 0 CA--C 1.544 0.725 0 O-C-N 121.127 -0.983 . . . . 0.0 113.511 179.196 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 92.2 m-85 -92.93 -7.41 46.13 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.177 1.391 . . . . 0.0 113.341 177.163 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 13.7 t . . . . . 0 N--CA 1.472 0.639 0 C-N-CA 124.835 1.254 . . . . 0.0 112.162 171.323 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 11.2 p30 . . . . . 0 CA--C 1.54 0.558 0 N-CA-C 112.562 0.578 . . . . 0.0 112.562 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 39.3 mt-30 -151.69 167.81 26.99 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.836 1.654 . . . . 0.0 111.224 -171.857 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 99.5 m-70 -87.02 133.34 33.6 Favored 'General case' 0 CA--C 1.541 0.63 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 153.312 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 85.4 mt -145.55 138.72 26.25 Favored 'General case' 0 N--CA 1.466 0.374 0 C-N-CA 126.039 1.736 . . . . 0.0 108.806 -177.812 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 3.3 t -155.79 153.88 30.51 Favored 'General case' 0 N--CA 1.47 0.53 0 O-C-N 121.373 -0.83 . . . . 0.0 112.357 -175.899 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 50.6 -127.44 26.9 Favored Glycine 0 N--CA 1.472 1.042 0 C-N-CA 125.185 1.374 . . . . 0.0 113.69 175.327 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 16.1 m -58.27 -34.75 70.85 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 124.193 0.997 . . . . 0.0 112.556 178.881 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 80.5 m-70 -76.19 -27.54 56.94 Favored 'General case' 0 CA--C 1.541 0.614 0 O-C-N 121.363 -0.836 . . . . 0.0 113.121 178.477 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 56.3 tp -69.17 -45.41 70.08 Favored 'General case' 0 N--CA 1.469 0.492 0 O-C-N 121.423 -0.798 . . . . 0.0 110.889 168.042 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 77.7 t -62.59 -37.28 78.52 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.08 0 C-N-CA 123.607 0.763 . . . . 0.0 111.467 175.715 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 43.9 tt0 -63.54 -48.55 77.02 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 125.174 1.389 . . . . 0.0 111.462 172.507 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.51 -43.54 98.57 Favored 'General case' 0 CA--C 1.54 0.593 0 O-C-N 121.563 -0.71 . . . . 0.0 112.253 178.243 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 18.4 mt -54.7 -48.69 72.15 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 124.244 1.017 . . . . 0.0 111.008 171.67 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 80.6 t80 -62.85 -37.33 86.41 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 113.201 0.815 . . . . 0.0 113.201 176.193 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 78.5 mt -72.95 -34.65 66.66 Favored 'General case' 0 N--CA 1.47 0.564 0 O-C-N 121.266 -0.896 . . . . 0.0 112.891 178.551 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 44.8 t -73.3 -41.86 57.62 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 C-N-CA 124.236 1.014 . . . . 0.0 111.299 174.935 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 44.5 t -90.05 -30.73 17.53 Favored 'General case' 0 CA--C 1.537 0.479 0 N-CA-C 113.957 1.095 . . . . 0.0 113.957 -171.995 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 71.01 -155.71 52.89 Favored Glycine 0 CA--C 1.532 1.102 0 C-N-CA 124.223 0.916 . . . . 0.0 112.078 -171.093 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -71.34 -3.77 22.44 Favored 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 124.746 1.218 . . . . 0.0 113.98 179.734 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 58.5 mtp180 -57.8 -34.09 69.26 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 124.845 1.258 . . . . 0.0 113.178 175.49 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 88.04 147.0 12.5 Favored Glycine 0 CA--C 1.531 1.061 0 C-N-CA 125.349 1.452 . . . . 0.0 112.83 178.746 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 52.2 p90 -137.87 166.66 23.49 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 125.27 1.428 . . . . 0.0 112.21 -173.234 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 88.7 t80 . . . . . 0 CA--C 1.536 0.429 0 C-N-CA 124.661 1.184 . . . . 0.0 110.279 174.377 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 86.5 t . . . . . 0 N--CA 1.48 1.036 0 CA-C-O 118.846 -0.597 . . . . 0.0 112.334 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -73.8 -36.44 65.01 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 119.344 0.974 . . . . 0.0 111.312 175.595 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 8.0 tt0 -61.42 -36.79 81.32 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 124.317 1.047 . . . . 0.0 111.882 179.699 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 95.6 m -88.65 -27.93 20.96 Favored 'General case' 0 CA--C 1.534 0.353 0 N-CA-C 114.679 1.363 . . . . 0.0 114.679 176.807 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 20.7 t -102.04 -46.05 4.98 Favored 'General case' 0 N--CA 1.475 0.781 0 N-CA-C 113.281 0.845 . . . . 0.0 113.281 -169.456 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 22.8 m -86.24 -44.72 11.93 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 125.39 1.476 . . . . 0.0 109.829 178.636 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 69.0 m -95.26 -169.55 2.0 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 124.567 1.147 . . . . 0.0 110.739 163.251 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 32.4 pt -108.35 144.94 16.03 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.755 0 C-N-CA 124.914 1.286 . . . . 0.0 110.403 169.485 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 19.3 p -126.41 151.82 47.17 Favored 'General case' 0 N--CA 1.47 0.575 0 C-N-CA 123.744 0.818 . . . . 0.0 112.332 176.683 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 90.1 p -91.05 166.93 12.74 Favored 'General case' 0 C--N 1.323 -0.56 0 C-N-CA 124.392 1.077 . . . . 0.0 113.428 174.648 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 46.6 mt -61.65 -34.78 76.3 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 123.339 0.656 . . . . 0.0 111.505 169.74 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 59.5 m-85 -66.4 -33.92 76.8 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.599 1.159 . . . . 0.0 112.698 175.001 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 85.5 mt-30 -75.29 -35.27 61.33 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 124.323 1.049 . . . . 0.0 112.026 173.056 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 93.3 mt -61.52 -42.04 98.21 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-N 119.582 1.083 . . . . 0.0 111.049 168.19 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -60.0 -30.18 68.96 Favored 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 123.936 0.895 . . . . 0.0 112.682 179.463 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 15.9 t-20 -64.54 -22.49 66.98 Favored 'General case' 0 CA--C 1.55 0.962 0 N-CA-C 113.402 0.889 . . . . 0.0 113.402 176.486 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 61.7 m-85 -99.34 2.4 45.32 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.644 1.578 . . . . 0.0 114.126 178.905 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 37.7 m . . . . . 0 N--CA 1.474 0.73 0 O-C-N 121.144 -0.973 . . . . 0.0 111.135 163.124 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 9.3 m120 . . . . . 0 CA--C 1.535 0.402 0 CA-C-O 121.347 0.594 . . . . 0.0 111.557 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 43.5 mt-30 -145.5 159.33 43.27 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 125.212 1.405 . . . . 0.0 110.64 -174.628 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 62.4 m-70 -82.31 127.46 33.24 Favored 'General case' 0 CA--C 1.537 0.456 0 N-CA-C 108.766 -0.827 . . . . 0.0 108.766 156.359 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 93.0 mt -141.87 132.68 25.75 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 126.014 1.726 . . . . 0.0 108.092 -177.726 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 3.0 t -153.84 153.92 32.99 Favored 'General case' 0 N--CA 1.468 0.434 0 O-C-N 121.044 -1.035 . . . . 0.0 112.279 -173.91 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 55.45 -129.54 46.59 Favored Glycine 0 CA--C 1.529 0.96 0 C-N-CA 125.097 1.332 . . . . 0.0 113.331 176.676 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 20.5 p -60.96 -33.99 74.05 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 124.506 1.123 . . . . 0.0 112.734 177.718 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 26.1 m80 -68.7 -36.66 78.76 Favored 'General case' 0 CA--C 1.542 0.652 0 O-C-N 121.229 -0.919 . . . . 0.0 111.708 176.292 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 55.7 tp -67.07 -46.04 75.49 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 123.072 0.549 . . . . 0.0 111.004 171.409 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 55.1 t -58.52 -42.56 84.86 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.992 0 C-N-CA 122.959 0.503 . . . . 0.0 111.126 177.011 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -64.98 -47.81 76.24 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 124.175 0.99 . . . . 0.0 111.415 176.562 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.7 -47.5 83.36 Favored 'General case' 0 CA--C 1.54 0.568 0 O-C-N 121.42 -0.8 . . . . 0.0 111.789 -179.508 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 31.0 tp -60.87 -45.65 93.7 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 124.388 1.075 . . . . 0.0 111.019 177.778 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 83.9 t80 -56.79 -43.66 81.14 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 123.621 0.768 . . . . 0.0 112.926 172.758 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 79.7 mt -72.75 -33.41 66.35 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 123.677 0.791 . . . . 0.0 113.04 -179.619 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 41.2 t -68.14 -43.34 85.13 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.739 0 C-N-CA 123.742 0.817 . . . . 0.0 111.105 172.837 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 83.5 m -82.35 -30.27 30.46 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 113.664 0.987 . . . . 0.0 113.664 -175.407 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 62.77 -131.24 43.36 Favored Glycine 0 CA--C 1.531 1.053 0 C-N-CA 124.487 1.041 . . . . 0.0 112.176 -178.771 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 31.1 mm-40 -64.9 -18.95 65.64 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 124.929 1.292 . . . . 0.0 114.193 -176.246 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -70.52 -43.08 70.34 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 124.128 0.971 . . . . 0.0 112.763 -174.19 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 86.19 -179.44 49.58 Favored Glycine 0 CA--C 1.534 1.28 0 C-N-CA 124.359 0.98 . . . . 0.0 113.017 -168.278 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 43.4 p90 -152.65 166.31 32.5 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 125.35 1.46 . . . . 0.0 113.261 -170.032 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 47.7 t80 . . . . . 0 CA--C 1.54 0.57 0 C-N-CA 124.648 1.179 . . . . 0.0 110.01 169.137 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 45.4 t . . . . . 0 N--CA 1.48 1.032 0 CA-C-O 120.411 0.148 . . . . 0.0 111.144 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 14.2 pm0 -69.55 -30.61 68.46 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 125.398 1.479 . . . . 0.0 112.651 176.828 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 33.5 tt0 -73.5 -45.4 54.15 Favored 'General case' 0 N--CA 1.465 0.315 0 C-N-CA 124.093 0.957 . . . . 0.0 110.422 177.25 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 67.0 m -60.01 -24.07 64.18 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 124.545 1.138 . . . . 0.0 113.326 170.835 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 9.5 t -84.78 -51.36 6.84 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 124.129 0.972 . . . . 0.0 111.095 -179.644 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 47.2 p -79.68 -23.47 42.43 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 125.531 1.532 . . . . 0.0 113.721 -175.913 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.5 t -140.37 -173.7 3.75 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 125.857 1.663 . . . . 0.0 110.818 175.008 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 39.1 pt -81.86 144.37 10.49 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.398 0 O-C-N 120.905 -1.122 . . . . 0.0 111.539 175.634 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 12.6 p -137.29 165.69 25.57 Favored 'General case' 0 N--CA 1.466 0.329 0 C-N-CA 124.677 1.191 . . . . 0.0 110.979 166.958 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 96.0 p -108.54 166.55 10.7 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 124.374 1.07 . . . . 0.0 113.73 -174.92 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 56.1 mt -64.38 -35.26 80.32 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 123.376 0.67 . . . . 0.0 112.092 175.013 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 29.1 p90 -68.95 -32.23 71.67 Favored 'General case' 0 N--CA 1.468 0.452 0 O-C-N 121.103 -0.998 . . . . 0.0 113.19 174.034 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 39.0 mt-30 -70.92 -33.69 70.77 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-O 118.819 -0.61 . . . . 0.0 112.187 171.819 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 76.0 mt -65.29 -40.39 93.79 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-N 119.417 1.008 . . . . 0.0 111.608 167.086 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 23.1 tt0 -62.54 -24.02 67.29 Favored 'General case' 0 CA--C 1.54 0.579 0 N-CA-C 113.213 0.82 . . . . 0.0 113.213 -178.125 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 19.9 t-20 -57.58 -26.39 61.41 Favored 'General case' 0 CA--C 1.552 1.034 0 O-C-N 120.967 -1.083 . . . . 0.0 113.367 171.883 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 2.4 m-30 -89.73 -10.35 46.0 Favored 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 125.008 1.323 . . . . 0.0 113.839 174.705 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 64.0 m . . . . . 0 N--CA 1.479 1.003 0 CA-C-N 120.315 1.416 . . . . 0.0 111.823 171.77 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.54 0.585 0 N-CA-C 113.414 0.894 . . . . 0.0 113.414 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 44.7 mt-30 -149.06 163.93 36.11 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 125.683 1.593 . . . . 0.0 110.904 -170.822 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 36.0 m-70 -81.96 132.49 35.26 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 108.915 -0.772 . . . . 0.0 108.915 156.345 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 86.7 mt -146.11 135.2 22.68 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 126.541 1.936 . . . . 0.0 108.851 -177.06 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 4.4 t -151.91 153.57 34.39 Favored 'General case' 0 N--CA 1.467 0.424 0 O-C-N 121.445 -0.785 . . . . 0.0 112.395 -173.386 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 51.53 -132.05 35.02 Favored Glycine 0 CA--C 1.531 1.075 0 C-N-CA 125.38 1.466 . . . . 0.0 113.831 174.817 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 19.8 m -58.56 -36.7 74.32 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 124.341 1.056 . . . . 0.0 112.108 -179.899 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 19.5 m-70 -71.54 -30.8 66.32 Favored 'General case' 0 CA--C 1.541 0.603 0 O-C-N 121.148 -0.97 . . . . 0.0 112.478 179.007 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 7.8 tt -67.01 -44.54 80.08 Favored 'General case' 0 C--N 1.343 0.288 0 O-C-N 121.37 -0.831 . . . . 0.0 111.227 166.381 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 72.4 t -60.1 -38.3 76.42 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.072 0 CA-C-N 118.907 0.776 . . . . 0.0 111.525 177.467 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -63.74 -50.49 68.9 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.496 1.118 . . . . 0.0 111.669 171.604 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.45 -44.23 97.47 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 118.578 0.626 . . . . 0.0 112.21 179.946 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 48.0 tp -57.99 -53.05 62.66 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 125.738 1.615 . . . . 0.0 110.698 175.375 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 51.9 t80 -54.34 -42.21 69.97 Favored 'General case' 0 CA--C 1.543 0.676 0 N-CA-C 112.952 0.723 . . . . 0.0 112.952 174.053 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 77.3 mt -69.94 -35.44 74.52 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 123.983 0.913 . . . . 0.0 112.857 178.682 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 39.6 t -64.21 -44.39 97.45 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.853 0 C-N-CA 124.483 1.113 . . . . 0.0 111.039 170.603 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 56.5 m -73.17 -29.04 62.56 Favored 'General case' 0 CA--C 1.54 0.591 0 N-CA-C 112.961 0.726 . . . . 0.0 112.961 -179.002 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 70.57 -120.1 8.84 Favored Glycine 0 CA--C 1.529 0.918 0 C-N-CA 125.03 1.3 . . . . 0.0 110.748 177.492 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 37.4 mp0 -67.3 -22.4 65.63 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 124.581 1.152 . . . . 0.0 112.659 173.566 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 56.2 mtm-85 -79.18 153.97 29.63 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 124.479 1.111 . . . . 0.0 111.451 -179.724 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . -86.76 -178.35 49.21 Favored Glycine 0 CA--C 1.529 0.943 0 C-N-CA 125.128 1.347 . . . . 0.0 112.618 172.327 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 42.0 p90 -146.06 151.94 38.53 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 124.659 1.183 . . . . 0.0 114.15 -176.74 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 64.1 t80 . . . . . 0 CA--C 1.541 0.601 0 C-N-CA 126.458 1.903 . . . . 0.0 109.76 161.151 . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 78.0 t . . . . . 0 N--CA 1.485 1.321 0 N-CA-C 113.525 0.935 . . . . 0.0 113.525 . . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 68.5 mm-40 -100.79 -44.12 5.89 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 119.074 0.852 . . . . 0.0 109.923 164.378 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 54.7 tt0 -59.21 -45.26 91.56 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 123.967 0.907 . . . . 0.0 113.159 -172.354 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 2.6 t -84.71 -16.74 40.71 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-N 119.756 1.162 . . . . 0.0 113.381 -177.07 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 79.5 m -76.53 -41.67 45.93 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 123.966 0.906 . . . . 0.0 111.809 170.992 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 72.3 p -93.94 -36.31 12.24 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 125.147 1.379 . . . . 0.0 112.928 -175.001 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.9 t -121.08 -160.2 0.84 Allowed 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 126.268 1.827 . . . . 0.0 110.255 174.342 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 69.5 mt -103.3 144.39 14.0 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.746 0 C-N-CA 125.555 1.542 . . . . 0.0 110.163 -178.129 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 15.1 p -130.92 157.7 42.23 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 123.845 0.858 . . . . 0.0 112.749 164.472 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 59.6 p -95.33 162.91 13.48 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 124.784 1.234 . . . . 0.0 113.234 177.358 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 51.6 mt -61.47 -33.39 73.68 Favored 'General case' 0 N--CA 1.468 0.462 0 O-C-N 121.502 -0.749 . . . . 0.0 111.781 172.027 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 58.2 m-85 -65.15 -33.9 77.12 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 123.853 0.861 . . . . 0.0 112.654 173.824 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 90.0 mt-30 -75.76 -34.41 60.25 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 124.061 0.944 . . . . 0.0 111.567 174.166 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 83.3 mt -62.45 -41.11 98.5 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 119.767 1.167 . . . . 0.0 111.49 167.967 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 31.8 tt0 -62.92 -27.32 69.29 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 123.669 0.788 . . . . 0.0 112.89 -179.482 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 15.5 t-20 -59.79 -21.89 61.44 Favored 'General case' 0 CA--C 1.549 0.919 0 N-CA-C 113.485 0.92 . . . . 0.0 113.485 175.237 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 86.5 m-85 -97.39 -0.58 46.05 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 125.419 1.488 . . . . 0.0 114.266 178.255 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 55.5 m . . . . . 0 CA--C 1.543 0.676 0 O-C-N 121.071 -1.018 . . . . 0.0 111.356 167.424 . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 1.5 p-10 . . . . . 0 CA--C 1.541 0.621 0 N-CA-C 112.974 0.731 . . . . 0.0 112.974 . . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 28.6 mm-40 -152.57 167.94 27.21 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 125.302 1.441 . . . . 0.0 112.041 -169.041 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 98.2 m-70 -83.21 138.23 33.7 Favored 'General case' 0 CA--C 1.543 0.682 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 155.903 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 79.2 mt -151.86 133.95 15.07 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 124.907 1.283 . . . . 0.0 109.08 -175.156 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 2.0 t -151.59 152.05 32.37 Favored 'General case' 0 N--CA 1.465 0.318 0 N-CA-C 112.8 0.667 . . . . 0.0 112.8 -177.815 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 60.99 -130.68 47.95 Favored Glycine 0 CA--C 1.529 0.969 0 C-N-CA 124.886 1.231 . . . . 0.0 113.472 175.543 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 19.8 p -61.3 -33.69 73.99 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 124.016 0.927 . . . . 0.0 112.161 179.481 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 11.6 m80 -64.36 -40.95 96.86 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 124.461 1.104 . . . . 0.0 111.557 176.472 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 60.2 tp -68.33 -43.67 77.02 Favored 'General case' 0 N--CA 1.468 0.433 0 C-N-CA 124.119 0.968 . . . . 0.0 111.461 176.001 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 79.5 t -64.35 -37.77 80.81 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.958 0 C-N-CA 123.422 0.689 . . . . 0.0 111.858 176.172 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -67.19 -45.44 76.88 Favored 'General case' 0 N--CA 1.466 0.375 0 C-N-CA 124.196 0.999 . . . . 0.0 111.581 173.722 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.43 -45.29 91.98 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 123.173 0.589 . . . . 0.0 111.735 176.976 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 27.4 mt -53.63 -54.79 32.67 Favored 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 124.29 1.036 . . . . 0.0 111.526 171.371 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 90.0 t80 -54.86 -42.48 72.06 Favored 'General case' 0 CA--C 1.543 0.688 0 N-CA-C 112.763 0.653 . . . . 0.0 112.763 177.774 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 92.4 mt -74.65 -35.36 62.85 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 124.158 0.983 . . . . 0.0 113.274 -178.893 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 33.9 t -68.07 -43.89 84.98 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 C-N-CA 124.034 0.934 . . . . 0.0 110.664 173.661 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 84.6 m -77.43 -32.11 54.41 Favored 'General case' 0 CA--C 1.54 0.591 0 N-CA-C 112.782 0.66 . . . . 0.0 112.782 -176.409 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 69.14 -119.76 9.85 Favored Glycine 0 N--CA 1.467 0.746 0 C-N-CA 124.354 0.978 . . . . 0.0 111.438 174.927 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -64.25 -24.49 67.68 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 124.839 1.255 . . . . 0.0 112.658 174.203 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 83.9 mtm180 -75.56 146.22 40.62 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 124.625 1.17 . . . . 0.0 110.95 175.896 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . -75.72 178.62 47.98 Favored Glycine 0 N--CA 1.475 1.248 0 C-N-CA 123.4 0.524 . . . . 0.0 111.968 166.514 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 55.0 p90 -148.27 161.23 41.93 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 124.074 0.949 . . . . 0.0 113.231 174.343 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 83.3 t80 . . . . . 0 CA--C 1.536 0.419 0 C-N-CA 124.896 1.278 . . . . 0.0 110.145 171.613 . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 60.5 t . . . . . 0 N--CA 1.484 1.273 0 N-CA-C 112.553 0.575 . . . . 0.0 112.553 . . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -76.44 -44.0 37.68 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 122.858 0.463 . . . . 0.0 110.83 173.602 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -59.22 -49.17 78.87 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 124.827 1.251 . . . . 0.0 111.822 -173.063 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 8.1 t -74.91 -17.99 60.48 Favored 'General case' 0 N--CA 1.472 0.626 0 N-CA-C 113.542 0.941 . . . . 0.0 113.542 -176.696 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 42.3 t -90.06 -41.41 11.7 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 124.977 1.311 . . . . 0.0 112.46 177.286 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 50.1 m -82.35 -44.68 15.87 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 126.718 2.007 . . . . 0.0 110.572 -177.784 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 73.0 m -108.77 -132.4 0.32 Allowed 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 125.948 1.699 . . . . 0.0 108.512 165.851 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 29.8 pt -136.73 161.9 35.64 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.776 0 C-N-CA 125.843 1.657 . . . . 0.0 112.184 -174.363 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 13.8 p -150.81 162.96 39.74 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 123.664 0.786 . . . . 0.0 112.38 167.046 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 10.8 t -106.88 164.11 12.39 Favored 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 125.3 1.44 . . . . 0.0 112.752 -177.919 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 28.5 mt -60.36 -35.62 76.11 Favored 'General case' 0 N--CA 1.468 0.425 0 C-N-CA 124.724 1.209 . . . . 0.0 111.945 -178.526 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 80.3 t80 -62.93 -29.98 71.21 Favored 'General case' 0 CA--C 1.543 0.685 0 N-CA-C 113.665 0.987 . . . . 0.0 113.665 172.349 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 75.8 mt-30 -82.2 -30.95 30.59 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 123.724 0.809 . . . . 0.0 111.376 176.649 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 88.4 mt -60.81 -48.91 79.64 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-N 118.503 0.592 . . . . 0.0 110.667 164.862 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 28.7 tt0 -63.0 -24.48 67.94 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 123.873 0.869 . . . . 0.0 112.938 -176.524 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 26.4 t30 -57.68 -27.26 62.74 Favored 'General case' 0 CA--C 1.549 0.932 0 O-C-N 121.118 -0.989 . . . . 0.0 113.422 174.893 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 64.7 m-85 -89.25 -3.8 58.41 Favored 'General case' 0 CA--C 1.548 0.887 0 C-N-CA 125.215 1.406 . . . . 0.0 113.714 176.965 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 79.8 m . . . . . 0 N--CA 1.47 0.562 0 C-N-CA 124.857 1.263 . . . . 0.0 113.203 176.141 . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 11.9 p30 . . . . . 0 CA--C 1.54 0.567 0 N-CA-C 113.209 0.818 . . . . 0.0 113.209 . . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 39.6 mt-30 -147.36 160.79 42.14 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 125.247 1.419 . . . . 0.0 110.657 -178.162 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 98.1 m-70 -81.36 127.11 32.4 Favored 'General case' 0 CA--C 1.54 0.576 0 N-CA-C 108.432 -0.951 . . . . 0.0 108.432 155.926 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 90.7 mt -143.28 130.0 20.33 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 124.679 1.192 . . . . 0.0 109.907 -177.204 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 83.8 m -128.72 141.23 51.39 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 124.805 1.242 . . . . 0.0 111.787 -174.926 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 49.0 -120.16 6.76 Favored Glycine 0 N--CA 1.473 1.153 0 C-N-CA 125.652 1.596 . . . . 0.0 114.525 164.556 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 25.3 m -58.2 -38.54 76.94 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 123.979 0.912 . . . . 0.0 112.481 -179.623 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 80.2 m-70 -75.37 -28.18 59.43 Favored 'General case' 0 CA--C 1.541 0.628 0 O-C-N 121.203 -0.936 . . . . 0.0 112.804 177.765 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 51.4 tp -67.23 -46.96 72.21 Favored 'General case' 0 N--CA 1.469 0.507 0 O-C-N 121.345 -0.847 . . . . 0.0 110.824 169.952 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 75.6 t -66.87 -33.88 66.3 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.019 0 C-N-CA 123.752 0.821 . . . . 0.0 111.651 176.591 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 43.2 tt0 -63.69 -49.82 71.65 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 124.987 1.315 . . . . 0.0 111.254 171.781 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -58.94 -45.61 90.01 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 123.159 0.584 . . . . 0.0 112.003 176.845 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 59.9 tp -55.37 -51.44 66.81 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 125.522 1.529 . . . . 0.0 111.745 174.633 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 80.9 t80 -58.61 -40.12 82.37 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 123.823 0.849 . . . . 0.0 112.849 175.062 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 85.8 mt -76.83 -34.35 57.89 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 124.075 0.95 . . . . 0.0 113.246 -177.913 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 27.3 t -63.22 -47.05 94.11 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.843 0 C-N-CA 124.267 1.027 . . . . 0.0 110.25 172.297 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 84.5 m -87.78 -23.78 23.98 Favored 'General case' 0 N--CA 1.471 0.579 0 N-CA-C 113.821 1.045 . . . . 0.0 113.821 -172.82 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 66.48 -115.06 7.0 Favored Glycine 0 CA--C 1.529 0.909 0 C-N-CA 124.625 1.107 . . . . 0.0 111.846 172.464 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -72.56 -19.88 61.42 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 123.844 0.858 . . . . 0.0 112.854 175.257 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 71.6 mtp180 -75.8 133.04 40.76 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 123.969 0.908 . . . . 0.0 109.72 172.932 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . -89.67 167.74 33.93 Favored Glycine 0 N--CA 1.469 0.842 0 C-N-CA 125.268 1.413 . . . . 0.0 113.094 -178.668 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 45.4 p90 -135.36 163.83 29.13 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 124.986 1.314 . . . . 0.0 113.595 -179.502 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 85.1 t80 . . . . . 0 CA--C 1.537 0.478 0 C-N-CA 126.161 1.784 . . . . 0.0 108.484 162.478 . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 16.6 t . . . . . 0 N--CA 1.485 1.296 0 CA-C-O 121.597 0.713 . . . . 0.0 110.254 . . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 4.9 pm0 -71.41 -0.09 9.47 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 127.322 2.249 . . . . 0.0 113.905 174.007 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 33.4 tt0 -104.72 -60.06 1.65 Allowed 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 123.861 0.865 . . . . 0.0 109.638 161.982 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 92.7 m -58.16 -30.9 66.75 Favored 'General case' 0 N--CA 1.467 0.411 0 N-CA-C 115.308 1.595 . . . . 0.0 115.308 -171.175 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 16.6 t -84.71 -38.94 19.11 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 123.194 0.598 . . . . 0.0 112.604 -172.553 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 22.0 p -99.97 -31.8 11.29 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 125.609 1.563 . . . . 0.0 113.618 -177.727 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.8 t -117.78 -166.2 1.18 Allowed 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 126.112 1.765 . . . . 0.0 110.206 172.603 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 14.9 tt -96.56 149.84 4.65 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.66 0 C-N-CA 124.631 1.172 . . . . 0.0 110.782 176.654 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 15.6 p -141.93 157.11 45.35 Favored 'General case' 0 N--CA 1.471 0.594 0 O-C-N 121.267 -0.896 . . . . 0.0 113.135 174.266 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 35.6 m -103.12 152.57 21.26 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 124.022 0.929 . . . . 0.0 112.335 -171.805 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 42.6 mt -60.27 -32.7 71.42 Favored 'General case' 0 N--CA 1.473 0.719 0 O-C-N 121.101 -0.999 . . . . 0.0 111.7 176.019 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 56.4 m-85 -61.77 -31.94 72.17 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 124.392 1.077 . . . . 0.0 113.534 172.422 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 97.1 mt-30 -79.96 -35.55 37.44 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 124.705 1.202 . . . . 0.0 110.833 175.415 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 63.1 mt -61.74 -39.01 90.08 Favored 'General case' 0 N--CA 1.473 0.684 0 CA-C-N 118.499 0.59 . . . . 0.0 111.946 168.662 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 28.8 tt0 -63.56 -30.53 71.63 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 123.419 0.688 . . . . 0.0 112.769 179.295 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 45.4 t30 -62.3 -20.77 64.66 Favored 'General case' 0 CA--C 1.55 0.977 0 O-C-N 120.924 -1.11 . . . . 0.0 113.007 173.417 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 1.4 m-85 -97.16 5.13 50.71 Favored 'General case' 0 CA--C 1.549 0.909 0 C-N-CA 125.989 1.715 . . . . 0.0 114.089 175.81 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 79.5 m . . . . . 0 N--CA 1.473 0.692 0 CA-C-N 119.355 0.98 . . . . 0.0 112.682 169.034 . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 25.0 p-10 . . . . . 0 CA--C 1.542 0.66 0 N-CA-C 113.125 0.787 . . . . 0.0 113.125 . . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 45.5 mm-40 -153.4 164.51 38.03 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 125.486 1.514 . . . . 0.0 111.979 -169.516 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 98.4 m-70 -83.74 133.08 34.8 Favored 'General case' 0 CA--C 1.542 0.637 0 O-C-N 121.653 -0.655 . . . . 0.0 109.259 158.359 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 84.0 mt -150.49 135.17 17.4 Favored 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 124.83 1.252 . . . . 0.0 109.97 -170.722 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 3.6 t -154.45 155.54 35.12 Favored 'General case' 0 N--CA 1.468 0.439 0 O-C-N 121.488 -0.757 . . . . 0.0 111.869 -179.925 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 52.84 -129.3 38.37 Favored Glycine 0 N--CA 1.47 0.944 0 C-N-CA 124.923 1.249 . . . . 0.0 113.536 176.393 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 28.3 p -56.78 -36.48 69.9 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 125.028 1.331 . . . . 0.0 113.065 178.662 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 75.3 m-70 -73.76 -29.62 62.32 Favored 'General case' 0 CA--C 1.541 0.631 0 O-C-N 120.883 -1.136 . . . . 0.0 113.07 177.181 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 35.9 tp -71.59 -42.1 68.16 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 119.172 0.896 . . . . 0.0 110.774 170.291 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 49.7 t -59.07 -41.48 83.59 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.074 0 C-N-CA 124.032 0.933 . . . . 0.0 111.526 172.24 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 43.3 tt0 -63.78 -47.29 81.52 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 125.631 1.572 . . . . 0.0 111.779 174.655 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.8 -43.86 97.69 Favored 'General case' 0 CA--C 1.537 0.447 0 O-C-N 121.749 -0.594 . . . . 0.0 111.61 179.168 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 40.1 mt -56.69 -52.45 64.89 Favored 'General case' 0 N--CA 1.465 0.318 0 C-N-CA 123.675 0.79 . . . . 0.0 111.307 172.181 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 77.2 t80 -53.16 -41.39 65.11 Favored 'General case' 0 CA--C 1.542 0.658 0 N-CA-C 112.803 0.668 . . . . 0.0 112.803 176.044 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 88.6 mt -75.24 -36.44 61.29 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 124.401 1.08 . . . . 0.0 113.525 179.962 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 36.9 t -71.25 -41.38 74.8 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.038 0 C-N-CA 124.249 1.02 . . . . 0.0 110.617 176.186 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 86.3 m -81.47 -38.77 25.85 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 123.825 0.85 . . . . 0.0 112.246 -175.175 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 62.26 -100.52 0.31 Allowed Glycine 0 N--CA 1.472 1.048 0 C-N-CA 124.483 1.039 . . . . 0.0 112.813 172.051 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -69.93 -31.29 68.98 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 124.824 1.249 . . . . 0.0 112.458 174.302 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 1.3 mpp_? -75.52 153.88 37.21 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.072 0.949 . . . . 0.0 110.426 170.243 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . -81.44 -164.9 33.74 Favored Glycine 0 CA--C 1.531 1.064 0 C-N-CA 124.027 0.822 . . . . 0.0 111.26 165.12 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 51.3 p90 -154.63 156.92 37.39 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 124.192 0.997 . . . . 0.0 113.503 177.847 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 60.3 t80 . . . . . 0 CA--C 1.541 0.632 0 C-N-CA 125.08 1.352 . . . . 0.0 113.704 -176.103 . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 99.1 t . . . . . 0 N--CA 1.481 1.083 0 CA-C-O 119.401 -0.333 . . . . 0.0 110.809 . . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 5.5 pm0 -67.5 -32.45 73.27 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 124.388 1.075 . . . . 0.0 111.265 171.904 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 8.5 tt0 -66.41 -38.19 86.92 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 124.24 1.016 . . . . 0.0 111.617 179.726 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 3.3 t -88.79 -16.76 31.3 Favored 'General case' 0 CA--C 1.544 0.719 0 N-CA-C 114.247 1.203 . . . . 0.0 114.247 176.01 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 52.5 t -97.92 -53.53 3.37 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 124.864 1.266 . . . . 0.0 113.633 -175.819 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 38.5 m -77.97 -47.36 18.72 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 125.396 1.478 . . . . 0.0 109.701 -179.245 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 74.7 m -90.47 -152.85 0.28 Allowed 'General case' 0 CA--C 1.551 1.01 0 C-N-CA 123.737 0.815 . . . . 0.0 109.888 158.224 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 28.8 pt -132.13 154.57 40.37 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.99 0 O-C-N 120.485 -1.384 . . . . 0.0 111.902 -176.821 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 1.1 p -149.94 164.89 34.24 Favored 'General case' 0 N--CA 1.468 0.468 0 N-CA-C 112.98 0.733 . . . . 0.0 112.98 168.89 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 2.8 t -111.9 166.41 11.24 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 124.674 1.19 . . . . 0.0 113.521 -177.414 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 71.1 mt -59.15 -34.42 72.05 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 124.359 1.064 . . . . 0.0 111.967 178.107 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 78.1 m-85 -63.97 -28.77 70.04 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 124.276 1.03 . . . . 0.0 113.476 173.671 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 55.8 mt-30 -81.17 -37.76 28.22 Favored 'General case' 0 N--CA 1.467 0.405 0 C-N-CA 123.778 0.831 . . . . 0.0 110.916 173.65 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 45.0 mt -56.02 -44.89 79.16 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 119.132 0.878 . . . . 0.0 111.086 170.524 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -60.84 -30.91 70.4 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 124.117 0.967 . . . . 0.0 112.959 177.448 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 27.2 t30 -80.64 -31.44 36.47 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 124.341 1.056 . . . . 0.0 112.832 174.608 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 19.6 m-30 -68.15 -37.17 80.76 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 123.975 0.91 . . . . 0.0 112.212 173.466 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 72.1 m . . . . . 0 N--CA 1.473 0.717 0 N-CA-C 113.602 0.964 . . . . 0.0 113.602 178.482 . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 11.0 m120 . . . . . 0 CA--C 1.542 0.645 0 CA-C-O 121.652 0.739 . . . . 0.0 112.951 . . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 27.7 mm-40 -145.15 164.81 30.14 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 125.373 1.469 . . . . 0.0 110.511 178.499 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 90.4 m-70 -83.59 117.21 23.0 Favored 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 107.785 -1.191 . . . . 0.0 107.785 160.832 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 94.3 mt -129.22 131.74 47.12 Favored 'General case' 0 N--CA 1.462 0.164 0 C-N-CA 124.859 1.263 . . . . 0.0 108.532 178.704 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -142.97 153.76 43.34 Favored 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 124.267 1.027 . . . . 0.0 111.517 -173.867 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 48.23 -126.69 15.55 Favored Glycine 0 N--CA 1.471 0.98 0 C-N-CA 125.578 1.561 . . . . 0.0 114.338 170.047 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 16.0 p -59.88 -38.91 83.58 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 124.579 1.152 . . . . 0.0 112.618 179.46 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 26.7 m170 -65.23 -37.87 88.63 Favored 'General case' 0 CA--C 1.544 0.718 0 O-C-N 121.076 -1.015 . . . . 0.0 111.803 177.74 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 56.6 tp -67.9 -44.23 77.44 Favored 'General case' 0 N--CA 1.466 0.37 0 C-N-CA 123.405 0.682 . . . . 0.0 111.117 172.234 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 53.5 t -59.02 -38.8 76.09 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.973 0 CA-C-N 118.836 0.744 . . . . 0.0 111.978 174.92 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -66.3 -45.71 79.44 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 123.87 0.868 . . . . 0.0 111.579 173.815 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.07 -46.37 90.92 Favored 'General case' 0 CA--C 1.543 0.681 0 CA-C-N 119.296 0.953 . . . . 0.0 111.901 176.794 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 32.5 mt -54.76 -50.28 68.82 Favored 'General case' 0 N--CA 1.466 0.333 0 C-N-CA 124.574 1.149 . . . . 0.0 111.436 173.174 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 88.4 t80 -62.36 -36.55 82.59 Favored 'General case' 0 CA--C 1.543 0.706 0 O-C-N 121.2 -0.938 . . . . 0.0 113.331 177.04 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 76.3 mt -73.01 -33.12 65.56 Favored 'General case' 0 N--CA 1.469 0.495 0 O-C-N 121.155 -0.966 . . . . 0.0 113.296 177.677 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 84.5 t -81.21 -37.1 15.49 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.93 0 C-N-CA 123.945 0.898 . . . . 0.0 111.469 176.869 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 44.0 m -124.8 6.03 8.09 Favored 'General case' 0 N--CA 1.473 0.691 0 N-CA-C 115.587 1.699 . . . . 0.0 115.587 -163.05 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . -57.53 -27.16 58.14 Favored Glycine 0 N--CA 1.479 1.533 0 N-CA-C 116.302 1.281 . . . . 0.0 116.302 -166.523 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -81.39 -21.55 38.91 Favored 'General case' 0 CA--C 1.548 0.871 0 N-CA-C 114.13 1.159 . . . . 0.0 114.13 174.709 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 75.9 mtp180 -91.52 -42.36 10.29 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 126.199 1.8 . . . . 0.0 112.23 177.961 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 97.31 136.98 9.35 Favored Glycine 0 CA--C 1.531 1.049 0 C-N-CA 125.651 1.596 . . . . 0.0 110.558 -163.155 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 46.8 p90 -105.1 165.12 11.31 Favored 'General case' 0 CA--C 1.538 0.519 0 N-CA-C 114.198 1.184 . . . . 0.0 114.198 -172.625 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 69.9 t80 . . . . . 0 CA--C 1.536 0.414 0 C-N-CA 126.391 1.876 . . . . 0.0 109.92 175.609 . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 45.3 t . . . . . 0 N--CA 1.481 1.084 0 CA-C-O 119.603 -0.237 . . . . 0.0 111.53 . . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 24.6 tt0 -78.8 -44.04 24.03 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-O 118.935 -0.555 . . . . 0.0 111.308 174.599 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -58.58 -49.79 76.18 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-N 118.572 0.624 . . . . 0.0 111.455 -177.558 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 16.5 m -60.89 -22.5 64.38 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 124.183 0.993 . . . . 0.0 113.392 176.935 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 49.7 t -96.93 -50.41 4.65 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 124.586 1.155 . . . . 0.0 112.824 -173.677 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 3.1 t -78.39 -35.46 47.16 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.398 1.079 . . . . 0.0 112.054 -179.221 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 30.9 m -107.74 -161.6 0.79 Allowed 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.235 1.414 . . . . 0.0 109.183 165.146 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 26.8 pt -109.49 157.55 9.83 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.734 0 C-N-CA 124.515 1.126 . . . . 0.0 110.878 174.787 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 18.1 p -140.62 160.39 40.13 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-O 121.615 0.721 . . . . 0.0 112.387 171.835 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 4.1 m -96.08 149.36 21.69 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 124.874 1.269 . . . . 0.0 111.896 -169.414 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 55.5 mt -57.27 -33.26 67.44 Favored 'General case' 0 N--CA 1.474 0.73 0 O-C-N 121.09 -1.006 . . . . 0.0 111.833 167.893 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 80.6 t80 -63.71 -30.81 71.86 Favored 'General case' 0 CA--C 1.543 0.682 0 N-CA-C 113.46 0.911 . . . . 0.0 113.46 172.491 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 45.9 mm-40 -80.99 -34.46 32.98 Favored 'General case' 0 CA--C 1.534 0.358 0 O-C-N 121.46 -0.775 . . . . 0.0 111.05 174.099 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 38.4 mt -58.18 -37.2 74.26 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 119.602 1.092 . . . . 0.0 111.296 167.095 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.401 ' HA ' ' SG ' ' A' ' 20' ' ' CYS . 24.7 tt0 -68.97 -35.3 76.58 Favored 'General case' 0 CA--C 1.545 0.768 0 N-CA-C 112.619 0.6 . . . . 0.0 112.619 173.74 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 62.3 t30 -64.74 -22.92 67.09 Favored 'General case' 0 CA--C 1.553 1.072 0 O-C-N 121.009 -1.057 . . . . 0.0 112.257 171.988 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 16.0 m-30 -91.65 -0.16 57.55 Favored 'General case' 0 CA--C 1.551 1.008 0 C-N-CA 125.802 1.641 . . . . 0.0 113.562 177.378 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . 0.401 ' SG ' ' HA ' ' A' ' 17' ' ' GLU . 81.6 m . . . . . 0 N--CA 1.474 0.752 0 O-C-N 121.063 -1.023 . . . . 0.0 113.639 172.572 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 61.6 m-20 . . . . . 0 N--CA 1.47 0.574 0 CA-C-O 120.63 0.252 . . . . 0.0 111.601 . . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 38.3 mt-30 -143.26 158.7 43.4 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 124.445 1.098 . . . . 0.0 111.229 -179.257 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 95.8 m-70 -80.28 127.33 32.24 Favored 'General case' 0 CA--C 1.539 0.522 0 N-CA-C 108.639 -0.874 . . . . 0.0 108.639 156.623 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 98.5 mt -140.23 123.0 16.41 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 125.59 1.556 . . . . 0.0 109.242 -175.142 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 57.7 m -130.73 138.81 50.16 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 124.891 1.277 . . . . 0.0 110.727 -174.176 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 54.43 -123.67 28.78 Favored Glycine 0 N--CA 1.473 1.101 0 C-N-CA 124.86 1.219 . . . . 0.0 114.029 166.522 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 17.8 p -59.9 -35.47 74.93 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 124.35 1.06 . . . . 0.0 112.387 179.973 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 24.2 m80 -67.69 -38.27 83.44 Favored 'General case' 0 CA--C 1.541 0.607 0 O-C-N 121.25 -0.906 . . . . 0.0 111.714 177.817 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 60.1 tp -67.5 -44.92 77.32 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 123.639 0.776 . . . . 0.0 111.213 172.206 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 53.1 t -60.45 -38.54 78.25 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.131 0 C-N-CA 123.614 0.766 . . . . 0.0 111.761 177.023 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 33.2 mm-40 -68.62 -43.89 75.41 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 123.855 0.862 . . . . 0.0 111.91 173.258 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.36 -43.62 98.56 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-N 119.278 0.944 . . . . 0.0 112.253 176.746 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 44.5 mt -55.48 -54.57 42.26 Favored 'General case' 0 N--CA 1.467 0.412 0 C-N-CA 124.803 1.241 . . . . 0.0 110.84 171.771 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 81.9 t80 -55.19 -40.75 71.11 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 123.48 0.712 . . . . 0.0 112.884 177.471 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 83.0 mt -75.74 -34.38 60.3 Favored 'General case' 0 CA--C 1.534 0.358 0 N-CA-C 113.645 0.979 . . . . 0.0 113.645 -179.121 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 42.9 t -72.73 -42.35 61.98 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.922 0 CA-C-N 118.666 0.666 . . . . 0.0 110.642 174.29 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 75.5 m -83.43 -35.6 24.88 Favored 'General case' 0 N--CA 1.466 0.37 0 N-CA-C 113.539 0.941 . . . . 0.0 113.539 -173.21 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 62.54 -131.43 44.09 Favored Glycine 0 CA--C 1.532 1.094 0 C-N-CA 123.839 0.733 . . . . 0.0 111.66 -175.973 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -63.28 -18.85 64.02 Favored 'General case' 0 CA--C 1.55 0.96 0 C-N-CA 124.942 1.297 . . . . 0.0 113.512 179.452 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 85.4 mtm180 -66.17 -21.9 66.34 Favored 'General case' 0 N--CA 1.477 0.919 0 N-CA-C 113.924 1.083 . . . . 0.0 113.924 -177.567 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.73 -178.43 39.5 Favored Glycine 0 CA--C 1.534 1.236 0 C-N-CA 124.658 1.123 . . . . 0.0 112.154 -172.934 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 53.4 p90 -159.86 164.57 33.48 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 124.368 1.067 . . . . 0.0 113.421 -177.299 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 93.6 t80 . . . . . 0 CA--C 1.535 0.389 0 C-N-CA 124.776 1.23 . . . . 0.0 110.635 171.744 . . . . . . . . 0 0 . 1 . 026 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 83.5 t . . . . . 0 N--CA 1.481 1.1 0 CA-C-O 119.376 -0.345 . . . . 0.0 111.028 . . . . . . . . . 0 0 . 1 . 026 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 78.5 mm-40 -70.68 -40.8 72.73 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-N 118.465 0.575 . . . . 0.0 111.329 176.597 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 63.9 tp60 -64.77 -38.9 92.56 Favored 'General case' 0 N--CA 1.463 0.222 0 O-C-N 121.83 -0.544 . . . . 0.0 112.052 -179.252 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 88.3 m -83.03 -31.5 27.39 Favored 'General case' 0 CA--C 1.53 0.204 0 N-CA-C 114.268 1.211 . . . . 0.0 114.268 178.607 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 30.5 t -103.46 -48.47 3.97 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 113.153 0.798 . . . . 0.0 113.153 -169.369 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 34.6 m -79.33 -47.12 16.37 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 124.526 1.131 . . . . 0.0 109.536 178.699 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 71.0 m -94.74 -164.32 1.15 Allowed 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 124.625 1.17 . . . . 0.0 111.255 164.112 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 40.4 pt -109.5 149.35 12.66 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 C-N-CA 124.694 1.198 . . . . 0.0 110.885 169.254 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 17.5 p -128.33 158.42 38.27 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 123.567 0.747 . . . . 0.0 112.028 174.149 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 61.5 p -98.67 160.03 14.55 Favored 'General case' 0 N--CA 1.468 0.441 0 N-CA-C 114.003 1.112 . . . . 0.0 114.003 -179.857 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 59.7 mt -60.88 -35.46 76.7 Favored 'General case' 0 CA--C 1.54 0.573 0 O-C-N 121.646 -0.659 . . . . 0.0 111.452 172.107 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 91.6 t80 -62.57 -35.45 79.54 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 124.118 0.967 . . . . 0.0 112.896 172.641 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 84.3 mt-30 -74.16 -35.4 64.03 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 123.866 0.866 . . . . 0.0 111.884 173.349 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 56.8 mt -63.28 -39.02 93.4 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 119.599 1.091 . . . . 0.0 111.923 171.433 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -60.91 -26.73 67.67 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 124.621 1.168 . . . . 0.0 113.319 -178.989 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 26.3 t30 -57.4 -28.69 63.46 Favored 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 124.261 1.024 . . . . 0.0 113.307 175.521 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 98.2 m-85 -95.07 -2.28 50.47 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 125.146 1.378 . . . . 0.0 114.022 -174.174 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 86.3 m . . . . . 0 CA--C 1.541 0.629 0 N-CA-C 113.938 1.088 . . . . 0.0 113.938 178.701 . . . . . . . . 0 0 . 1 . 026 nuclear orig core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 51.4 p30 . . . . . 0 CA--C 1.541 0.634 0 N-CA-C 112.864 0.69 . . . . 0.0 112.864 . . . . . . . . . 0 0 . 1 . 026 nuclear orig core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 40.9 mt-30 -151.29 162.53 40.74 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 124.922 1.289 . . . . 0.0 111.722 -164.754 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 84.0 m-70 -82.67 130.16 35.08 Favored 'General case' 0 CA--C 1.541 0.633 0 N-CA-C 109.522 -0.548 . . . . 0.0 109.522 154.589 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 78.5 mt -144.07 126.88 16.24 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 126.391 1.876 . . . . 0.0 108.996 -178.5 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 62.3 m -134.74 140.68 46.12 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 124.986 1.315 . . . . 0.0 110.455 -174.754 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 51.7 -118.88 7.6 Favored Glycine 0 N--CA 1.473 1.137 0 C-N-CA 124.88 1.229 . . . . 0.0 114.022 169.147 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 19.3 m -59.48 -33.92 71.92 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 124.475 1.11 . . . . 0.0 112.688 -179.804 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 93.2 m-70 -72.67 -38.83 67.48 Favored 'General case' 0 CA--C 1.539 0.55 0 O-C-N 121.409 -0.807 . . . . 0.0 111.163 178.196 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 55.7 tp -63.81 -45.87 87.7 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 124.053 0.941 . . . . 0.0 111.056 171.827 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 21.8 t -59.59 -43.28 90.67 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.952 0 C-N-CA 124.614 1.166 . . . . 0.0 111.751 176.171 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -65.57 -46.42 79.53 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 123.175 0.59 . . . . 0.0 111.65 175.683 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.07 -44.01 98.02 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 123.533 0.733 . . . . 0.0 112.058 179.961 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 21.4 mt -54.94 -55.51 29.82 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 124.301 1.041 . . . . 0.0 111.132 173.0 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 79.9 t80 -58.15 -34.51 70.36 Favored 'General case' 0 N--CA 1.472 0.666 0 N-CA-C 113.512 0.93 . . . . 0.0 113.512 179.417 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 86.1 mt -74.79 -40.94 60.85 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 124.661 1.184 . . . . 0.0 113.559 175.062 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 38.7 t -64.49 -42.77 96.19 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.021 0 C-N-CA 123.956 0.903 . . . . 0.0 111.052 174.24 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 61.6 m -73.58 -25.7 60.48 Favored 'General case' 0 CA--C 1.538 0.518 0 N-CA-C 112.611 0.597 . . . . 0.0 112.611 179.264 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 83.77 49.29 4.89 Favored Glycine 0 N--CA 1.471 1.008 0 C-N-CA 124.648 1.118 . . . . 0.0 112.184 171.944 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 36.4 mt-10 78.06 -7.93 1.74 Allowed 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 127.997 2.519 . . . . 0.0 113.362 -177.418 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 32.2 mtp180 -66.47 162.48 20.54 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 125.238 1.415 . . . . 0.0 111.927 168.278 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . -63.63 159.42 38.59 Favored Glycine 0 CA--C 1.532 1.145 0 C-N-CA 124.154 0.883 . . . . 0.0 112.939 174.668 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 56.1 p90 -153.8 175.44 13.3 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 125.518 1.527 . . . . 0.0 111.675 -172.288 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 61.0 t80 . . . . . 0 CA--C 1.536 0.429 0 C-N-CA 124.416 1.086 . . . . 0.0 110.884 178.081 . . . . . . . . 0 0 . 1 . 027 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 25.0 t . . . . . 0 N--CA 1.492 1.659 0 N-CA-C 112.135 0.42 . . . . 0.0 112.135 . . . . . . . . . 0 0 . 1 . 027 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -68.74 -16.52 63.83 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.536 1.134 . . . . 0.0 113.391 -179.867 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 36.7 tt0 -91.82 -57.11 2.85 Favored 'General case' 0 C--O 1.225 -0.207 0 C-N-CA 123.633 0.773 . . . . 0.0 109.474 162.73 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 64.0 m -63.28 -29.89 71.13 Favored 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 114.779 1.4 . . . . 0.0 114.779 -165.412 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 26.7 t -96.18 -38.87 9.96 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 123.872 0.869 . . . . 0.0 112.458 -175.513 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 27.3 m -83.08 -39.21 21.45 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 125.536 1.534 . . . . 0.0 111.766 -179.425 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 22.6 t -114.29 -135.7 0.36 Allowed 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 126.953 2.101 . . . . 0.0 108.768 168.291 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 16.0 pt -133.2 151.18 33.45 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.727 0 C-N-CA 125.901 1.681 . . . . 0.0 111.964 -178.507 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 66.9 m -125.41 158.32 34.64 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 125.392 1.477 . . . . 0.0 111.096 170.38 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 10.5 t -109.52 158.36 18.07 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 124.248 1.019 . . . . 0.0 112.49 175.566 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 45.0 mt -58.87 -35.26 72.69 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 125.297 1.439 . . . . 0.0 111.735 178.942 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 76.2 t80 -62.46 -29.9 70.86 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 124.33 1.052 . . . . 0.0 113.188 173.34 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 94.9 mt-30 -81.63 -33.68 31.3 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 124.313 1.045 . . . . 0.0 110.529 176.586 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 44.1 mt -65.56 -37.98 88.24 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 123.546 0.738 . . . . 0.0 112.129 171.76 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 29.1 tt0 -60.04 -24.32 64.43 Favored 'General case' 0 CA--C 1.544 0.73 0 N-CA-C 113.62 0.971 . . . . 0.0 113.62 -178.901 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 17.3 t-20 -58.47 -23.35 57.57 Favored 'General case' 0 CA--C 1.549 0.939 0 N-CA-C 113.637 0.977 . . . . 0.0 113.637 174.774 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 96.5 m-85 -97.92 0.98 47.52 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.479 1.511 . . . . 0.0 114.195 -177.601 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 60.3 m . . . . . 0 N--CA 1.473 0.722 0 N-CA-C 113.226 0.824 . . . . 0.0 113.226 173.29 . . . . . . . . 0 0 . 1 . 027 nuclear orig core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 10.6 m120 . . . . . 0 CA--C 1.539 0.541 0 CA-C-O 121.059 0.457 . . . . 0.0 112.063 . . . . . . . . . 0 0 . 1 . 027 nuclear orig core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 38.1 mt-30 -144.87 157.34 44.19 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.16 1.384 . . . . 0.0 110.985 -177.985 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 99.2 m-70 -79.57 127.1 31.74 Favored 'General case' 0 CA--C 1.538 0.508 0 N-CA-C 108.61 -0.885 . . . . 0.0 108.61 160.774 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 98.8 mt -143.21 120.76 11.75 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 125.489 1.516 . . . . 0.0 109.914 -173.165 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 58.1 m -127.54 136.94 52.41 Favored 'General case' 0 N--CA 1.467 0.41 0 C-N-CA 125.066 1.346 . . . . 0.0 110.703 -176.878 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 48.43 -116.57 3.21 Favored Glycine 0 CA--C 1.531 1.046 0 C-N-CA 125.208 1.385 . . . . 0.0 114.275 167.556 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 21.1 m -59.31 -34.6 72.52 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 124.39 1.076 . . . . 0.0 112.651 -178.986 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 94.8 m-70 -72.22 -36.74 69.23 Favored 'General case' 0 CA--C 1.542 0.67 0 O-C-N 121.268 -0.895 . . . . 0.0 111.404 177.891 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 58.8 tp -65.77 -45.51 82.24 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 123.69 0.796 . . . . 0.0 110.99 171.963 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 53.6 t -62.65 -37.15 78.25 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.042 0 C-N-CA 124.381 1.073 . . . . 0.0 111.76 176.916 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -66.19 -47.08 75.1 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 123.627 0.771 . . . . 0.0 111.336 172.593 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.57 -43.53 97.18 Favored 'General case' 0 CA--C 1.539 0.539 0 O-C-N 121.521 -0.737 . . . . 0.0 111.996 177.792 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 18.3 mt -53.16 -56.16 18.57 Favored 'General case' 0 N--CA 1.468 0.448 0 C-N-CA 124.673 1.189 . . . . 0.0 111.175 172.037 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 71.5 t80 -55.82 -41.99 75.03 Favored 'General case' 0 CA--C 1.542 0.646 0 N-CA-C 113.151 0.797 . . . . 0.0 113.151 177.41 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 87.6 mt -72.36 -34.72 68.18 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 124.281 1.032 . . . . 0.0 113.134 -179.461 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 28.6 t -66.79 -43.92 89.54 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.909 0 C-N-CA 123.804 0.842 . . . . 0.0 110.624 172.464 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 82.6 m -72.43 -35.98 68.46 Favored 'General case' 0 CA--C 1.539 0.557 0 N-CA-C 112.206 0.447 . . . . 0.0 112.206 -177.85 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 68.51 -109.51 2.94 Favored Glycine 0 CA--C 1.528 0.885 0 C-N-CA 125.136 1.35 . . . . 0.0 112.112 170.512 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -68.85 -27.75 66.1 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 124.362 1.065 . . . . 0.0 112.199 173.575 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 82.6 mtm180 -74.16 154.59 39.03 Favored 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 124.968 1.307 . . . . 0.0 111.019 175.323 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . -80.62 -173.1 46.39 Favored Glycine 0 CA--C 1.527 0.801 0 C-N-CA 123.985 0.802 . . . . 0.0 111.316 168.721 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 15.3 p90 -162.0 165.43 27.39 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 124.7 1.2 . . . . 0.0 112.213 176.161 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 88.2 t80 . . . . . 0 CA--C 1.535 0.378 0 C-N-CA 123.544 0.738 . . . . 0.0 111.696 167.074 . . . . . . . . 0 0 . 1 . 028 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 76.2 t . . . . . 0 N--CA 1.48 1.031 0 N-CA-C 113.406 0.891 . . . . 0.0 113.406 . . . . . . . . . 0 0 . 1 . 028 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 67.3 mm-40 -69.21 -42.58 75.56 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 118.693 0.679 . . . . 0.0 111.389 177.517 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 17.0 tm0? -61.72 -48.45 80.67 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 123.895 0.878 . . . . 0.0 111.346 -174.49 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 5.0 t -75.66 -12.45 60.2 Favored 'General case' 0 N--CA 1.472 0.646 0 N-CA-C 113.642 0.979 . . . . 0.0 113.642 -179.866 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 25.2 t -87.25 -43.47 12.17 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 124.88 1.272 . . . . 0.0 112.519 177.119 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 74.2 p -86.37 -43.26 13.0 Favored 'General case' 0 N--CA 1.478 0.966 0 C-N-CA 124.408 1.083 . . . . 0.0 112.268 177.952 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 17.5 t -104.52 -149.6 0.41 Allowed 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 125.807 1.643 . . . . 0.0 109.75 169.589 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 27.6 pt -125.94 157.03 36.08 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.728 0 C-N-CA 125.577 1.551 . . . . 0.0 112.286 -178.081 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 17.3 p -143.1 159.66 41.86 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 124.307 1.043 . . . . 0.0 112.157 170.779 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 8.5 t -105.76 162.81 13.22 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 124.885 1.274 . . . . 0.0 112.799 -177.646 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 53.0 mt -58.64 -35.59 72.75 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 124.773 1.229 . . . . 0.0 111.882 179.646 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 69.7 t80 -64.17 -28.58 69.85 Favored 'General case' 0 CA--C 1.547 0.829 0 N-CA-C 113.722 1.008 . . . . 0.0 113.722 173.598 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 75.2 mt-30 -83.32 -33.26 25.96 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 124.269 1.028 . . . . 0.0 110.997 175.495 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 83.2 mt -63.32 -38.14 90.01 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-N 118.576 0.626 . . . . 0.0 111.907 168.858 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 28.8 tt0 -62.23 -23.77 66.85 Favored 'General case' 0 CA--C 1.542 0.651 0 N-CA-C 113.566 0.951 . . . . 0.0 113.566 -179.691 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 29.7 t30 -57.25 -25.92 59.92 Favored 'General case' 0 CA--C 1.549 0.918 0 O-C-N 120.969 -1.082 . . . . 0.0 113.309 173.425 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 97.4 m-85 -96.73 0.84 50.18 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 125.411 1.484 . . . . 0.0 113.735 -175.744 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 61.2 m . . . . . 0 N--CA 1.474 0.727 0 CA-C-N 119.252 0.933 . . . . 0.0 113.143 175.69 . . . . . . . . 0 0 . 1 . 028 nuclear orig core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 39.4 p30 . . . . . 0 CA--C 1.541 0.612 0 N-CA-C 113.401 0.889 . . . . 0.0 113.401 . . . . . . . . . 0 0 . 1 . 028 nuclear orig core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 39.0 mt-30 -147.48 160.35 42.69 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 125.234 1.413 . . . . 0.0 110.947 -170.22 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 99.3 m-70 -82.18 129.11 34.75 Favored 'General case' 0 CA--C 1.539 0.537 0 N-CA-C 108.156 -1.053 . . . . 0.0 108.156 159.51 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 87.0 mt -145.17 134.18 22.59 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 125.025 1.33 . . . . 0.0 109.211 -176.972 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 4.1 t -151.97 153.82 34.83 Favored 'General case' 0 C--O 1.235 0.342 0 C-N-CA 123.02 0.528 . . . . 0.0 111.786 -174.867 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 49.62 -128.66 24.75 Favored Glycine 0 CA--C 1.53 0.97 0 C-N-CA 125.465 1.507 . . . . 0.0 113.799 175.743 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 18.6 m -58.78 -33.45 70.32 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 124.53 1.132 . . . . 0.0 112.824 -179.136 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 80.8 m-70 -76.78 -26.74 54.81 Favored 'General case' 0 CA--C 1.54 0.578 0 O-C-N 121.073 -1.017 . . . . 0.0 112.875 177.857 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 42.6 tp -72.58 -42.26 64.79 Favored 'General case' 0 N--CA 1.468 0.457 0 O-C-N 121.225 -0.922 . . . . 0.0 111.07 168.28 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 55.8 t -59.28 -41.7 84.88 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.003 0 C-N-CA 123.794 0.838 . . . . 0.0 111.378 172.714 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 43.7 tt0 -62.47 -47.35 84.39 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 125.633 1.573 . . . . 0.0 111.823 173.44 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.25 -44.95 95.38 Favored 'General case' 0 CA--C 1.539 0.541 0 O-C-N 121.927 -0.483 . . . . 0.0 112.245 178.276 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 39.6 mt -55.92 -51.48 67.47 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 124.204 1.002 . . . . 0.0 111.092 173.265 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 68.1 t80 -55.32 -43.66 75.1 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 123.619 0.768 . . . . 0.0 113.058 175.262 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 89.8 mt -74.75 -32.86 62.21 Favored 'General case' 0 N--CA 1.471 0.619 0 N-CA-C 113.595 0.961 . . . . 0.0 113.595 -178.478 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 30.4 t -70.91 -43.58 76.67 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 C-N-CA 123.998 0.919 . . . . 0.0 110.466 173.655 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 76.1 m -81.62 -36.55 28.79 Favored 'General case' 0 CA--C 1.533 0.302 0 N-CA-C 113.533 0.938 . . . . 0.0 113.533 -173.855 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . -50.84 131.89 32.04 Favored Glycine 0 CA--C 1.538 1.521 0 C-N-CA 124.324 0.964 . . . . 0.0 113.37 -168.415 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -80.14 -3.59 49.46 Favored 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 128.468 2.707 . . . . 0.0 115.496 10.908 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 75.3 mtm180 -64.2 155.32 32.17 Favored 'General case' 0 N--CA 1.475 0.798 0 CA-C-N 119.567 1.076 . . . . 0.0 110.708 174.628 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . -78.69 -174.08 43.96 Favored Glycine 0 N--CA 1.471 0.972 0 C-N-CA 124.147 0.88 . . . . 0.0 111.519 169.825 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 45.6 p90 -157.02 155.69 31.64 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 123.882 0.873 . . . . 0.0 112.927 -179.075 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 68.3 t80 . . . . . 0 CA--C 1.538 0.491 0 C-N-CA 125.628 1.571 . . . . 0.0 111.205 173.068 . . . . . . . . 0 0 . 1 . 029 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 47.2 t . . . . . 0 N--CA 1.481 1.12 0 N-CA-C 111.343 0.127 . . . . 0.0 111.343 . . . . . . . . . 0 0 . 1 . 029 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -70.75 -54.94 9.82 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 124.114 0.965 . . . . 0.0 110.099 169.956 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 6.7 tt0 -56.91 -49.08 76.68 Favored 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 123.999 0.919 . . . . 0.0 112.117 -174.121 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 63.7 m -62.33 -28.24 69.61 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 114.006 1.113 . . . . 0.0 114.006 -179.094 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 18.6 t -102.1 -36.39 8.57 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 123.806 0.842 . . . . 0.0 112.763 -171.736 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 92.4 m -82.78 -29.51 29.57 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 126.228 1.811 . . . . 0.0 111.713 175.524 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 9.9 t -135.98 -156.26 0.7 Allowed 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 125.616 1.566 . . . . 0.0 110.697 177.124 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 28.1 mm -93.5 147.35 5.55 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.74 0 C-N-CA 125.408 1.483 . . . . 0.0 109.814 172.047 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 19.1 p -132.73 159.01 40.92 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 123.514 0.726 . . . . 0.0 112.486 163.665 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 53.3 p -100.08 162.72 12.8 Favored 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 113.788 1.033 . . . . 0.0 113.788 -175.22 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 78.4 mt -64.22 -33.54 76.03 Favored 'General case' 0 CA--C 1.536 0.421 0 O-C-N 121.344 -0.848 . . . . 0.0 111.5 172.126 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 87.2 t80 -66.78 -34.01 76.89 Favored 'General case' 0 CA--C 1.544 0.713 0 O-C-N 121.459 -0.776 . . . . 0.0 112.845 173.058 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 78.3 mt-30 -71.38 -37.04 71.61 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 123.556 0.742 . . . . 0.0 111.312 173.36 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 95.6 mt -60.98 -42.68 98.82 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-N 119.144 0.884 . . . . 0.0 111.245 167.346 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 56.6 tt0 -64.75 -31.13 72.22 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 123.353 0.661 . . . . 0.0 112.722 178.495 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 18.6 t-20 -64.2 -22.49 66.96 Favored 'General case' 0 CA--C 1.551 0.987 0 O-C-N 121.044 -1.035 . . . . 0.0 112.846 173.129 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 23.5 m-85 -95.73 0.47 52.52 Favored 'General case' 0 CA--C 1.55 0.958 0 C-N-CA 125.686 1.595 . . . . 0.0 113.338 171.661 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 76.4 m . . . . . 0 CA--C 1.542 0.639 0 O-C-N 120.649 -1.282 . . . . 0.0 112.133 165.772 . . . . . . . . 0 0 . 1 . 029 nuclear orig core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . 0.316 6.2 p30 . . . . . 0 CA--C 1.543 0.696 0 N-CA-C 114.162 1.171 . . . . 0.0 114.162 . . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 78.1 mt-30 -156.09 168.42 27.33 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 123.734 0.814 . . . . 0.0 113.149 -162.939 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 93.5 m-70 -84.52 134.21 34.43 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 123.628 0.771 . . . . 0.0 109.53 158.173 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 75.4 mt -148.34 131.91 16.78 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 126.277 1.831 . . . . 0.0 109.895 -176.861 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 85.5 m -135.97 144.52 45.44 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 124.992 1.317 . . . . 0.0 110.911 -177.596 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 52.46 -125.21 28.35 Favored Glycine 0 N--CA 1.474 1.199 0 C-N-CA 125.464 1.507 . . . . 0.0 114.248 165.414 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 27.5 m -58.21 -38.46 76.82 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 123.671 0.788 . . . . 0.0 112.296 -179.196 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 17.5 m-70 -72.33 -32.17 66.29 Favored 'General case' 0 CA--C 1.54 0.565 0 O-C-N 121.142 -0.974 . . . . 0.0 112.237 179.253 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 59.2 tp -65.43 -43.6 89.96 Favored 'General case' 0 CA--C 1.534 0.346 0 O-C-N 121.629 -0.669 . . . . 0.0 111.112 168.708 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 55.4 t -62.3 -40.49 88.03 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.942 0 C-N-CA 123.696 0.798 . . . . 0.0 111.661 175.684 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -62.93 -48.14 80.2 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 124.218 1.007 . . . . 0.0 111.613 173.368 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.63 -44.72 96.02 Favored 'General case' 0 CA--C 1.538 0.497 0 O-C-N 121.759 -0.588 . . . . 0.0 112.224 178.709 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 60.7 tp -57.07 -53.37 58.89 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 123.995 0.918 . . . . 0.0 110.571 174.494 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 9.9 m-30 -55.72 -38.62 69.98 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 123.328 0.651 . . . . 0.0 112.514 178.038 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 76.5 mt -71.65 -35.44 70.36 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 124.42 1.088 . . . . 0.0 113.137 177.758 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 55.3 t -70.44 -40.58 77.71 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.055 0 C-N-CA 123.754 0.822 . . . . 0.0 110.972 173.324 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 57.7 m -75.64 -35.52 60.42 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 113.075 0.769 . . . . 0.0 113.075 -178.747 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 59.02 -129.63 49.89 Favored Glycine 0 CA--C 1.532 1.107 0 N-CA-C 111.544 -0.622 . . . . 0.0 111.544 -174.942 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -75.66 -9.92 59.0 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 124.528 1.131 . . . . 0.0 114.035 179.566 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 60.1 mtp180 -65.95 -35.51 80.79 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 123.957 0.903 . . . . 0.0 113.251 -176.009 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 95.46 158.79 32.72 Favored Glycine 0 CA--C 1.532 1.152 0 C-N-CA 125.366 1.46 . . . . 0.0 113.069 -169.714 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 33.0 p90 -122.77 168.12 12.63 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 125.848 1.659 . . . . 0.0 113.117 -173.192 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 80.9 t80 . . . . . 0 CA--C 1.54 0.59 0 C-N-CA 125.823 1.649 . . . . 0.0 109.239 161.057 . . . . . . . . 0 0 . 1 . 030 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 11.0 t . . . . . 0 N--CA 1.479 0.996 0 CA-C-O 120.301 0.096 . . . . 0.0 111.08 . . . . . . . . . 0 0 . 1 . 030 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 29.7 mm-40 -79.15 8.88 5.11 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.963 1.305 . . . . 0.0 112.535 178.402 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -115.71 -53.63 2.57 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 124.729 1.212 . . . . 0.0 109.993 162.314 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 11.7 m -65.85 -28.48 69.0 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 115.392 1.627 . . . . 0.0 115.392 -173.954 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 42.6 t -92.86 -45.41 8.0 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-N 118.667 0.667 . . . . 0.0 111.927 -178.12 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 23.1 p -68.76 -35.98 77.75 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 126.806 2.042 . . . . 0.0 112.601 -179.308 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 65.0 m -132.76 -171.43 2.66 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 126.42 1.888 . . . . 0.0 110.775 179.064 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 30.3 mm -75.88 142.27 14.68 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.793 0 O-C-N 120.565 -1.335 . . . . 0.0 110.767 172.341 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 14.1 p -134.15 160.58 37.39 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 123.547 0.739 . . . . 0.0 112.461 158.758 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 37.4 t -101.99 159.79 15.06 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 124.889 1.276 . . . . 0.0 112.523 -178.225 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 40.2 mt -63.35 -30.41 71.55 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 123.594 0.758 . . . . 0.0 111.518 170.685 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 26.6 m-85 -65.6 -28.74 69.35 Favored 'General case' 0 CA--C 1.544 0.714 0 N-CA-C 113.304 0.853 . . . . 0.0 113.304 171.881 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 79.0 mt-30 -78.78 -38.36 38.67 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-O 118.558 -0.734 . . . . 0.0 110.593 172.598 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 42.6 mt -58.01 -37.96 75.27 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 119.099 0.863 . . . . 0.0 111.549 168.708 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 25.4 tt0 -66.37 -31.99 73.1 Favored 'General case' 0 CA--C 1.546 0.818 0 CA-C-N 118.688 0.676 . . . . 0.0 112.65 175.891 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 32.8 t30 -68.2 -23.97 64.89 Favored 'General case' 0 CA--C 1.548 0.892 0 O-C-N 121.043 -1.035 . . . . 0.0 112.685 171.947 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 10.5 m-30 -86.7 -5.7 59.05 Favored 'General case' 0 CA--C 1.549 0.917 0 C-N-CA 125.326 1.45 . . . . 0.0 113.545 177.455 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 58.2 m . . . . . 0 N--CA 1.472 0.643 0 C-N-CA 123.562 0.745 . . . . 0.0 112.342 169.614 . . . . . . . . 0 0 . 1 . 030 nuclear orig core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 4.1 p30 . . . . . 0 CA--C 1.534 0.349 0 CA-C-O 120.823 0.344 . . . . 0.0 110.406 . . . . . . . . . 0 0 . 1 . 030 nuclear orig core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 36.2 mt-30 -153.37 166.17 33.48 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 123.821 0.849 . . . . 0.0 112.36 -159.264 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 51.3 m-70 -81.8 132.3 35.28 Favored 'General case' 0 CA--C 1.542 0.664 0 N-CA-C 108.519 -0.919 . . . . 0.0 108.519 156.298 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 72.5 mt -140.73 126.83 19.56 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 125.698 1.599 . . . . 0.0 109.062 -178.263 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 68.7 m -131.14 143.95 51.02 Favored 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 125.053 1.341 . . . . 0.0 110.986 -173.77 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 56.47 -128.42 46.32 Favored Glycine 0 CA--C 1.528 0.866 0 C-N-CA 124.807 1.194 . . . . 0.0 113.927 166.433 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 23.5 p -61.5 -31.79 71.8 Favored 'General case' 0 N--CA 1.467 0.401 0 C-N-CA 124.482 1.113 . . . . 0.0 112.864 179.742 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 26.5 m80 -69.27 -39.99 78.05 Favored 'General case' 0 CA--C 1.54 0.565 0 O-C-N 121.042 -1.037 . . . . 0.0 111.395 175.792 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 50.5 tp -65.13 -45.28 85.71 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 123.379 0.671 . . . . 0.0 111.226 171.917 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 65.8 t -59.55 -43.02 89.93 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.008 0 C-N-CA 123.265 0.626 . . . . 0.0 111.656 176.381 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -65.01 -47.78 76.24 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 123.776 0.83 . . . . 0.0 111.529 177.214 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.92 -46.78 89.32 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 123.022 0.529 . . . . 0.0 111.653 178.632 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 43.8 tp -59.39 -49.99 75.67 Favored 'General case' 0 CA--C 1.533 0.327 0 C-N-CA 124.783 1.233 . . . . 0.0 111.229 176.981 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 63.2 t80 -55.43 -42.56 74.35 Favored 'General case' 0 CA--C 1.54 0.569 0 N-CA-C 113.122 0.786 . . . . 0.0 113.122 174.158 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 88.0 mt -73.88 -31.52 63.18 Favored 'General case' 0 N--CA 1.469 0.517 0 N-CA-C 113.104 0.779 . . . . 0.0 113.104 -179.324 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 41.1 t -68.65 -45.8 80.86 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.763 0 C-N-CA 123.538 0.735 . . . . 0.0 110.618 171.126 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 76.0 m -76.83 -35.15 57.75 Favored 'General case' 0 N--CA 1.469 0.498 0 N-CA-C 113.232 0.827 . . . . 0.0 113.232 -175.207 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 62.62 -130.82 43.53 Favored Glycine 0 CA--C 1.53 1.019 0 C-N-CA 124.284 0.945 . . . . 0.0 111.182 -175.762 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -64.38 -19.75 65.69 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 124.913 1.285 . . . . 0.0 113.57 179.182 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 83.7 mtm180 -64.2 -31.77 73.1 Favored 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 113.661 0.986 . . . . 0.0 113.661 -176.073 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 75.19 178.87 42.9 Favored Glycine 0 CA--C 1.535 1.284 0 C-N-CA 124.412 1.006 . . . . 0.0 112.852 -172.06 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 51.4 p90 -154.78 166.51 33.24 Favored 'General case' 0 CA--C 1.539 0.554 0 N-CA-C 114.179 1.177 . . . . 0.0 114.179 -170.626 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 83.3 t80 . . . . . 0 CA--C 1.54 0.563 0 C-N-CA 125.826 1.65 . . . . 0.0 110.149 167.06 . . . . . . . . 0 0 . 1 . 031 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 21.5 t . . . . . 0 N--CA 1.484 1.239 0 N-CA-C 112.94 0.718 . . . . 0.0 112.94 . . . . . . . . . 0 0 . 1 . 031 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -85.65 -48.26 9.04 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 125.157 1.383 . . . . 0.0 111.405 176.529 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 62.9 tt0 -69.7 -43.68 71.95 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 124.582 1.153 . . . . 0.0 112.193 -172.436 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 74.0 m -74.15 -15.68 61.02 Favored 'General case' 0 N--CA 1.464 0.256 0 N-CA-C 113.595 0.961 . . . . 0.0 113.595 -179.763 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 44.6 t -85.22 -52.62 5.79 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 125.519 1.528 . . . . 0.0 111.783 172.283 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 37.4 p -74.14 -44.32 54.12 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 124.693 1.197 . . . . 0.0 112.476 -176.525 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 50.9 m -101.54 -161.25 0.84 Allowed 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 125.415 1.486 . . . . 0.0 109.737 164.596 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 27.3 pt -112.31 151.38 14.3 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.708 0 O-C-N 120.801 -1.187 . . . . 0.0 111.311 175.309 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 69.6 m -131.1 161.25 32.48 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 124.741 1.216 . . . . 0.0 111.83 172.841 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 47.1 p -97.77 165.19 12.07 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 124.548 1.139 . . . . 0.0 113.385 176.555 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 58.0 mt -63.81 -33.13 74.98 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 123.571 0.748 . . . . 0.0 111.988 171.492 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 88.5 t80 -67.35 -33.66 75.69 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 123.663 0.785 . . . . 0.0 112.891 173.644 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 92.2 mt-30 -73.09 -33.81 65.82 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 123.464 0.705 . . . . 0.0 111.751 173.553 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 90.9 mt -64.94 -39.59 93.73 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 118.766 0.712 . . . . 0.0 111.701 166.555 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 29.8 tt0 -64.2 -30.64 71.69 Favored 'General case' 0 CA--C 1.543 0.698 0 N-CA-C 112.822 0.675 . . . . 0.0 112.822 179.748 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 18.4 t-20 -60.35 -21.62 62.3 Favored 'General case' 0 CA--C 1.551 1.014 0 O-C-N 121.177 -0.952 . . . . 0.0 113.362 172.794 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 27.6 m-85 -99.89 4.97 45.37 Favored 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 126.301 1.84 . . . . 0.0 113.89 177.128 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 74.7 m . . . . . 0 N--CA 1.473 0.682 0 O-C-N 120.65 -1.281 . . . . 0.0 111.877 167.303 . . . . . . . . 0 0 . 1 . 031 nuclear orig core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 4.6 m-80 . . . . . 0 CA--C 1.541 0.605 0 CA-C-O 120.66 0.267 . . . . 0.0 111.312 . . . . . . . . . 0 0 . 1 . 031 nuclear orig core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 41.9 mt-30 -146.42 157.49 43.77 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 124.549 1.14 . . . . 0.0 111.423 -174.74 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 81.8 m-70 -79.3 125.76 29.91 Favored 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 108.173 -1.047 . . . . 0.0 108.173 157.513 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 93.2 mt -137.93 121.51 17.33 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 125.187 1.395 . . . . 0.0 109.612 -176.086 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 59.0 m -128.48 138.58 52.35 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 125.136 1.375 . . . . 0.0 110.633 -174.402 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 52.64 -121.59 15.69 Favored Glycine 0 N--CA 1.473 1.13 0 C-N-CA 124.773 1.178 . . . . 0.0 113.484 167.369 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 31.7 p -61.96 -31.73 72.1 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 124.799 1.24 . . . . 0.0 113.293 -179.789 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 93.0 m-70 -69.75 -37.53 76.46 Favored 'General case' 0 CA--C 1.54 0.591 0 O-C-N 120.896 -1.128 . . . . 0.0 111.436 174.748 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 6.9 tt -68.0 -43.44 78.88 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-O 118.581 -0.724 . . . . 0.0 110.98 172.035 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 53.2 t -55.86 -45.56 79.8 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.004 0 CA-C-N 118.985 0.811 . . . . 0.0 111.253 173.647 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 7.1 tp10 -63.21 -46.96 84.56 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 123.573 0.749 . . . . 0.0 111.281 178.002 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.64 -48.14 80.67 Favored 'General case' 0 CA--C 1.537 0.481 0 O-C-N 121.609 -0.682 . . . . 0.0 111.808 178.881 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 44.1 tp -60.2 -46.62 89.09 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 125.356 1.462 . . . . 0.0 111.124 178.726 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 67.5 t80 -57.69 -42.67 84.14 Favored 'General case' 0 CA--C 1.539 0.522 0 N-CA-C 113.012 0.745 . . . . 0.0 113.012 173.481 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 83.6 mt -74.45 -32.43 62.6 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 123.771 0.828 . . . . 0.0 112.784 -179.741 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 25.8 t -66.29 -46.91 85.96 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.884 0 C-N-CA 124.268 1.027 . . . . 0.0 110.456 171.471 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 75.8 m -80.44 -32.55 37.26 Favored 'General case' 0 N--CA 1.467 0.398 0 N-CA-C 113.628 0.973 . . . . 0.0 113.628 -174.345 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 64.3 -134.13 39.29 Favored Glycine 0 CA--C 1.529 0.914 0 C-N-CA 124.167 0.889 . . . . 0.0 111.454 -176.397 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -68.84 -12.08 61.16 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 124.497 1.119 . . . . 0.0 113.956 179.448 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 86.5 mtm180 -65.25 -32.27 73.86 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 124.162 0.985 . . . . 0.0 113.058 179.802 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 79.26 -179.98 52.51 Favored Glycine 0 CA--C 1.533 1.16 0 C-N-CA 124.517 1.056 . . . . 0.0 112.626 -171.329 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 48.3 p90 -151.73 161.45 42.65 Favored 'General case' 0 N--CA 1.468 0.449 0 N-CA-C 114.057 1.132 . . . . 0.0 114.057 -174.645 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 82.7 t80 . . . . . 0 CA--C 1.536 0.438 0 C-N-CA 125.807 1.643 . . . . 0.0 109.216 167.627 . . . . . . . . 0 0 . 1 . 032 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 37.9 t . . . . . 0 N--CA 1.477 0.898 0 N-CA-C 111.819 0.303 . . . . 0.0 111.819 . . . . . . . . . 0 0 . 1 . 032 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -77.68 -57.82 3.6 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-N 118.722 0.692 . . . . 0.0 110.201 168.318 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 62.5 tp60 -55.72 -49.83 71.98 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 124.786 1.235 . . . . 0.0 112.76 -174.662 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 89.3 m -62.21 -26.01 68.12 Favored 'General case' 0 N--CA 1.466 0.348 0 C-N-CA 124.644 1.178 . . . . 0.0 113.711 179.295 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 14.0 t -98.4 -39.73 8.64 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 124.278 1.031 . . . . 0.0 112.257 -171.902 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 1.7 t -83.36 -27.61 29.57 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 125.052 1.341 . . . . 0.0 112.828 178.315 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 21.1 t -140.82 -153.23 0.45 Allowed 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 126.277 1.831 . . . . 0.0 108.828 176.583 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 43.6 pt -101.09 156.24 4.4 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.401 0 C-N-CA 123.889 0.876 . . . . 0.0 111.608 175.329 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 18.1 p -140.17 165.95 26.0 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 124.252 1.021 . . . . 0.0 111.898 173.567 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 88.3 p -104.17 155.72 18.48 Favored 'General case' 0 C--O 1.236 0.383 0 C-N-CA 124.291 1.036 . . . . 0.0 112.481 -175.112 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 57.2 mt -59.02 -29.02 66.95 Favored 'General case' 0 CA--C 1.533 0.293 0 O-C-N 121.294 -0.878 . . . . 0.0 112.058 170.557 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 84.4 t80 -67.2 -29.77 69.53 Favored 'General case' 0 CA--C 1.542 0.653 0 N-CA-C 113.648 0.981 . . . . 0.0 113.648 171.648 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 -78.98 -33.0 45.52 Favored 'General case' 0 N--CA 1.468 0.464 0 O-C-N 121.43 -0.794 . . . . 0.0 110.637 174.333 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 10.8 mp -60.89 -44.46 97.08 Favored 'General case' 0 CA--C 1.542 0.658 0 CA-C-N 118.124 0.42 . . . . 0.0 111.076 164.891 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 31.9 tt0 -63.64 -37.17 86.31 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 123.969 0.908 . . . . 0.0 112.492 179.266 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 21.3 t-20 -61.27 -22.85 65.23 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 123.933 0.893 . . . . 0.0 112.955 173.904 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -94.82 -0.94 53.69 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 125.562 1.545 . . . . 0.0 114.01 176.823 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 38.3 m . . . . . 0 N--CA 1.471 0.597 0 O-C-N 120.657 -1.277 . . . . 0.0 110.731 163.447 . . . . . . . . 0 0 . 1 . 032 nuclear orig core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 39.9 m-20 . . . . . 0 CA--C 1.543 0.686 0 CA-C-O 120.821 0.343 . . . . 0.0 111.003 . . . . . . . . . 0 0 . 1 . 032 nuclear orig core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 45.0 mt-30 -143.89 159.81 41.9 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 123.723 0.809 . . . . 0.0 112.049 -172.254 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 96.4 m-70 -78.3 133.4 37.64 Favored 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 108.936 -0.765 . . . . 0.0 108.936 155.02 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 93.6 mt -150.53 129.91 12.92 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 125.413 1.485 . . . . 0.0 108.259 -174.6 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 4.1 t -156.82 151.82 26.1 Favored 'General case' 0 N--CA 1.469 0.52 0 O-C-N 121.155 -0.966 . . . . 0.0 112.246 -178.677 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 56.94 -132.16 52.3 Favored Glycine 0 CA--C 1.531 1.033 0 C-N-CA 124.708 1.147 . . . . 0.0 112.698 -179.241 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 25.4 m -61.58 -29.32 69.95 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 124.27 1.028 . . . . 0.0 112.146 -177.615 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 14.9 m80 -68.71 -42.4 77.75 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 124.311 1.044 . . . . 0.0 111.008 178.398 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 51.2 tp -68.7 -44.15 74.56 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-O 118.458 -0.782 . . . . 0.0 110.663 172.806 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 53.7 t -58.57 -40.74 79.94 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.895 0 CA-C-N 119.042 0.837 . . . . 0.0 111.72 177.176 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -66.57 -48.58 69.17 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 123.614 0.766 . . . . 0.0 111.459 175.536 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.51 -44.21 97.47 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-O 121.318 0.58 . . . . 0.0 111.809 179.564 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 40.6 tp -60.95 -46.34 91.11 Favored 'General case' 0 C--N 1.333 -0.124 0 C-N-CA 124.905 1.282 . . . . 0.0 111.058 175.9 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 50.7 t80 -64.59 -26.17 68.29 Favored 'General case' 0 CA--C 1.543 0.691 0 N-CA-C 113.69 0.996 . . . . 0.0 113.69 173.814 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 73.7 mt -75.6 -32.44 60.31 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-N 119.71 1.141 . . . . 0.0 113.087 172.341 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 92.6 t -76.85 -38.9 29.91 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.252 0 C-N-CA 124.163 0.985 . . . . 0.0 111.311 173.237 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 63.5 m -105.58 14.68 28.15 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 126.044 1.738 . . . . 0.0 114.158 -172.566 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . -56.98 -36.71 75.0 Favored Glycine 0 N--CA 1.477 1.413 0 CA-C-N 119.275 0.943 . . . . 0.0 114.958 -168.686 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 4.4 mp0 -77.54 -11.75 59.89 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 124.917 1.287 . . . . 0.0 113.494 175.816 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 24.2 mmm180 -111.45 -53.03 2.74 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 126.225 1.81 . . . . 0.0 113.415 -169.467 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 92.18 162.61 37.44 Favored Glycine 0 CA--C 1.536 1.358 0 C-N-CA 124.706 1.146 . . . . 0.0 111.317 -153.641 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 49.5 p90 -142.02 156.58 45.43 Favored 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 114.403 1.26 . . . . 0.0 114.403 -170.94 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 57.3 t80 . . . . . 0 CA--C 1.542 0.636 0 C-N-CA 127.393 2.277 . . . . 0.0 110.008 165.098 . . . . . . . . 0 0 . 1 . 033 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 70.6 t . . . . . 0 N--CA 1.485 1.281 0 N-CA-C 112.166 0.432 . . . . 0.0 112.166 . . . . . . . . . 0 0 . 1 . 033 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 -79.64 -64.52 1.17 Allowed 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 123.594 0.758 . . . . 0.0 109.352 170.347 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 11.1 tt0 -58.69 -47.28 85.06 Favored 'General case' 0 N--CA 1.465 0.29 0 C-N-CA 125.063 1.345 . . . . 0.0 112.442 -168.048 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 87.3 m -64.86 -23.08 67.12 Favored 'General case' 0 C--O 1.234 0.255 0 N-CA-C 113.645 0.98 . . . . 0.0 113.645 -178.526 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 8.4 t -101.98 -31.41 10.68 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 123.49 0.716 . . . . 0.0 112.597 -172.377 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 80.7 p -88.6 -28.16 20.88 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 124.532 1.133 . . . . 0.0 112.9 172.399 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 11.8 t -139.13 -160.05 1.02 Allowed 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 126.492 1.917 . . . . 0.0 109.622 178.495 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 42.6 pt -96.51 156.98 3.3 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.476 0 C-N-CA 124.416 1.086 . . . . 0.0 111.731 176.061 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 18.2 p -147.35 160.55 42.41 Favored 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 124.219 1.008 . . . . 0.0 112.695 175.409 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 50.8 m -109.6 155.41 21.47 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 124.568 1.147 . . . . 0.0 111.774 -174.979 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 33.1 mt -60.41 -31.13 70.09 Favored 'General case' 0 N--CA 1.469 0.48 0 O-C-N 120.949 -1.094 . . . . 0.0 112.078 177.762 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 33.4 m-85 -61.09 -30.16 70.18 Favored 'General case' 0 CA--C 1.542 0.66 0 N-CA-C 113.558 0.947 . . . . 0.0 113.558 171.22 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 96.2 mt-30 -81.78 -34.55 30.28 Favored 'General case' 0 N--CA 1.465 0.294 0 C-N-CA 123.94 0.896 . . . . 0.0 110.298 177.355 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 8.3 mp -62.12 -40.39 95.73 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 118.775 0.716 . . . . 0.0 111.785 166.653 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -59.16 -28.35 66.51 Favored 'General case' 0 CA--C 1.541 0.596 0 C-N-CA 124.587 1.155 . . . . 0.0 113.105 -178.146 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 5.4 m-80 -66.29 -16.33 63.95 Favored 'General case' 0 CA--C 1.546 0.816 0 N-CA-C 113.795 1.035 . . . . 0.0 113.795 175.559 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 72.5 m-85 -102.21 5.2 40.04 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 125.908 1.683 . . . . 0.0 113.458 177.609 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 86.0 m . . . . . 0 N--CA 1.473 0.701 0 O-C-N 121.018 -1.052 . . . . 0.0 112.422 167.735 . . . . . . . . 0 0 . 1 . 033 nuclear orig core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 10.4 p30 . . . . . 0 CA--C 1.541 0.629 0 CA-C-O 120.689 0.281 . . . . 0.0 111.569 . . . . . . . . . 0 0 . 1 . 033 nuclear orig core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 38.7 mt-30 -150.43 167.42 27.17 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 124.444 1.098 . . . . 0.0 111.479 -166.673 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 92.4 m-70 -86.72 136.74 32.9 Favored 'General case' 0 CA--C 1.542 0.671 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 152.675 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 93.3 mt -148.93 136.03 19.99 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 125.582 1.553 . . . . 0.0 109.412 -176.875 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 73.0 m -140.74 145.29 36.23 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 124.742 1.217 . . . . 0.0 110.526 -179.11 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 52.53 -125.71 29.81 Favored Glycine 0 N--CA 1.473 1.135 0 C-N-CA 124.772 1.177 . . . . 0.0 114.503 165.381 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 23.6 m -60.39 -36.92 79.21 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 124.061 0.944 . . . . 0.0 111.941 -177.656 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 27.5 m170 -68.62 -37.93 80.13 Favored 'General case' 0 CA--C 1.54 0.559 0 O-C-N 121.325 -0.86 . . . . 0.0 111.809 178.25 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 9.6 tt -64.14 -45.94 86.29 Favored 'General case' 0 C--O 1.223 -0.305 0 C-N-CA 123.993 0.917 . . . . 0.0 110.796 170.074 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 41.7 t -61.65 -37.18 77.34 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.963 0 C-N-CA 123.602 0.761 . . . . 0.0 111.836 178.4 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -68.31 -45.43 72.99 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 124.022 0.929 . . . . 0.0 111.804 173.364 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.76 -43.67 97.72 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 119.352 0.978 . . . . 0.0 111.756 175.248 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 51.4 tp -61.15 -48.76 80.12 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 125.222 1.409 . . . . 0.0 111.022 177.109 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 46.9 t80 -54.35 -40.02 67.66 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 123.49 0.716 . . . . 0.0 112.659 172.436 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 82.2 mt -74.9 -33.9 62.1 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 123.961 0.904 . . . . 0.0 113.248 178.703 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 40.0 t -65.85 -44.7 92.7 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.924 0 C-N-CA 124.413 1.085 . . . . 0.0 110.98 172.15 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 58.5 m -83.41 -29.81 27.82 Favored 'General case' 0 N--CA 1.469 0.504 0 N-CA-C 113.676 0.991 . . . . 0.0 113.676 -175.087 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 67.61 -144.89 44.63 Favored Glycine 0 CA--C 1.532 1.129 0 C-N-CA 124.224 0.916 . . . . 0.0 112.012 -174.499 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -68.96 -7.42 35.05 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 124.65 1.18 . . . . 0.0 114.139 -178.953 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 80.0 mtt85 -61.31 -31.88 71.74 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 124.733 1.213 . . . . 0.0 113.389 177.049 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 86.34 179.35 49.55 Favored Glycine 0 CA--C 1.533 1.164 0 C-N-CA 125.112 1.339 . . . . 0.0 112.441 -170.654 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 52.6 p90 -159.65 167.32 28.69 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 124.729 1.212 . . . . 0.0 112.833 -173.274 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 81.7 t80 . . . . . 0 CA--C 1.537 0.472 0 C-N-CA 125.999 1.72 . . . . 0.0 108.314 172.209 . . . . . . . . 0 0 . 1 . 034 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 74.7 t . . . . . 0 N--CA 1.48 1.041 0 N-CA-C 111.396 0.147 . . . . 0.0 111.396 . . . . . . . . . 0 0 . 1 . 034 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 18.8 tt0 -79.17 0.89 26.49 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 123.642 0.777 . . . . 0.0 113.027 -179.519 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 6.7 tp60 -104.54 -63.05 1.25 Allowed 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 124.458 1.103 . . . . 0.0 109.643 166.032 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 64.5 m -66.19 -26.18 67.28 Favored 'General case' 0 N--CA 1.467 0.424 0 N-CA-C 115.151 1.537 . . . . 0.0 115.151 -170.152 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 12.1 t -87.61 -33.36 18.88 Favored 'General case' 0 N--CA 1.471 0.585 0 O-C-N 121.708 -0.62 . . . . 0.0 112.594 -172.117 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 20.7 p -105.69 -35.29 7.44 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 126.29 1.836 . . . . 0.0 112.826 -175.806 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.1 t -112.18 -171.79 1.92 Allowed 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 125.48 1.512 . . . . 0.0 110.31 169.579 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 11.1 tt -92.83 146.72 6.03 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.686 0 C-N-CA 124.807 1.243 . . . . 0.0 110.329 173.624 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 27.2 p -133.56 158.21 43.73 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-O 121.805 0.812 . . . . 0.0 112.448 175.285 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 83.8 p -104.78 158.29 16.62 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 125.006 1.322 . . . . 0.0 111.939 -179.802 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 55.8 mt -60.16 -30.29 69.22 Favored 'General case' 0 N--CA 1.466 0.34 0 O-C-N 121.083 -1.011 . . . . 0.0 111.927 173.87 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 76.9 t80 -65.7 -31.98 73.29 Favored 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 113.398 0.888 . . . . 0.0 113.398 171.249 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 40.5 mt-30 -73.73 -36.84 65.22 Favored 'General case' 0 N--CA 1.468 0.458 0 O-C-N 121.5 -0.75 . . . . 0.0 110.483 173.144 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 7.0 mp -61.59 -40.12 93.64 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-N 118.608 0.64 . . . . 0.0 111.603 168.992 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 27.5 tt0 -68.51 -32.41 72.35 Favored 'General case' 0 CA--C 1.544 0.737 0 N-CA-C 112.786 0.661 . . . . 0.0 112.786 178.83 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 6.3 m-80 -66.21 -15.11 62.89 Favored 'General case' 0 CA--C 1.549 0.936 0 O-C-N 120.914 -1.116 . . . . 0.0 112.976 171.05 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 14.0 m-85 -97.75 1.33 48.32 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 125.889 1.676 . . . . 0.0 113.639 172.381 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 39.4 m . . . . . 0 CA--C 1.546 0.789 0 CA-C-N 119.93 1.241 . . . . 0.0 110.794 162.144 . . . . . . . . 0 0 . 1 . 034 nuclear orig core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 65.4 m-20 . . . . . 0 N--CA 1.472 0.65 0 N-CA-C 110.426 -0.213 . . . . 0.0 110.426 . . . . . . . . . 0 0 . 1 . 034 nuclear orig core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 41.9 mt-30 -146.03 159.29 43.47 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 123.575 0.75 . . . . 0.0 112.02 -166.908 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 99.0 m-70 -86.13 133.24 33.88 Favored 'General case' 0 CA--C 1.54 0.576 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 154.772 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 96.3 mt -146.66 135.52 22.33 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 125.375 1.47 . . . . 0.0 108.668 -172.007 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 4.2 t -160.45 154.8 23.46 Favored 'General case' 0 N--CA 1.466 0.348 0 O-C-N 121.538 -0.726 . . . . 0.0 111.99 -175.584 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 62.97 -139.61 44.92 Favored Glycine 0 N--CA 1.47 0.943 0 C-N-CA 123.969 0.795 . . . . 0.0 112.691 -178.845 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 23.9 p -61.83 -29.09 69.94 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 124.675 1.19 . . . . 0.0 112.411 179.64 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 15.7 m80 -62.6 -42.09 99.36 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 124.311 1.044 . . . . 0.0 111.939 176.668 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 40.4 tp -71.72 -40.0 69.75 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 123.628 0.771 . . . . 0.0 111.432 175.299 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 88.1 t -58.5 -43.19 86.37 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.202 0 C-N-CA 123.094 0.558 . . . . 0.0 111.406 173.31 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -67.31 -43.41 81.75 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 124.291 1.037 . . . . 0.0 111.752 176.443 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.36 -44.49 97.08 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 122.942 0.497 . . . . 0.0 111.671 177.14 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 34.9 mt -60.43 -46.59 89.48 Favored 'General case' 0 N--CA 1.467 0.407 0 C-N-CA 124.046 0.938 . . . . 0.0 111.084 174.408 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 84.2 t80 -56.56 -39.57 73.68 Favored 'General case' 0 CA--C 1.543 0.705 0 CA-C-N 118.725 0.693 . . . . 0.0 112.75 174.263 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 89.8 mt -77.62 -36.01 52.12 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 124.074 0.949 . . . . 0.0 113.47 179.805 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 41.1 t -69.14 -44.46 80.86 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.921 0 C-N-CA 124.036 0.934 . . . . 0.0 110.741 174.571 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 75.0 m -85.72 -30.75 22.88 Favored 'General case' 0 N--CA 1.47 0.531 0 N-CA-C 113.374 0.879 . . . . 0.0 113.374 -173.205 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 63.49 -132.08 41.42 Favored Glycine 0 CA--C 1.531 1.046 0 C-N-CA 123.975 0.797 . . . . 0.0 111.377 -177.508 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -69.74 -11.72 61.07 Favored 'General case' 0 CA--C 1.547 0.849 0 N-CA-C 113.8 1.037 . . . . 0.0 113.8 179.797 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 83.8 mtm180 -64.73 -37.45 87.65 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-N 119.13 0.877 . . . . 0.0 112.898 -179.459 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 83.07 169.68 45.02 Favored Glycine 0 CA--C 1.534 1.269 0 C-N-CA 124.513 1.054 . . . . 0.0 112.822 -170.356 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 53.5 p90 -153.34 160.61 42.72 Favored 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 114.198 1.184 . . . . 0.0 114.198 -170.398 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 46.0 t80 . . . . . 0 CA--C 1.54 0.581 0 C-N-CA 126.317 1.847 . . . . 0.0 110.219 164.59 . . . . . . . . 0 0 . 1 . 035 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 54.7 t . . . . . 0 N--CA 1.484 1.27 0 N-CA-C 112.553 0.575 . . . . 0.0 112.553 . . . . . . . . . 0 0 . 1 . 035 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -71.42 -33.68 69.63 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 118.187 0.449 . . . . 0.0 111.354 -178.873 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 18.1 tt0 -59.66 -56.89 16.26 Favored 'General case' 0 N--CA 1.466 0.334 0 C-N-CA 123.411 0.684 . . . . 0.0 110.987 177.948 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 2.1 t -73.45 -15.9 61.32 Favored 'General case' 0 N--CA 1.469 0.515 0 N-CA-C 113.547 0.943 . . . . 0.0 113.547 -174.276 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 26.2 t -90.29 -35.41 15.29 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 123.853 0.861 . . . . 0.0 112.999 178.634 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 76.8 p -95.58 -37.03 11.03 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 124.417 1.087 . . . . 0.0 113.097 177.833 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 17.7 t -113.46 -147.54 0.42 Allowed 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 126.923 2.089 . . . . 0.0 108.74 168.075 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 44.5 pt -118.01 168.49 9.86 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 C-N-CA 125.113 1.365 . . . . 0.0 112.616 -179.767 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 20.1 p -147.44 159.09 44.11 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 124.501 1.121 . . . . 0.0 111.661 166.663 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 88.6 p -96.17 162.12 13.67 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 125.142 1.377 . . . . 0.0 112.43 174.822 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 57.5 mt -60.42 -34.2 73.61 Favored 'General case' 0 N--CA 1.468 0.464 0 O-C-N 121.391 -0.818 . . . . 0.0 111.535 173.292 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 79.9 m-85 -65.6 -34.04 77.3 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 123.81 0.844 . . . . 0.0 113.014 173.028 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 45.2 mt-30 -72.28 -35.88 68.82 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-O 118.468 -0.777 . . . . 0.0 111.98 171.718 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 68.5 mt -58.57 -46.4 86.99 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 119.143 0.883 . . . . 0.0 110.949 169.276 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 22.5 tt0 -69.53 -27.34 65.08 Favored 'General case' 0 CA--C 1.541 0.597 0 N-CA-C 113.307 0.855 . . . . 0.0 113.307 -178.251 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.7 m-80 -62.65 -22.42 66.43 Favored 'General case' 0 CA--C 1.546 0.791 0 O-C-N 120.954 -1.091 . . . . 0.0 113.504 176.579 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 62.6 m-85 -99.91 0.81 41.99 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 125.169 1.388 . . . . 0.0 113.709 174.231 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 89.7 m . . . . . 0 CA--C 1.54 0.56 0 C-N-CA 124.197 0.999 . . . . 0.0 113.188 171.838 . . . . . . . . 0 0 . 1 . 035 nuclear orig core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 8.1 p-10 . . . . . 0 CA--C 1.537 0.461 0 N-CA-C 112.745 0.646 . . . . 0.0 112.745 . . . . . . . . . 0 0 . 1 . 035 nuclear orig core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 41.7 mt-30 -152.14 169.16 23.11 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 125.11 1.364 . . . . 0.0 111.885 -169.29 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 98.4 m-70 -88.17 135.35 33.48 Favored 'General case' 0 CA--C 1.542 0.673 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 150.276 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 86.6 mt -145.09 132.28 20.49 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 125.063 1.345 . . . . 0.0 110.53 -179.055 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 63.6 m -131.51 141.87 49.83 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 125.568 1.547 . . . . 0.0 110.295 178.097 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 51.57 -120.26 9.83 Favored Glycine 0 N--CA 1.475 1.28 0 C-N-CA 124.843 1.211 . . . . 0.0 114.372 165.543 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 29.3 m -60.13 -33.8 72.64 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 124.234 1.014 . . . . 0.0 112.627 -177.742 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 97.1 m-70 -72.16 -38.21 69.21 Favored 'General case' 0 CA--C 1.54 0.574 0 O-C-N 121.324 -0.86 . . . . 0.0 111.324 177.554 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 62.6 tp -65.13 -45.34 85.45 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 123.718 0.807 . . . . 0.0 111.126 172.392 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 27.5 t -60.38 -41.69 88.21 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.898 0 C-N-CA 124.246 1.018 . . . . 0.0 111.771 175.61 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -63.77 -47.41 81.07 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 123.631 0.772 . . . . 0.0 111.423 174.498 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.49 -43.87 97.75 Favored 'General case' 0 CA--C 1.541 0.62 0 O-C-N 121.691 -0.631 . . . . 0.0 112.477 179.549 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 25.5 mt -54.27 -50.93 66.1 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 124.45 1.1 . . . . 0.0 110.913 172.354 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 57.7 t80 -63.75 -33.06 74.82 Favored 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 113.463 0.912 . . . . 0.0 113.463 176.9 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 74.5 mt -74.69 -36.28 62.75 Favored 'General case' 0 N--CA 1.472 0.631 0 O-C-N 121.044 -1.035 . . . . 0.0 113.175 177.394 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 53.2 t -71.72 -43.44 70.18 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.875 0 C-N-CA 123.762 0.825 . . . . 0.0 111.066 175.709 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 65.1 m -104.72 -17.77 14.52 Favored 'General case' 0 N--CA 1.475 0.783 0 N-CA-C 114.467 1.284 . . . . 0.0 114.467 -166.593 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 67.72 -155.57 52.87 Favored Glycine 0 CA--C 1.531 1.081 0 C-N-CA 124.927 1.251 . . . . 0.0 113.18 179.642 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -71.83 -1.75 15.28 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 124.526 1.13 . . . . 0.0 113.297 175.606 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 29.1 ttp180 -60.83 -26.21 67.16 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 125.45 1.5 . . . . 0.0 112.886 176.531 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 111.5 139.52 7.9 Favored Glycine 0 CA--C 1.53 1.001 0 C-N-CA 126.392 1.949 . . . . 0.0 112.863 177.093 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 40.9 p90 -144.07 166.92 23.63 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 125.671 1.589 . . . . 0.0 112.167 -176.647 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 44.5 t80 . . . . . 0 CA--C 1.538 0.499 0 CA-C-O 121.74 0.781 . . . . 0.0 112.564 169.588 . . . . . . . . 0 0 . 1 . 036 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 85.2 t . . . . . 0 N--CA 1.484 1.259 0 CA-C-O 119.927 -0.082 . . . . 0.0 110.909 . . . . . . . . . 0 0 . 1 . 036 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -74.04 -47.81 34.29 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 123.097 0.559 . . . . 0.0 110.102 176.379 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 13.3 tm0? -58.74 -47.07 85.9 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 124.499 1.12 . . . . 0.0 111.693 -177.409 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 12.4 m -59.15 -23.89 62.56 Favored 'General case' 0 N--CA 1.47 0.525 0 N-CA-C 113.727 1.01 . . . . 0.0 113.727 174.988 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 49.4 t -98.13 -49.23 4.81 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 124.97 1.308 . . . . 0.0 113.324 -172.191 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 77.0 p -79.04 -36.11 41.57 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 124.641 1.176 . . . . 0.0 112.087 -179.662 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 13.2 t -106.77 -154.68 0.53 Allowed 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 125.554 1.542 . . . . 0.0 109.319 164.438 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 26.7 pt -117.29 155.6 18.88 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.624 0 C-N-CA 125.704 1.602 . . . . 0.0 111.474 178.036 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 16.1 p -145.87 162.32 38.0 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 124.041 0.936 . . . . 0.0 111.935 171.772 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 32.6 t -101.85 156.27 17.62 Favored 'General case' 0 N--CA 1.465 0.318 0 C-N-CA 124.071 0.948 . . . . 0.0 112.74 -173.383 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 55.5 mt -59.56 -31.95 69.9 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 124.178 0.991 . . . . 0.0 111.461 174.192 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 3.5 m-30 -67.62 -25.26 65.66 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 124.307 1.043 . . . . 0.0 112.727 173.703 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 89.2 mt-30 -88.41 -31.04 19.03 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 124.405 1.082 . . . . 0.0 110.527 178.505 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 10.9 mp -57.28 -52.65 64.48 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 122.964 0.506 . . . . 0.0 110.578 161.694 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 5.6 tm-20 -58.95 -29.51 67.19 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 124.956 1.303 . . . . 0.0 113.413 -173.971 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 22.3 t30 -51.76 -30.01 21.04 Favored 'General case' 0 CA--C 1.549 0.918 0 C-N-CA 124.934 1.293 . . . . 0.0 114.29 175.087 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 95.2 m-85 -94.79 0.45 54.93 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 125.347 1.459 . . . . 0.0 113.993 -177.343 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 75.3 m . . . . . 0 CA--C 1.538 0.484 0 C-N-CA 124.303 1.041 . . . . 0.0 113.409 177.77 . . . . . . . . 0 0 . 1 . 036 nuclear orig core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 40.3 m-80 . . . . . 0 CA--C 1.54 0.596 0 N-CA-C 113.331 0.863 . . . . 0.0 113.331 . . . . . . . . . 0 0 . 1 . 036 nuclear orig core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 36.9 mt-30 -145.57 164.19 32.45 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 125.69 1.596 . . . . 0.0 110.552 177.656 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 98.9 m-70 -81.45 128.98 34.45 Favored 'General case' 0 CA--C 1.538 0.5 0 N-CA-C 108.711 -0.848 . . . . 0.0 108.711 157.889 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 89.9 mt -142.24 124.69 15.7 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 125.498 1.519 . . . . 0.0 109.169 -176.302 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 61.5 m -127.67 137.55 52.54 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 124.256 1.022 . . . . 0.0 111.251 -173.646 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 45.59 -118.85 3.25 Favored Glycine 0 N--CA 1.472 1.075 0 C-N-CA 126.04 1.781 . . . . 0.0 114.708 165.404 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 19.1 m -60.0 -33.11 71.54 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 124.33 1.052 . . . . 0.0 112.693 -178.655 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 83.0 m-70 -78.77 -29.91 45.34 Favored 'General case' 0 CA--C 1.543 0.686 0 O-C-N 121.083 -1.01 . . . . 0.0 112.659 176.885 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 54.4 tp -65.48 -45.44 83.64 Favored 'General case' 0 N--CA 1.47 0.571 0 O-C-N 121.444 -0.785 . . . . 0.0 110.991 167.909 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 77.1 t -65.89 -35.02 74.12 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.022 0 C-N-CA 123.869 0.868 . . . . 0.0 111.934 175.95 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -63.87 -50.4 68.95 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 124.799 1.239 . . . . 0.0 111.569 171.623 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -58.76 -43.55 90.36 Favored 'General case' 0 CA--C 1.54 0.567 0 O-C-N 121.895 -0.503 . . . . 0.0 111.594 176.564 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 52.9 tp -58.8 -47.74 83.71 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 124.818 1.247 . . . . 0.0 111.677 177.23 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 89.7 t80 -59.27 -40.46 86.12 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 123.613 0.765 . . . . 0.0 112.452 173.119 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 90.0 mt -75.61 -35.22 60.58 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 124.113 0.965 . . . . 0.0 113.314 -178.156 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 41.4 t -65.24 -44.22 95.16 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.958 0 C-N-CA 124.378 1.071 . . . . 0.0 110.303 174.406 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 74.4 m -98.77 -17.72 18.35 Favored 'General case' 0 N--CA 1.471 0.611 0 N-CA-C 115.094 1.516 . . . . 0.0 115.094 -169.838 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 65.14 -138.79 39.42 Favored Glycine 0 CA--C 1.53 1.016 0 C-N-CA 124.81 1.195 . . . . 0.0 113.019 176.79 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -63.07 -19.66 64.61 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 125.524 1.53 . . . . 0.0 113.553 -176.392 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 50.8 mtm180 -61.47 -36.69 81.16 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 124.042 0.937 . . . . 0.0 113.151 -178.584 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.57 -176.45 42.24 Favored Glycine 0 CA--C 1.533 1.212 0 C-N-CA 123.992 0.806 . . . . 0.0 113.565 -178.17 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 37.9 p90 -156.89 169.98 23.54 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 125.332 1.453 . . . . 0.0 113.121 -168.362 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 89.1 t80 . . . . . 0 CA--C 1.538 0.498 0 C-N-CA 125.124 1.37 . . . . 0.0 109.051 161.577 . . . . . . . . 0 0 . 1 . 037 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 55.4 t . . . . . 0 N--CA 1.48 1.056 0 CA-C-O 119.176 -0.44 . . . . 0.0 111.917 . . . . . . . . . 0 0 . 1 . 037 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 78.5 mt-10 -86.66 -48.06 8.62 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-N 118.946 0.794 . . . . 0.0 111.047 168.72 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 61.8 tp60 -60.46 -44.32 95.99 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 123.144 0.578 . . . . 0.0 112.176 -175.162 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -79.59 -19.61 48.91 Favored 'General case' 0 CA--C 1.536 0.408 0 N-CA-C 113.641 0.978 . . . . 0.0 113.641 -177.128 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 48.3 t -100.54 -55.46 2.59 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 124.212 1.005 . . . . 0.0 113.002 -174.706 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 50.7 m -76.17 -42.99 44.78 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 125.45 1.5 . . . . 0.0 110.217 -177.244 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 16.4 t -99.98 -150.92 0.39 Allowed 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 123.725 0.81 . . . . 0.0 109.266 158.468 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 34.9 pt -120.99 158.24 23.66 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.675 0 C-N-CA 125.402 1.481 . . . . 0.0 112.078 179.056 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -148.78 165.8 30.35 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-O 121.974 0.892 . . . . 0.0 113.035 166.411 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 16.6 t -109.81 166.97 10.5 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 123.986 0.914 . . . . 0.0 112.182 -175.717 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 49.1 mt -57.26 -31.85 66.0 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 124.575 1.15 . . . . 0.0 111.705 174.817 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 27.7 m-85 -59.66 -33.54 71.68 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.215 1.006 . . . . 0.0 113.576 171.334 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 20.7 mm100 -82.05 -32.64 30.31 Favored 'General case' 0 N--CA 1.468 0.428 0 C-N-CA 124.483 1.113 . . . . 0.0 111.069 177.472 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 73.4 mt -60.66 -43.13 97.98 Favored 'General case' 0 CA--C 1.542 0.636 0 CA-C-N 118.418 0.554 . . . . 0.0 110.603 167.78 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -65.33 -35.93 82.48 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 123.85 0.86 . . . . 0.0 112.309 174.058 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 21.6 t-20 -63.77 -29.34 70.56 Favored 'General case' 0 CA--C 1.548 0.884 0 O-C-N 120.801 -1.187 . . . . 0.0 113.065 176.964 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 4.9 m-85 -83.01 -0.84 50.74 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 125.074 1.35 . . . . 0.0 113.891 172.349 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 8.1 t . . . . . 0 CA--C 1.54 0.589 0 O-C-N 120.873 -1.142 . . . . 0.0 113.479 175.422 . . . . . . . . 0 0 . 1 . 037 nuclear orig core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 60.9 t-20 . . . . . 0 N--CA 1.468 0.449 0 N-CA-C 109.653 -0.499 . . . . 0.0 109.653 . . . . . . . . . 0 0 . 1 . 037 nuclear orig core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 26.7 mm-40 -150.83 161.37 42.8 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 124.475 1.11 . . . . 0.0 113.207 -160.897 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 85.5 m-70 -80.47 123.79 28.36 Favored 'General case' 0 CA--C 1.542 0.636 0 N-CA-C 108.786 -0.82 . . . . 0.0 108.786 156.944 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 91.1 mt -138.67 127.46 23.6 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 126.133 1.773 . . . . 0.0 108.878 178.368 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 73.5 m -132.41 143.87 50.11 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 124.961 1.304 . . . . 0.0 111.066 -173.566 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 52.78 -123.77 24.85 Favored Glycine 0 N--CA 1.471 0.997 0 C-N-CA 124.907 1.242 . . . . 0.0 113.776 166.302 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 20.3 m -61.25 -33.01 72.81 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 123.958 0.903 . . . . 0.0 112.702 -179.063 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 99.5 m-70 -73.52 -35.46 65.58 Favored 'General case' 0 CA--C 1.54 0.568 0 O-C-N 121.196 -0.94 . . . . 0.0 111.81 176.65 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 56.5 tp -64.5 -46.97 80.7 Favored 'General case' 0 N--CA 1.466 0.326 0 C-N-CA 123.332 0.653 . . . . 0.0 110.706 170.509 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 76.5 t -60.77 -41.15 87.36 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 C-N-CA 123.296 0.638 . . . . 0.0 111.515 176.063 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 42.9 tt0 -63.34 -48.34 78.39 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 123.575 0.75 . . . . 0.0 111.434 177.253 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.12 -45.75 92.1 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 123.069 0.548 . . . . 0.0 111.887 177.923 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 37.2 tp -60.43 -43.68 96.53 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 125.056 1.343 . . . . 0.0 111.436 178.454 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 68.8 t80 -64.76 -34.05 77.42 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 124.079 0.952 . . . . 0.0 113.328 172.381 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 65.8 mt -74.13 -31.93 62.96 Favored 'General case' 0 N--CA 1.472 0.626 0 O-C-N 121.044 -1.035 . . . . 0.0 113.142 176.317 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 79.4 t -72.96 -44.03 58.12 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.039 0 CA-C-N 118.367 0.531 . . . . 0.0 111.135 172.6 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -148.27 11.05 0.9 Allowed 'General case' 0 N--CA 1.473 0.705 0 N-CA-C 117.065 2.246 . . . . 0.0 117.065 -161.744 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . -63.76 -23.83 67.62 Favored Glycine 0 N--CA 1.476 1.317 0 O-C-N 120.803 -1.186 . . . . 0.0 115.46 -171.86 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -73.96 -22.51 59.62 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-N 118.255 1.028 . . . . 0.0 113.755 173.436 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 29.4 mtp180 -94.09 -37.08 11.8 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 125.486 1.514 . . . . 0.0 111.835 172.99 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 94.13 142.15 11.98 Favored Glycine 0 CA--C 1.527 0.844 0 C-N-CA 126.051 1.786 . . . . 0.0 112.851 176.707 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 25.9 p90 -127.13 159.76 33.26 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 125.115 1.366 . . . . 0.0 114.221 -166.909 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 40.3 t80 . . . . . 0 CA--C 1.542 0.646 0 C-N-CA 126.024 1.73 . . . . 0.0 110.555 164.523 . . . . . . . . 0 0 . 1 . 038 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 20.4 t . . . . . 0 N--CA 1.484 1.262 0 N-CA-C 110.746 -0.094 . . . . 0.0 110.746 . . . . . . . . . 0 0 . 1 . 038 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -71.6 -13.96 61.93 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 123.653 0.781 . . . . 0.0 112.796 -178.476 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 53.6 tp60 -85.63 -77.69 0.29 Allowed 'General case' 0 C--O 1.226 -0.176 0 N-CA-C 108.082 -1.081 . . . . 0.0 108.082 156.193 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 64.3 m -55.3 -27.1 44.55 Favored 'General case' 0 N--CA 1.472 0.66 0 N-CA-C 115.794 1.776 . . . . 0.0 115.794 -159.844 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 11.0 t -90.78 -23.34 20.67 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 123.929 0.891 . . . . 0.0 112.565 -176.84 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 32.3 m -107.11 -28.15 10.16 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 126.702 2.001 . . . . 0.0 112.224 -175.029 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 16.1 t -147.89 168.46 22.17 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 126.094 1.758 . . . . 0.0 110.36 172.222 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 34.6 pt -68.65 150.16 10.9 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.708 0 O-C-N 120.379 -1.451 . . . . 0.0 113.569 -170.582 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 14.8 p -147.31 163.06 37.61 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 124.783 1.233 . . . . 0.0 112.334 174.384 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 48.7 m -120.08 155.05 33.76 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 124.082 0.953 . . . . 0.0 113.089 -171.366 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 46.8 mt -60.99 -33.52 73.37 Favored 'General case' 0 N--CA 1.471 0.594 0 O-C-N 121.256 -0.903 . . . . 0.0 112.137 177.361 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 83.7 t80 -62.44 -27.0 68.81 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 124.09 0.956 . . . . 0.0 113.519 172.643 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 91.6 mt-30 -81.12 -40.61 23.78 Favored 'General case' 0 N--CA 1.467 0.396 0 C-N-CA 124.132 0.973 . . . . 0.0 110.395 172.517 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 41.8 mt -57.72 -33.32 68.3 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-N 118.921 0.782 . . . . 0.0 112.499 174.19 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 8.4 tm-20 -56.3 -34.7 66.74 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 125.086 1.354 . . . . 0.0 113.003 176.332 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 25.1 t30 -63.34 -34.27 77.33 Favored 'General case' 0 CA--C 1.543 0.711 0 O-C-N 121.203 -0.936 . . . . 0.0 112.256 175.443 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 74.5 m-85 -88.57 2.13 53.63 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 125.849 1.659 . . . . 0.0 113.762 -178.129 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 82.5 m . . . . . 0 CA--C 1.543 0.686 0 C-N-CA 126.146 1.778 . . . . 0.0 113.051 168.227 . . . . . . . . 0 0 . 1 . 038 nuclear orig core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 24.8 t-20 . . . . . 0 CA--C 1.54 0.562 0 CA-C-O 120.38 0.133 . . . . 0.0 110.74 . . . . . . . . . 0 0 . 1 . 038 nuclear orig core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 48.5 mm-40 -156.32 167.41 30.53 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 124.771 1.228 . . . . 0.0 112.15 -167.554 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 16.8 m170 -84.78 138.43 32.6 Favored 'General case' 0 CA--C 1.542 0.636 0 N-CA-C 109.329 -0.619 . . . . 0.0 109.329 150.226 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 72.1 mt -146.41 136.44 23.5 Favored 'General case' 0 N--CA 1.465 0.314 0 C-N-CA 125.067 1.347 . . . . 0.0 109.455 -175.476 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 3.0 t -154.64 153.44 31.36 Favored 'General case' 0 N--CA 1.466 0.327 0 C-N-CA 123.502 0.721 . . . . 0.0 111.451 -176.117 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 47.76 -124.79 10.59 Favored Glycine 0 CA--C 1.529 0.928 0 C-N-CA 125.19 1.376 . . . . 0.0 113.772 176.82 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 24.3 p -60.35 -33.93 73.13 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 125.028 1.331 . . . . 0.0 113.197 179.301 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 98.2 m-70 -70.12 -39.27 75.56 Favored 'General case' 0 CA--C 1.542 0.646 0 O-C-N 121.204 -0.935 . . . . 0.0 111.583 177.025 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 63.5 tp -65.96 -45.14 82.83 Favored 'General case' 0 N--CA 1.471 0.604 0 O-C-N 121.616 -0.678 . . . . 0.0 110.869 172.735 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 24.7 t -59.59 -39.68 80.1 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.936 0 C-N-CA 124.187 0.995 . . . . 0.0 111.806 176.238 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -67.84 -46.61 71.31 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 123.879 0.872 . . . . 0.0 111.601 175.074 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.87 -46.2 90.04 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.158 0.583 . . . . 0.0 111.602 178.2 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 30.6 mt -54.74 -59.2 5.04 Favored 'General case' 0 N--CA 1.466 0.357 0 C-N-CA 124.099 0.96 . . . . 0.0 110.255 171.472 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 69.6 t80 -51.85 -38.71 57.01 Favored 'General case' 0 CA--C 1.543 0.707 0 CA-C-N 119.443 1.02 . . . . 0.0 113.234 -179.495 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 86.7 mt -72.71 -32.2 65.57 Favored 'General case' 0 N--CA 1.471 0.593 0 N-CA-C 113.914 1.079 . . . . 0.0 113.914 177.732 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 68.0 t -78.07 -38.06 23.61 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.01 0 C-N-CA 123.922 0.889 . . . . 0.0 111.316 174.384 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 44.1 m -89.48 -33.43 16.79 Favored 'General case' 0 N--CA 1.466 0.348 0 N-CA-C 114.28 1.215 . . . . 0.0 114.28 -170.633 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 60.79 -131.93 49.15 Favored Glycine 0 CA--C 1.533 1.192 0 N-CA-C 111.391 -0.684 . . . . 0.0 111.391 -172.18 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -72.46 -7.75 51.48 Favored 'General case' 0 CA--C 1.546 0.826 0 N-CA-C 114.364 1.246 . . . . 0.0 114.364 -179.311 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 68.8 mtp180 -62.95 -26.85 69.02 Favored 'General case' 0 N--CA 1.476 0.875 0 CA-C-N 119.336 0.971 . . . . 0.0 113.414 177.938 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 75.38 173.62 33.67 Favored Glycine 0 CA--C 1.531 1.075 0 C-N-CA 124.419 1.009 . . . . 0.0 112.192 -168.629 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 35.6 p90 -150.12 157.73 43.42 Favored 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 114.789 1.403 . . . . 0.0 114.789 -171.619 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 89.5 t80 . . . . . 0 CA--C 1.541 0.634 0 C-N-CA 126.321 1.848 . . . . 0.0 109.617 171.306 . . . . . . . . 0 0 . 1 . 039 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 38.2 t . . . . . 0 N--CA 1.481 1.113 0 CA-C-O 119.069 -0.491 . . . . 0.0 111.535 . . . . . . . . . 0 0 . 1 . 039 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -71.45 -47.39 56.05 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-N 119.169 0.895 . . . . 0.0 110.491 173.906 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 65.3 tp60 -56.84 -46.24 81.84 Favored 'General case' 0 N--CA 1.467 0.393 0 C-N-CA 123.698 0.799 . . . . 0.0 111.963 179.347 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -82.85 -17.11 45.05 Favored 'General case' 0 N--CA 1.469 0.487 0 N-CA-C 114.477 1.288 . . . . 0.0 114.477 -175.056 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 29.3 t -102.89 -43.92 5.4 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 123.986 0.915 . . . . 0.0 112.807 -175.983 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 61.7 m -85.63 -37.17 19.79 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 125.476 1.511 . . . . 0.0 111.118 178.89 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 18.1 t -110.69 -149.55 0.45 Allowed 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 124.15 0.98 . . . . 0.0 109.366 160.944 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 11.9 tt -116.86 157.45 17.81 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.932 0 C-N-CA 126.099 1.759 . . . . 0.0 111.258 177.828 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 1.6 p -143.72 -171.75 3.59 Favored 'General case' 0 N--CA 1.476 0.865 0 O-C-N 121.237 -0.914 . . . . 0.0 111.719 167.663 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 59.5 p -131.72 168.93 16.93 Favored 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 124.478 1.111 . . . . 0.0 112.573 177.534 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 32.9 mt -61.41 -31.65 71.58 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 123.374 0.669 . . . . 0.0 112.103 174.164 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 87.0 t80 -65.1 -33.01 75.01 Favored 'General case' 0 CA--C 1.54 0.569 0 N-CA-C 112.946 0.721 . . . . 0.0 112.946 171.827 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 19.7 mm100 -75.83 -28.02 58.1 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-O 118.699 -0.667 . . . . 0.0 112.274 172.571 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 53.3 mt -68.9 -40.26 79.28 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-N 119.412 1.005 . . . . 0.0 111.639 168.579 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -58.49 -24.72 61.16 Favored 'General case' 0 CA--C 1.547 0.84 0 N-CA-C 113.428 0.899 . . . . 0.0 113.428 -177.414 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 25.0 t30 -54.83 -26.0 32.2 Favored 'General case' 0 CA--C 1.551 0.989 0 C-N-CA 124.567 1.147 . . . . 0.0 113.844 171.727 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 98.6 m-85 -101.83 4.31 40.2 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 126.051 1.74 . . . . 0.0 114.021 -175.468 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 61.2 m . . . . . 0 CA--C 1.543 0.674 0 O-C-N 121.352 -0.843 . . . . 0.0 111.59 166.384 . . . . . . . . 0 0 . 1 . 039 nuclear orig core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 11.5 m120 . . . . . 0 CA--C 1.533 0.322 0 CA-C-O 120.954 0.407 . . . . 0.0 111.229 . . . . . . . . . 0 0 . 1 . 039 nuclear orig core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 38.2 mt-30 -152.43 154.11 34.91 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 124.948 1.299 . . . . 0.0 110.332 -173.066 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 95.1 m-70 -87.89 123.37 32.57 Favored 'General case' 0 CA--C 1.54 0.57 0 N-CA-C 108.372 -0.973 . . . . 0.0 108.372 162.572 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 72.1 mt -140.75 142.57 34.75 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 125.541 1.536 . . . . 0.0 108.397 -171.621 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -149.15 150.91 33.45 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 123.486 0.715 . . . . 0.0 112.25 -173.609 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 43.95 -125.06 5.41 Favored Glycine 0 N--CA 1.473 1.129 0 C-N-CA 125.754 1.645 . . . . 0.0 114.316 172.427 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 20.1 m -62.13 -31.13 71.56 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 124.653 1.181 . . . . 0.0 112.803 -178.06 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 97.7 m-70 -72.38 -37.1 68.83 Favored 'General case' 0 CA--C 1.539 0.546 0 O-C-N 121.037 -1.039 . . . . 0.0 111.463 177.308 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 8.8 tt -66.27 -44.72 82.83 Favored 'General case' 0 C--N 1.344 0.346 0 O-C-N 121.719 -0.613 . . . . 0.0 110.974 169.941 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 53.9 t -61.75 -36.72 75.33 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.986 0 C-N-CA 123.212 0.605 . . . . 0.0 111.782 177.836 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -65.8 -48.47 71.62 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 123.905 0.882 . . . . 0.0 111.739 172.107 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.8 -44.07 94.15 Favored 'General case' 0 CA--C 1.543 0.678 0 O-C-N 121.633 -0.667 . . . . 0.0 111.704 176.77 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 52.3 tp -58.28 -50.94 71.83 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 125.885 1.674 . . . . 0.0 111.005 176.122 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 52.8 t80 -54.76 -42.21 71.4 Favored 'General case' 0 CA--C 1.541 0.634 0 N-CA-C 113.009 0.744 . . . . 0.0 113.009 173.434 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 89.5 mt -74.04 -33.36 63.7 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 123.925 0.89 . . . . 0.0 113.348 179.957 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 24.4 t -65.11 -47.18 88.74 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.819 0 C-N-CA 124.864 1.266 . . . . 0.0 110.361 171.457 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 84.7 m -75.74 -36.27 59.95 Favored 'General case' 0 N--CA 1.469 0.482 0 N-CA-C 112.753 0.649 . . . . 0.0 112.753 -176.436 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 62.81 -134.35 43.92 Favored Glycine 0 CA--C 1.529 0.927 0 C-N-CA 124.384 0.992 . . . . 0.0 111.412 -178.195 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -61.13 -18.4 57.86 Favored 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 114.681 1.363 . . . . 0.0 114.681 178.714 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 86.0 mtm180 -65.2 -30.45 71.35 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 124.117 0.967 . . . . 0.0 113.212 179.815 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 77.73 177.82 47.56 Favored Glycine 0 CA--C 1.533 1.212 0 C-N-CA 124.507 1.051 . . . . 0.0 112.888 -173.221 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 33.3 p90 -158.55 168.26 27.39 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 124.641 1.176 . . . . 0.0 112.64 -172.134 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 92.0 t80 . . . . . 0 CA--C 1.537 0.454 0 C-N-CA 124.389 1.076 . . . . 0.0 111.83 164.085 . . . . . . . . 0 0 . 1 . 040 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 83.7 t . . . . . 0 N--CA 1.483 1.211 0 CA-C-O 119.388 -0.339 . . . . 0.0 110.412 . . . . . . . . . 0 0 . 1 . 040 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 14.9 pt-20 -61.98 -36.29 81.04 Favored 'General case' 0 CA--C 1.543 0.695 0 CA-C-N 118.722 0.692 . . . . 0.0 112.296 172.566 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 28.5 tt0 -74.0 -43.92 56.37 Favored 'General case' 0 C--O 1.225 -0.223 0 C-N-CA 123.534 0.734 . . . . 0.0 110.365 -179.704 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 92.6 m -72.27 -36.3 68.97 Favored 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 113.746 1.017 . . . . 0.0 113.746 179.098 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 15.8 t -93.46 -45.61 7.69 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 123.601 0.76 . . . . 0.0 112.826 -168.447 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 25.1 m -91.47 -38.33 12.62 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 124.747 1.219 . . . . 0.0 111.488 -177.298 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.7 t -105.09 -152.32 0.46 Allowed 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 124.493 1.117 . . . . 0.0 111.393 171.221 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 24.1 mt -109.87 140.38 29.04 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.791 0 C-N-CA 126.002 1.721 . . . . 0.0 110.092 168.817 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 9.7 p -124.39 -172.9 2.65 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.74 1.216 . . . . 0.0 111.129 167.366 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 8.4 t -148.8 166.66 27.8 Favored 'General case' 0 N--CA 1.469 0.503 0 O-C-N 120.655 -1.278 . . . . 0.0 111.898 179.264 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 34.0 mt -59.86 -33.49 71.88 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 124.628 1.171 . . . . 0.0 112.143 -178.234 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 86.6 t80 -61.42 -29.91 70.23 Favored 'General case' 0 CA--C 1.546 0.792 0 N-CA-C 113.565 0.95 . . . . 0.0 113.565 171.908 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 54.0 mm-40 -80.16 -36.47 35.08 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 123.343 0.657 . . . . 0.0 110.522 174.503 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 32.5 mt -62.27 -37.86 87.09 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 118.523 0.601 . . . . 0.0 111.52 172.193 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -61.31 -32.1 71.96 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 124.878 1.271 . . . . 0.0 112.903 179.004 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 24.1 t30 -62.5 -24.24 67.37 Favored 'General case' 0 CA--C 1.548 0.901 0 O-C-N 121.405 -0.809 . . . . 0.0 112.794 176.424 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 38.8 m-85 -95.51 1.59 54.01 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 125.584 1.553 . . . . 0.0 114.475 179.785 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 70.2 m . . . . . 0 CA--C 1.544 0.74 0 O-C-N 121.002 -1.061 . . . . 0.0 113.234 173.294 . . . . . . . . 0 0 . 1 . 040 nuclear orig core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 10.0 p30 . . . . . 0 CA--C 1.543 0.681 0 CA-C-O 121.007 0.432 . . . . 0.0 110.498 . . . . . . . . . 0 0 . 1 . 040 nuclear orig core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 30.5 mt-30 -148.3 165.82 29.87 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 124.043 0.937 . . . . 0.0 112.374 -158.888 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 93.8 m-70 -82.37 134.36 35.25 Favored 'General case' 0 CA--C 1.545 0.752 0 N-CA-C 108.968 -0.753 . . . . 0.0 108.968 157.592 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 76.4 mt -147.54 133.92 19.63 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 125.735 1.614 . . . . 0.0 108.619 -177.649 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 3.7 t -158.42 153.17 24.84 Favored 'General case' 0 N--CA 1.469 0.492 0 O-C-N 121.428 -0.795 . . . . 0.0 112.225 -177.38 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 61.01 -134.4 49.11 Favored Glycine 0 CA--C 1.53 0.992 0 C-N-CA 124.719 1.152 . . . . 0.0 113.139 179.171 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 20.3 m -60.9 -30.92 70.46 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 124.467 1.107 . . . . 0.0 112.029 -178.43 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 13.5 m80 -66.52 -41.82 88.19 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 124.543 1.137 . . . . 0.0 111.541 178.046 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 48.8 tp -69.46 -42.7 74.54 Favored 'General case' 0 N--CA 1.466 0.336 0 C-N-CA 124.284 1.033 . . . . 0.0 111.359 174.585 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 48.1 t -60.32 -41.07 85.82 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.038 0 C-N-CA 123.635 0.774 . . . . 0.0 111.349 175.458 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -66.61 -45.17 80.01 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 124.065 0.946 . . . . 0.0 111.829 174.399 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.99 -45.68 91.92 Favored 'General case' 0 CA--C 1.54 0.582 0 O-C-N 121.656 -0.652 . . . . 0.0 112.129 178.096 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 17.6 mt -54.74 -54.19 45.22 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 124.493 1.117 . . . . 0.0 110.974 172.795 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 77.8 t80 -55.45 -41.66 73.19 Favored 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 113.196 0.813 . . . . 0.0 113.196 177.177 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 85.4 mt -73.22 -35.76 66.35 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 123.9 0.88 . . . . 0.0 113.127 179.839 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 43.6 t -67.89 -42.47 85.76 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.845 0 C-N-CA 123.525 0.73 . . . . 0.0 110.903 173.842 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 82.7 m -80.75 -27.28 36.85 Favored 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 113.483 0.92 . . . . 0.0 113.483 -175.658 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 65.65 -111.96 4.59 Favored Glycine 0 CA--C 1.53 0.996 0 C-N-CA 124.298 0.951 . . . . 0.0 111.908 173.565 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -75.47 -18.91 59.72 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 124.395 1.078 . . . . 0.0 113.074 176.131 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 95.6 mtt-85 -76.9 158.16 30.9 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 124.059 0.943 . . . . 0.0 111.678 173.16 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . -74.46 179.37 43.43 Favored Glycine 0 CA--C 1.531 1.058 0 C-N-CA 123.839 0.733 . . . . 0.0 111.668 168.768 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 42.1 p90 -153.73 169.54 23.07 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.542 1.137 . . . . 0.0 112.473 -178.247 . . . . . . . . 1 1 . 1 . 040 nuclear orig core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 63.6 t80 . . . . . 0 CA--C 1.54 0.595 0 C-N-CA 124.828 1.251 . . . . 0.0 111.983 179.406 . . . . . . . . 0 0 . 1 . 041 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 85.5 t . . . . . 0 N--CA 1.48 1.048 0 CA-C-O 118.922 -0.561 . . . . 0.0 112.048 . . . . . . . . . 0 0 . 1 . 041 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -59.75 -35.45 74.61 Favored 'General case' 0 N--CA 1.474 0.755 0 CA-C-N 118.958 0.799 . . . . 0.0 112.573 -178.546 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 28.7 tp60 -71.44 -32.8 68.76 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-O 118.663 -0.684 . . . . 0.0 112.02 -178.536 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -95.23 -22.0 18.1 Favored 'General case' 0 CA--C 1.539 0.557 0 N-CA-C 114.161 1.171 . . . . 0.0 114.161 177.172 . . . . . . . . 2 2 . 1 . 041 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 51.1 t -100.52 -56.08 2.43 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 124.764 1.226 . . . . 0.0 112.983 -172.976 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 26.8 m -81.06 -47.35 13.68 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 124.635 1.174 . . . . 0.0 109.894 -178.245 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 13.7 t -84.83 -158.35 0.35 Allowed 'General case' 0 CA--C 1.552 1.035 0 C-N-CA 123.045 0.538 . . . . 0.0 110.283 155.791 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 29.8 pt -128.82 150.4 34.44 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.552 0 C-N-CA 125.181 1.392 . . . . 0.0 111.974 178.842 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -145.12 166.56 25.04 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 123.962 0.905 . . . . 0.0 112.099 170.546 . . . . . . . . 2 2 . 1 . 041 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 3.4 t -118.52 167.11 11.92 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 124.064 0.946 . . . . 0.0 112.703 -173.943 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 47.7 mt -58.02 -35.65 71.58 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 124.713 1.205 . . . . 0.0 111.946 179.959 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 75.2 m-85 -62.06 -30.78 71.22 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 124.463 1.105 . . . . 0.0 113.543 173.287 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 17.6 mm100 -82.96 -33.68 26.63 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 124.328 1.051 . . . . 0.0 110.951 174.57 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 48.4 mt -62.51 -36.33 82.22 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 119.238 0.927 . . . . 0.0 111.418 170.988 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 25.5 tt0 -63.17 -27.75 69.58 Favored 'General case' 0 CA--C 1.544 0.726 0 N-CA-C 113.331 0.863 . . . . 0.0 113.331 178.894 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 30.8 t30 -59.59 -25.65 64.78 Favored 'General case' 0 CA--C 1.547 0.856 0 O-C-N 121.264 -0.897 . . . . 0.0 113.181 174.423 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 59.3 m-85 -94.55 -0.31 54.66 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 125.282 1.433 . . . . 0.0 114.117 -178.728 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 81.2 m . . . . . 0 CA--C 1.544 0.747 0 CA-C-N 119.076 0.853 . . . . 0.0 113.183 175.338 . . . . . . . . 0 0 . 1 . 041 nuclear orig core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 40.8 m-80 . . . . . 0 CA--C 1.541 0.598 0 N-CA-C 113.638 0.977 . . . . 0.0 113.638 . . . . . . . . . 0 0 . 1 . 041 nuclear orig core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 53.8 mm-40 -140.55 166.55 24.43 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 125.804 1.642 . . . . 0.0 110.442 -179.096 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 92.2 m-70 -84.96 116.7 23.52 Favored 'General case' 0 CA--C 1.541 0.628 0 N-CA-C 108.655 -0.869 . . . . 0.0 108.655 164.219 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 91.8 mt -132.35 126.33 33.0 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 125.743 1.617 . . . . 0.0 108.507 179.169 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 77.7 m -132.2 144.21 50.49 Favored 'General case' 0 N--CA 1.465 0.29 0 C-N-CA 124.839 1.255 . . . . 0.0 111.76 -168.01 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 53.04 -124.7 28.71 Favored Glycine 0 CA--C 1.531 1.081 0 C-N-CA 125.307 1.432 . . . . 0.0 114.271 164.647 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 22.2 p -56.85 -41.39 77.84 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 124.726 1.21 . . . . 0.0 112.238 176.968 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 19.3 m-70 -69.57 -29.89 67.54 Favored 'General case' 0 CA--C 1.541 0.628 0 O-C-N 120.613 -1.305 . . . . 0.0 112.712 177.946 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 48.0 tp -69.06 -43.06 75.4 Favored 'General case' 0 N--CA 1.47 0.564 0 O-C-N 121.544 -0.723 . . . . 0.0 111.275 169.559 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 52.1 t -60.57 -41.33 87.5 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.99 0 C-N-CA 123.927 0.891 . . . . 0.0 111.67 173.535 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -63.7 -46.5 85.17 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 124.372 1.069 . . . . 0.0 111.527 173.58 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.12 -45.06 96.22 Favored 'General case' 0 CA--C 1.544 0.734 0 CA-C-N 118.761 0.71 . . . . 0.0 111.923 178.872 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 22.2 mt -55.33 -54.36 44.54 Favored 'General case' 0 N--CA 1.467 0.416 0 C-N-CA 124.186 0.995 . . . . 0.0 111.056 173.018 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 71.1 t80 -55.61 -42.28 74.66 Favored 'General case' 0 N--CA 1.47 0.544 0 N-CA-C 113.007 0.743 . . . . 0.0 113.007 177.48 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 84.9 mt -74.88 -33.38 62.06 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 124.127 0.971 . . . . 0.0 113.341 -178.6 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 37.7 t -69.26 -44.02 80.86 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.849 0 C-N-CA 123.974 0.909 . . . . 0.0 110.684 172.498 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 72.9 m -76.79 -33.51 58.03 Favored 'General case' 0 CA--C 1.538 0.508 0 N-CA-C 113.074 0.768 . . . . 0.0 113.074 -175.936 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 68.89 -111.68 4.1 Favored Glycine 0 CA--C 1.529 0.91 0 C-N-CA 124.662 1.125 . . . . 0.0 112.044 172.166 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -69.12 -27.14 65.3 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 124.171 0.988 . . . . 0.0 112.131 173.975 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 82.8 mtm180 -72.91 153.99 40.76 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 124.803 1.241 . . . . 0.0 110.758 175.988 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . -76.22 -174.83 38.54 Favored Glycine 0 N--CA 1.474 1.175 0 C-N-CA 123.915 0.769 . . . . 0.0 111.581 168.423 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 52.5 p90 -152.46 148.09 27.01 Favored 'General case' 0 CA--C 1.536 0.442 0 N-CA-C 113.287 0.847 . . . . 0.0 113.287 179.234 . . . . . . . . 1 1 . 1 . 041 nuclear orig core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 90.7 t80 . . . . . 0 CA--C 1.538 0.493 0 C-N-CA 125.787 1.635 . . . . 0.0 110.671 169.664 . . . . . . . . 0 0 . 1 . 042 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 53.0 t . . . . . 0 N--CA 1.481 1.121 0 N-CA-C 111.6 0.222 . . . . 0.0 111.6 . . . . . . . . . 0 0 . 1 . 042 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 44.2 mm-40 -79.14 -56.73 4.15 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-O 118.969 -0.539 . . . . 0.0 110.518 168.609 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 23.8 tt0 -61.58 -40.91 96.44 Favored 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 113.865 1.061 . . . . 0.0 113.865 -166.692 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 25.7 m -69.49 -21.69 63.67 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 119.204 0.911 . . . . 0.0 112.766 175.948 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 13.2 t -88.12 -41.52 12.98 Favored 'General case' 0 CA--C 1.538 0.513 0 O-C-N 121.393 -0.817 . . . . 0.0 111.617 179.814 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 72.7 p -82.29 -18.17 43.27 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 125.243 1.417 . . . . 0.0 114.034 179.668 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 71.3 p -148.36 172.42 14.44 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 124.919 1.288 . . . . 0.0 111.905 -179.485 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 64.9 mt -73.9 129.03 36.59 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.679 0 O-C-N 121.238 -0.914 . . . . 0.0 109.774 174.549 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 17.3 p -123.49 159.77 28.36 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 124.866 1.267 . . . . 0.0 111.727 169.629 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 18.8 m -108.97 153.52 23.46 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 124.3 1.04 . . . . 0.0 111.276 -171.667 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 36.6 mt -60.69 -31.15 70.41 Favored 'General case' 0 N--CA 1.472 0.629 0 O-C-N 120.907 -1.121 . . . . 0.0 112.357 179.678 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 86.9 m-85 -64.59 -25.89 68.17 Favored 'General case' 0 CA--C 1.543 0.711 0 N-CA-C 114.096 1.147 . . . . 0.0 114.096 171.684 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 57.5 mm-40 -88.41 -25.93 22.42 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 124.752 1.221 . . . . 0.0 111.38 175.136 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 9.2 mp -62.42 -49.27 76.15 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 119.467 1.03 . . . . 0.0 110.588 162.993 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 37.5 tt0 -59.55 -28.45 67.12 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 124.679 1.191 . . . . 0.0 113.411 -179.874 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 26.2 t30 -54.33 -30.99 53.22 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 124.582 1.153 . . . . 0.0 113.889 179.321 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 99.4 m-85 -95.95 0.44 51.85 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 124.989 1.316 . . . . 0.0 113.865 -177.88 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 83.0 m . . . . . 0 CA--C 1.542 0.638 0 C-N-CA 124.594 1.158 . . . . 0.0 113.655 174.959 . . . . . . . . 0 0 . 1 . 042 nuclear orig core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 51.7 p-10 . . . . . 0 CA--C 1.543 0.677 0 CA-C-O 120.872 0.368 . . . . 0.0 111.328 . . . . . . . . . 0 0 . 1 . 042 nuclear orig core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 42.5 mt-30 -152.3 164.93 36.44 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 124.46 1.104 . . . . 0.0 111.937 -162.946 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 21.9 m-70 -84.79 135.25 34.19 Favored 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 108.758 -0.831 . . . . 0.0 108.758 153.607 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 81.5 mt -145.09 125.16 13.61 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 126.302 1.841 . . . . 0.0 109.465 -177.671 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 58.1 m -124.74 138.1 54.3 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 125.097 1.359 . . . . 0.0 110.489 -178.141 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 51.05 -117.25 5.27 Favored Glycine 0 N--CA 1.474 1.173 0 C-N-CA 125.091 1.329 . . . . 0.0 113.947 167.352 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 19.9 m -59.84 -32.94 71.14 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 124.495 1.118 . . . . 0.0 112.786 -178.066 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 96.2 m-70 -71.25 -38.66 71.9 Favored 'General case' 0 CA--C 1.539 0.535 0 O-C-N 121.253 -0.904 . . . . 0.0 111.42 176.418 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 56.5 tp -66.68 -42.95 85.7 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 123.508 0.723 . . . . 0.0 111.241 172.913 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 42.5 t -60.61 -43.26 94.32 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.916 0 C-N-CA 124.018 0.927 . . . . 0.0 111.699 175.061 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -64.28 -45.39 88.23 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 123.74 0.816 . . . . 0.0 111.425 175.5 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.46 -46.18 91.15 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 123.068 0.547 . . . . 0.0 112.034 177.309 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 28.7 mt -56.66 -48.38 77.7 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 124.091 0.956 . . . . 0.0 111.444 175.559 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 61.9 t80 -56.84 -41.13 77.33 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 123.773 0.829 . . . . 0.0 113.095 174.774 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 90.8 mt -78.02 -35.03 50.32 Favored 'General case' 0 N--CA 1.47 0.554 0 N-CA-C 113.426 0.898 . . . . 0.0 113.426 -179.455 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 40.8 t -67.23 -44.89 87.31 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 C-N-CA 124.645 1.178 . . . . 0.0 110.415 175.94 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 74.3 m -95.34 -25.84 16.14 Favored 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 113.628 0.973 . . . . 0.0 113.628 -170.758 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 63.08 -109.37 2.67 Favored Glycine 0 CA--C 1.531 1.052 0 C-N-CA 124.361 0.982 . . . . 0.0 112.72 168.509 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 39.1 mm-40 -69.8 -24.93 63.56 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 124.418 1.087 . . . . 0.0 112.86 175.818 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 96.0 mtt-85 -77.48 141.31 39.75 Favored 'General case' 0 N--CA 1.467 0.382 0 C-N-CA 124.046 0.938 . . . . 0.0 110.617 172.768 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . -74.0 152.48 45.58 Favored Glycine 0 N--CA 1.469 0.843 0 C-N-CA 124.652 1.12 . . . . 0.0 111.6 175.192 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 45.3 p90 -131.02 166.2 21.53 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 124.867 1.267 . . . . 0.0 112.508 -173.967 . . . . . . . . 1 1 . 1 . 042 nuclear orig core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 50.3 t80 . . . . . 0 CA--C 1.535 0.389 0 C-N-CA 124.215 1.006 . . . . 0.0 111.557 170.441 . . . . . . . . 0 0 . 1 . 043 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 93.4 t . . . . . 0 N--CA 1.483 1.217 0 N-CA-C 111.996 0.369 . . . . 0.0 111.996 . . . . . . . . . 0 0 . 1 . 043 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 33.4 mm-40 -89.38 -54.74 3.95 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 123.149 0.579 . . . . 0.0 110.093 169.034 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 64.4 tt0 -62.75 -44.19 96.83 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 124.77 1.228 . . . . 0.0 112.865 -168.511 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 2.7 t -81.16 -12.43 59.21 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-N 118.847 0.749 . . . . 0.0 112.777 -179.658 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 13.6 t -89.12 -40.04 13.2 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 124.227 1.011 . . . . 0.0 111.684 178.034 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 2.4 t -89.98 -36.15 15.13 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 124.813 1.245 . . . . 0.0 112.804 178.001 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 14.3 t -120.56 -149.95 0.44 Allowed 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 126.034 1.733 . . . . 0.0 109.42 172.349 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 47.7 pt -113.09 159.84 12.89 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.704 0 C-N-CA 125.099 1.36 . . . . 0.0 112.338 179.924 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 17.0 p -142.03 163.02 34.02 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 124.758 1.223 . . . . 0.0 112.166 167.194 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 13.8 m -104.93 152.48 22.61 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 125.056 1.342 . . . . 0.0 111.363 -176.052 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 33.9 mt -60.21 -34.4 73.59 Favored 'General case' 0 N--CA 1.47 0.526 0 O-C-N 120.999 -1.063 . . . . 0.0 111.549 176.42 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 85.4 t80 -60.06 -32.55 71.04 Favored 'General case' 0 CA--C 1.547 0.834 0 N-CA-C 113.213 0.82 . . . . 0.0 113.213 172.658 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 84.4 mt-30 -77.17 -36.75 54.85 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 123.773 0.829 . . . . 0.0 110.767 175.762 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 57.3 mt -60.93 -40.74 94.39 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-N 118.538 0.608 . . . . 0.0 111.729 170.416 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -62.31 -39.15 92.07 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 124.534 1.134 . . . . 0.0 112.03 175.076 . . . . . . . . 2 2 . 1 . 043 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 31.3 t30 -63.41 -26.22 68.64 Favored 'General case' 0 CA--C 1.549 0.918 0 N-CA-C 113.363 0.875 . . . . 0.0 113.363 178.091 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 7.7 m-85 -77.5 -12.39 59.96 Favored 'General case' 0 CA--C 1.545 0.775 0 N-CA-C 114.247 1.203 . . . . 0.0 114.247 173.629 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 74.0 m . . . . . 0 CA--C 1.544 0.746 0 N-CA-C 114.181 1.178 . . . . 0.0 114.181 -178.102 . . . . . . . . 0 0 . 1 . 043 nuclear orig core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.541 0.618 0 N-CA-C 111.768 0.285 . . . . 0.0 111.768 . . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 42.4 mt-30 -146.9 165.63 29.18 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 124.301 1.04 . . . . 0.0 111.668 -166.89 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 96.6 m-70 -84.2 134.09 34.57 Favored 'General case' 0 CA--C 1.541 0.61 0 N-CA-C 108.948 -0.76 . . . . 0.0 108.948 156.882 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 92.0 mt -150.31 136.69 18.84 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 125.39 1.476 . . . . 0.0 108.995 -175.715 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 3.7 t -155.53 151.86 28.16 Favored 'General case' 0 N--CA 1.467 0.377 0 C-N-CA 123.294 0.638 . . . . 0.0 112.05 -177.241 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 54.62 -127.95 41.33 Favored Glycine 0 CA--C 1.531 1.06 0 C-N-CA 124.868 1.223 . . . . 0.0 113.338 178.851 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 24.8 m -62.58 -29.67 70.76 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 124.434 1.093 . . . . 0.0 111.988 -178.247 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 16.7 m80 -70.53 -39.39 74.08 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 124.065 0.946 . . . . 0.0 111.247 179.485 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 59.6 tp -67.9 -43.47 79.22 Favored 'General case' 0 N--CA 1.467 0.393 0 C-N-CA 123.998 0.919 . . . . 0.0 111.153 172.866 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 44.8 t -62.4 -39.17 83.3 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.941 0 C-N-CA 123.59 0.756 . . . . 0.0 111.812 176.028 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -66.3 -45.99 78.51 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 124.185 0.994 . . . . 0.0 111.541 173.985 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.0 -48.87 80.04 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 122.917 0.487 . . . . 0.0 111.766 177.109 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 23.4 mt -51.39 -53.27 38.21 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 124.882 1.273 . . . . 0.0 111.627 173.058 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 69.6 t80 -58.12 -42.88 86.72 Favored 'General case' 0 CA--C 1.54 0.592 0 N-CA-C 113.359 0.874 . . . . 0.0 113.359 177.846 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 89.5 mt -75.58 -32.07 60.22 Favored 'General case' 0 N--CA 1.47 0.55 0 N-CA-C 113.119 0.785 . . . . 0.0 113.119 -178.276 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 25.3 t -69.25 -44.42 80.6 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.746 0 C-N-CA 124.526 1.13 . . . . 0.0 110.795 174.175 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 80.9 m -94.74 -24.62 17.03 Favored 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 114.333 1.234 . . . . 0.0 114.333 -169.409 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 61.5 -109.11 2.28 Favored Glycine 0 CA--C 1.53 0.995 0 C-N-CA 124.327 0.965 . . . . 0.0 112.433 174.971 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -73.59 -24.19 60.03 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 124.079 0.951 . . . . 0.0 113.099 177.892 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 38.5 mtp85 -73.05 139.33 46.48 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 123.703 0.801 . . . . 0.0 110.496 172.895 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . -84.23 128.53 8.67 Favored Glycine 0 N--CA 1.467 0.743 0 C-N-CA 124.908 1.242 . . . . 0.0 111.269 -174.393 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 53.1 p90 -90.97 166.05 13.23 Favored 'General case' 0 CA--C 1.536 0.416 0 N-CA-C 113.446 0.906 . . . . 0.0 113.446 -177.73 . . . . . . . . 1 1 . 1 . 043 nuclear orig core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 70.9 t80 . . . . . 0 CA--C 1.536 0.437 0 C-N-CA 124.987 1.315 . . . . 0.0 110.219 174.59 . . . . . . . . 0 0 . 1 . 044 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 93.1 t . . . . . 0 N--CA 1.476 0.852 0 CA-C-O 119.921 -0.085 . . . . 0.0 110.834 . . . . . . . . . 0 0 . 1 . 044 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -64.36 -43.35 94.82 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-O 119.078 -0.487 . . . . 0.0 111.345 177.902 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 42.9 tt0 -61.35 -52.61 63.92 Favored 'General case' 0 CA--C 1.533 0.302 0 CA-C-N 118.633 0.651 . . . . 0.0 111.076 176.56 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 59.7 m -60.08 -32.76 71.26 Favored 'General case' 0 N--CA 1.467 0.38 0 N-CA-C 112.906 0.706 . . . . 0.0 112.906 -176.383 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 68.8 m -76.42 -57.39 3.89 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 123.78 0.832 . . . . 0.0 111.871 176.517 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 69.7 p -81.62 -20.61 39.36 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 124.641 1.176 . . . . 0.0 113.91 -169.168 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 10.5 t -140.86 -162.58 1.38 Allowed 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 126.73 2.012 . . . . 0.0 109.575 177.891 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 38.6 pt -93.88 147.06 5.82 Favored 'Isoleucine or valine' 0 C--O 1.236 0.362 0 O-C-N 120.932 -1.105 . . . . 0.0 112.034 176.492 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 17.2 p -137.87 165.11 27.3 Favored 'General case' 0 N--CA 1.466 0.355 0 C-N-CA 125.06 1.344 . . . . 0.0 110.231 166.747 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 13.5 t -115.96 161.67 18.5 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-O 121.604 0.716 . . . . 0.0 112.419 -179.076 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 53.0 mt -58.89 -33.39 70.45 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 125.009 1.324 . . . . 0.0 111.558 174.772 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 29.0 m-85 -58.79 -33.79 70.75 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 123.788 0.835 . . . . 0.0 113.223 171.304 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 63.4 mm-40 -83.18 -29.37 28.64 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 124.226 1.01 . . . . 0.0 111.327 177.869 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 41.1 mt -64.65 -39.96 94.6 Favored 'General case' 0 N--CA 1.471 0.608 0 CA-C-N 119.148 0.886 . . . . 0.0 111.046 168.593 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 26.9 tt0 -60.84 -27.16 67.87 Favored 'General case' 0 CA--C 1.545 0.751 0 N-CA-C 113.586 0.958 . . . . 0.0 113.586 -179.561 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 21.8 t30 -58.8 -26.29 63.95 Favored 'General case' 0 CA--C 1.548 0.882 0 O-C-N 121.062 -1.024 . . . . 0.0 113.1 173.656 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 89.7 m-85 -100.8 5.95 43.66 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 125.597 1.559 . . . . 0.0 113.967 -178.046 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 63.8 m . . . . . 0 CA--C 1.542 0.66 0 O-C-N 120.999 -1.063 . . . . 0.0 111.995 166.081 . . . . . . . . 0 0 . 1 . 044 nuclear orig core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 8.7 m120 . . . . . 0 CA--C 1.543 0.703 0 N-CA-C 111.696 0.258 . . . . 0.0 111.696 . . . . . . . . . 0 0 . 1 . 044 nuclear orig core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 42.7 mt-30 -150.93 161.12 43.32 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 125.45 1.5 . . . . 0.0 111.031 -178.493 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 37.1 m-70 -80.51 136.54 36.31 Favored 'General case' 0 CA--C 1.544 0.74 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 152.122 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 90.1 mt -150.07 127.17 11.24 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 125.86 1.664 . . . . 0.0 107.727 -172.917 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 4.2 t -152.19 156.64 40.17 Favored 'General case' 0 CA--C 1.535 0.404 0 O-C-N 121.44 -0.787 . . . . 0.0 112.586 -172.375 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 61.47 -138.6 47.11 Favored Glycine 0 CA--C 1.528 0.888 0 C-N-CA 125.002 1.287 . . . . 0.0 112.941 177.386 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 23.8 p -57.01 -39.2 74.28 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 123.915 0.886 . . . . 0.0 112.516 174.996 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 17.2 m-70 -65.12 -29.17 70.01 Favored 'General case' 0 CA--C 1.545 0.763 0 O-C-N 121.131 -0.981 . . . . 0.0 113.364 -179.4 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 55.9 tp -69.49 -41.76 75.69 Favored 'General case' 0 N--CA 1.469 0.476 0 O-C-N 121.476 -0.765 . . . . 0.0 111.527 170.115 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 94.6 t -64.25 -38.7 83.19 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.901 0 C-N-CA 123.098 0.559 . . . . 0.0 110.942 175.976 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 49.7 mt-10 -64.02 -48.08 77.72 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 124.485 1.114 . . . . 0.0 111.421 173.02 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.29 -45.51 93.11 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-N 119.158 0.89 . . . . 0.0 111.752 178.233 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 53.2 tp -57.45 -51.87 67.68 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 124.403 1.081 . . . . 0.0 110.933 175.077 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 54.8 t80 -56.67 -40.59 75.81 Favored 'General case' 0 CA--C 1.539 0.548 0 N-CA-C 113.42 0.896 . . . . 0.0 113.42 175.283 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 76.7 mt -73.04 -32.2 64.92 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 124.088 0.955 . . . . 0.0 112.934 179.641 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 37.1 t -68.41 -45.88 81.51 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.752 0 C-N-CA 123.739 0.816 . . . . 0.0 110.739 171.039 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 85.0 m -75.94 -36.07 59.49 Favored 'General case' 0 CA--C 1.535 0.398 0 N-CA-C 113.389 0.885 . . . . 0.0 113.389 -175.575 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 63.64 -134.56 41.39 Favored Glycine 0 CA--C 1.531 1.069 0 C-N-CA 124.433 1.016 . . . . 0.0 111.632 -176.136 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -62.94 -17.59 62.09 Favored 'General case' 0 CA--C 1.543 0.703 0 N-CA-C 114.741 1.385 . . . . 0.0 114.741 179.06 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 84.0 mtm180 -62.96 -32.0 73.23 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 124.418 1.087 . . . . 0.0 113.344 -179.152 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 80.32 -178.9 53.68 Favored Glycine 0 CA--C 1.532 1.148 0 C-N-CA 124.707 1.146 . . . . 0.0 112.431 -171.358 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 51.7 p90 -156.04 164.77 38.02 Favored 'General case' 0 N--CA 1.469 0.493 0 N-CA-C 113.531 0.937 . . . . 0.0 113.531 -172.506 . . . . . . . . 1 1 . 1 . 044 nuclear orig core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 40.1 t80 . . . . . 0 CA--C 1.538 0.495 0 C-N-CA 126.139 1.776 . . . . 0.0 109.502 174.5 . . . . . . . . 0 0 . 1 . 045 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 73.0 t . . . . . 0 N--CA 1.482 1.126 0 N-CA-C 112.036 0.384 . . . . 0.0 112.036 . . . . . . . . . 0 0 . 1 . 045 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -84.76 -6.05 59.34 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 125.286 1.434 . . . . 0.0 113.907 179.535 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 64.1 tt0 -106.38 -57.24 2.08 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 124.904 1.282 . . . . 0.0 110.099 -178.891 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 89.7 m -66.22 -28.23 68.59 Favored 'General case' 0 N--CA 1.465 0.322 0 C-N-CA 124.881 1.273 . . . . 0.0 113.931 -178.276 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 8.4 t -80.48 -42.91 21.72 Favored 'General case' 0 CA--C 1.541 0.622 0 O-C-N 121.636 -0.665 . . . . 0.0 110.733 178.526 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 20.1 m -77.02 -33.45 57.46 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 127.386 2.274 . . . . 0.0 112.924 -173.763 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.5 t -146.07 -173.62 4.21 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 124.879 1.272 . . . . 0.0 111.142 -179.305 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 65.0 mt -74.28 134.22 29.98 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.58 0 O-C-N 120.613 -1.304 . . . . 0.0 110.256 175.192 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 8.3 p -128.6 173.1 10.57 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 124.86 1.264 . . . . 0.0 111.142 166.103 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 5.7 m -123.58 149.24 45.54 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 123.728 0.811 . . . . 0.0 110.917 -169.938 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 39.8 mt -59.49 -33.07 70.88 Favored 'General case' 0 N--CA 1.471 0.617 0 O-C-N 120.89 -1.131 . . . . 0.0 111.856 173.345 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 79.9 t80 -60.11 -28.24 67.69 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 124.366 1.066 . . . . 0.0 113.612 171.729 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 58.4 mm-40 -84.32 -36.26 22.7 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 124.131 0.973 . . . . 0.0 110.644 174.402 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 49.7 mt -60.33 -30.93 69.83 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-N 119.723 1.147 . . . . 0.0 112.278 172.13 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -59.26 -27.39 65.76 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 124.376 1.07 . . . . 0.0 113.512 176.18 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 33.3 t30 -65.74 -24.24 66.92 Favored 'General case' 0 CA--C 1.55 0.945 0 O-C-N 121.1 -1.0 . . . . 0.0 113.057 174.129 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 87.6 m-85 -99.7 5.01 45.8 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 126.081 1.752 . . . . 0.0 113.368 -176.154 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 56.5 m . . . . . 0 CA--C 1.544 0.712 0 O-C-N 121.408 -0.807 . . . . 0.0 112.025 163.575 . . . . . . . . 0 0 . 1 . 045 nuclear orig core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 30.5 m-20 . . . . . 0 CA--C 1.539 0.547 0 N-CA-C 109.745 -0.465 . . . . 0.0 109.745 . . . . . . . . . 0 0 . 1 . 045 nuclear orig core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 44.3 mt-30 -151.51 165.08 35.31 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 124.593 1.157 . . . . 0.0 112.181 -168.564 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 17.5 m-70 -77.07 137.22 38.81 Favored 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 108.631 -0.877 . . . . 0.0 108.631 150.951 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 70.0 mt -146.02 129.26 16.69 Favored 'General case' 0 C--N 1.331 -0.2 0 C-N-CA 125.612 1.565 . . . . 0.0 108.295 -176.565 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 4.2 t -148.67 154.36 39.55 Favored 'General case' 0 N--CA 1.465 0.316 0 C-N-CA 123.238 0.615 . . . . 0.0 111.716 -175.863 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 52.06 -129.46 35.54 Favored Glycine 0 CA--C 1.529 0.923 0 C-N-CA 125.336 1.446 . . . . 0.0 113.056 176.975 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 19.9 m -57.86 -34.62 69.94 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 124.251 1.02 . . . . 0.0 112.737 -179.32 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 75.1 m-70 -75.11 -28.96 60.44 Favored 'General case' 0 CA--C 1.541 0.602 0 O-C-N 121.073 -1.017 . . . . 0.0 113.017 177.797 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 50.1 tp -70.68 -42.63 70.47 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 119.037 0.835 . . . . 0.0 111.058 169.008 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 82.1 t -59.48 -42.45 87.88 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.106 0 CA-C-N 118.477 0.58 . . . . 0.0 111.442 172.548 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -61.83 -48.85 78.72 Favored 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 125.439 1.496 . . . . 0.0 111.843 176.458 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -64.29 -45.26 88.76 Favored 'General case' 0 CA--C 1.54 0.572 0 O-C-N 121.681 -0.637 . . . . 0.0 111.733 179.818 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 45.8 tp -59.76 -46.32 89.52 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 123.868 0.867 . . . . 0.0 110.816 175.994 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 39.1 t80 -58.8 -39.81 82.24 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 123.875 0.87 . . . . 0.0 113.183 172.965 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 68.5 mt -69.59 -31.93 70.37 Favored 'General case' 0 N--CA 1.469 0.516 0 O-C-N 121.482 -0.761 . . . . 0.0 112.952 177.993 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 70.2 t -77.35 -40.04 28.69 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.887 0 C-N-CA 124.238 1.015 . . . . 0.0 111.564 174.693 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 85.4 m -108.34 4.92 25.02 Favored 'General case' 0 N--CA 1.47 0.556 0 N-CA-C 115.246 1.573 . . . . 0.0 115.246 -167.269 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . -60.45 -24.17 61.29 Favored Glycine 0 N--CA 1.478 1.446 0 N-CA-C 116.837 1.495 . . . . 0.0 116.837 -161.469 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -77.06 -27.08 54.22 Favored 'General case' 0 CA--C 1.549 0.94 0 CA-C-N 118.406 1.103 . . . . 0.0 112.834 173.714 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 66.1 mtp180 -100.37 -35.4 9.6 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 126.238 1.815 . . . . 0.0 113.497 -174.695 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 88.88 174.43 46.82 Favored Glycine 0 CA--C 1.533 1.192 0 C-N-CA 124.738 1.161 . . . . 0.0 111.44 -159.953 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 40.4 p90 -151.17 167.76 26.77 Favored 'General case' 0 N--CA 1.475 0.775 0 N-CA-C 114.466 1.284 . . . . 0.0 114.466 -172.37 . . . . . . . . 1 1 . 1 . 045 nuclear orig core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 45.1 t80 . . . . . 0 CA--C 1.539 0.547 0 C-N-CA 126.005 1.722 . . . . 0.0 110.401 172.406 . . . . . . . . 0 0 . 1 . 046 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 75.8 t . . . . . 0 N--CA 1.487 1.377 0 N-CA-C 112.981 0.734 . . . . 0.0 112.981 . . . . . . . . . 0 0 . 1 . 046 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 43.3 tt0 -76.98 -50.77 12.42 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-N 118.171 0.441 . . . . 0.0 110.131 169.621 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 61.2 tt0 -61.37 -40.48 94.49 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 113.483 0.92 . . . . 0.0 113.483 -169.587 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 7.5 m -64.99 -23.16 67.14 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 113.634 0.976 . . . . 0.0 113.634 174.388 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 26.6 t -94.03 -39.8 10.43 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 124.12 0.968 . . . . 0.0 112.811 -177.544 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 73.2 p -85.41 -40.7 16.15 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 124.856 1.262 . . . . 0.0 112.57 179.116 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 47.8 m -105.32 -170.23 1.72 Allowed 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 125.597 1.559 . . . . 0.0 110.152 170.515 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 11.7 tt -103.43 146.86 10.52 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.8 0 C-N-CA 124.979 1.312 . . . . 0.0 110.025 175.971 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 14.2 p -142.04 162.04 36.47 Favored 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 113.613 0.968 . . . . 0.0 113.613 -178.304 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 19.4 m -112.96 150.1 32.34 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 124.386 1.075 . . . . 0.0 111.994 -170.234 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 28.2 mt -61.1 -33.37 73.25 Favored 'General case' 0 N--CA 1.473 0.713 0 O-C-N 121.275 -0.891 . . . . 0.0 111.858 177.461 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 57.5 m-85 -62.03 -31.85 72.28 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 124.538 1.135 . . . . 0.0 113.082 173.121 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 22.6 mm100 -81.81 -31.18 31.89 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 124.407 1.083 . . . . 0.0 111.684 174.021 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 53.7 mt -62.07 -38.76 90.03 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-N 119.644 1.111 . . . . 0.0 111.397 168.472 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 28.7 tt0 -61.3 -26.02 67.51 Favored 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 113.45 0.907 . . . . 0.0 113.45 -179.396 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 16.1 t-20 -59.72 -22.96 62.76 Favored 'General case' 0 CA--C 1.551 1.015 0 O-C-N 121.156 -0.965 . . . . 0.0 113.547 173.004 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 96.2 m-85 -97.61 1.22 48.52 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 125.61 1.564 . . . . 0.0 114.033 179.574 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 59.6 m . . . . . 0 CA--C 1.543 0.706 0 O-C-N 121.144 -0.973 . . . . 0.0 111.962 168.402 . . . . . . . . 0 0 . 1 . 046 nuclear orig core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 10.1 p30 . . . . . 0 CA--C 1.541 0.6 0 CA-C-O 120.677 0.275 . . . . 0.0 111.712 . . . . . . . . . 0 0 . 1 . 046 nuclear orig core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 34.3 mm-40 -150.89 162.12 41.39 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 124.282 1.033 . . . . 0.0 112.32 -162.28 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 98.1 m-70 -85.91 130.07 34.65 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 123.612 0.765 . . . . 0.0 109.046 164.185 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 90.3 mt -142.83 128.51 19.23 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 125.16 1.384 . . . . 0.0 109.445 -172.112 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 62.7 m -131.62 143.2 50.15 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 124.932 1.293 . . . . 0.0 111.046 -176.246 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 54.51 -127.44 39.83 Favored Glycine 0 N--CA 1.475 1.287 0 C-N-CA 124.846 1.212 . . . . 0.0 114.363 165.275 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 20.3 m -61.09 -33.67 73.72 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 124.152 0.981 . . . . 0.0 112.223 -177.749 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 27.2 m170 -70.93 -37.6 72.89 Favored 'General case' 0 CA--C 1.544 0.716 0 O-C-N 121.353 -0.842 . . . . 0.0 111.391 177.83 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 54.7 tp -66.38 -45.78 78.9 Favored 'General case' 0 N--CA 1.466 0.339 0 C-N-CA 123.697 0.799 . . . . 0.0 111.543 171.398 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 62.4 t -63.0 -36.44 75.8 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.785 0 C-N-CA 123.121 0.569 . . . . 0.0 111.465 177.421 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -66.14 -47.34 74.4 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 123.924 0.89 . . . . 0.0 112.046 172.278 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.47 -46.14 89.63 Favored 'General case' 0 CA--C 1.538 0.505 0 O-C-N 121.554 -0.716 . . . . 0.0 111.754 177.007 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 50.8 tp -58.5 -49.93 75.6 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 124.849 1.26 . . . . 0.0 110.997 174.828 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 52.1 t80 -56.17 -41.04 74.85 Favored 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 113.11 0.782 . . . . 0.0 113.11 174.329 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 80.1 mt -72.24 -35.51 68.85 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 123.91 0.884 . . . . 0.0 112.818 179.083 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 37.8 t -64.01 -46.14 94.73 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.912 0 C-N-CA 123.793 0.837 . . . . 0.0 110.827 171.333 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 81.5 m -78.18 -30.96 49.33 Favored 'General case' 0 N--CA 1.469 0.493 0 N-CA-C 113.437 0.902 . . . . 0.0 113.437 -175.743 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 63.92 -137.76 41.53 Favored Glycine 0 CA--C 1.531 1.057 0 C-N-CA 123.843 0.735 . . . . 0.0 111.417 -174.924 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 28.2 tt0 -67.71 -15.22 63.53 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 124.428 1.091 . . . . 0.0 113.907 -178.573 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 81.7 mtm180 -57.69 -41.11 80.96 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 124.126 0.971 . . . . 0.0 112.574 178.441 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 81.71 -178.29 53.75 Favored Glycine 0 CA--C 1.532 1.108 0 C-N-CA 124.133 0.873 . . . . 0.0 112.1 -168.591 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 52.5 p90 -159.71 167.68 27.76 Favored 'General case' 0 CA--C 1.539 0.548 0 N-CA-C 113.76 1.022 . . . . 0.0 113.76 -167.258 . . . . . . . . 1 1 . 1 . 046 nuclear orig core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 86.3 t80 . . . . . 0 CA--C 1.541 0.598 0 C-N-CA 126.134 1.773 . . . . 0.0 109.76 166.672 . . . . . . . . 0 0 . 1 . 047 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 44.2 t . . . . . 0 N--CA 1.487 1.385 0 N-CA-C 112.87 0.692 . . . . 0.0 112.87 . . . . . . . . . 0 0 . 1 . 047 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -84.17 -32.04 24.83 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 123.395 0.678 . . . . 0.0 111.465 177.969 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 63.9 tt0 -65.88 -40.21 91.39 Favored 'General case' 0 CA--C 1.537 0.446 0 O-C-N 121.516 -0.74 . . . . 0.0 112.091 179.666 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 13.2 t -77.03 -15.95 59.45 Favored 'General case' 0 CA--C 1.539 0.543 0 N-CA-C 113.405 0.891 . . . . 0.0 113.405 174.872 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 33.8 t -82.14 -40.1 22.33 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 124.715 1.206 . . . . 0.0 112.123 174.128 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 25.8 p -85.84 -49.37 7.95 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 125.991 1.716 . . . . 0.0 112.047 179.817 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 63.3 m -97.73 -139.05 0.29 Allowed 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 125.586 1.555 . . . . 0.0 109.673 166.308 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 32.8 pt -136.06 161.15 38.24 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.783 0 C-N-CA 125.558 1.543 . . . . 0.0 111.643 -177.705 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 14.9 p -154.71 159.18 40.54 Favored 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 124.758 1.223 . . . . 0.0 112.08 170.576 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 2.3 t -106.01 165.58 11.11 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 124.104 0.962 . . . . 0.0 111.938 177.193 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -59.99 -32.44 70.86 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.958 1.303 . . . . 0.0 111.422 178.161 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 80.3 t80 -63.79 -26.61 68.71 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 124.56 1.144 . . . . 0.0 113.425 172.838 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 72.9 mt-30 -87.82 -31.7 19.43 Favored 'General case' 0 N--CA 1.467 0.386 0 C-N-CA 124.511 1.124 . . . . 0.0 111.17 175.518 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 70.9 mt -59.6 -38.41 81.2 Favored 'General case' 0 N--CA 1.472 0.656 0 CA-C-N 119.322 0.964 . . . . 0.0 111.171 166.018 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 27.2 tt0 -58.1 -25.83 61.83 Favored 'General case' 0 CA--C 1.548 0.885 0 N-CA-C 113.85 1.055 . . . . 0.0 113.85 179.424 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 32.0 t30 -60.78 -26.27 67.13 Favored 'General case' 0 CA--C 1.547 0.86 0 O-C-N 121.024 -1.047 . . . . 0.0 113.205 174.081 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 92.8 m-85 -100.08 5.17 44.97 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 125.75 1.62 . . . . 0.0 114.285 -175.348 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 68.8 m . . . . . 0 N--CA 1.473 0.7 0 N-CA-C 113.583 0.957 . . . . 0.0 113.583 167.818 . . . . . . . . 0 0 . 1 . 047 nuclear orig core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . 0.279 0.5 OUTLIER . . . . . 0 N--CA 1.473 0.714 0 N-CA-C 116.259 1.948 . . . . 0.0 116.259 . . . . . . . . . 2 2 . 1 . 047 nuclear orig core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 71.3 mm-40 -123.31 168.6 12.28 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 125.242 1.417 . . . . 0.0 111.394 -168.446 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 98.4 m-70 -82.9 125.76 31.73 Favored 'General case' 0 CA--C 1.537 0.462 0 O-C-N 121.296 -0.878 . . . . 0.0 108.667 165.804 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 93.7 mt -142.62 137.08 29.76 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 125.255 1.422 . . . . 0.0 108.118 -179.668 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 4.5 t -143.68 151.83 40.57 Favored 'General case' 0 N--CA 1.466 0.374 0 N-CA-C 112.836 0.68 . . . . 0.0 112.836 -171.797 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 46.14 -128.66 10.13 Favored Glycine 0 CA--C 1.529 0.915 0 C-N-CA 125.985 1.755 . . . . 0.0 114.377 170.378 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 20.0 m -59.48 -33.12 70.93 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 124.777 1.231 . . . . 0.0 112.549 -178.619 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 97.4 m-70 -71.48 -39.81 70.63 Favored 'General case' 0 CA--C 1.541 0.605 0 O-C-N 121.088 -1.008 . . . . 0.0 111.472 178.555 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 8.2 tt -65.57 -44.35 87.0 Favored 'General case' 0 N--CA 1.466 0.329 0 C-N-CA 123.171 0.588 . . . . 0.0 111.003 170.8 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 53.3 t -64.31 -34.34 68.54 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.964 0 CA-C-N 118.406 0.548 . . . . 0.0 111.758 179.012 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -67.53 -48.09 68.02 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 123.95 0.9 . . . . 0.0 111.562 171.864 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -58.99 -44.8 91.65 Favored 'General case' 0 CA--C 1.542 0.668 0 O-C-N 121.736 -0.602 . . . . 0.0 111.775 176.141 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 61.4 tp -56.41 -52.5 64.42 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 125.603 1.561 . . . . 0.0 110.753 173.825 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 48.7 t80 -56.14 -39.78 72.82 Favored 'General case' 0 CA--C 1.543 0.69 0 N-CA-C 113.334 0.864 . . . . 0.0 113.334 174.715 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 82.7 mt -72.75 -32.53 65.72 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 123.87 0.868 . . . . 0.0 113.071 178.613 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 34.2 t -67.76 -44.56 85.64 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.995 0 C-N-CA 124.651 1.18 . . . . 0.0 110.594 171.736 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 62.4 m -83.31 -30.23 27.7 Favored 'General case' 0 N--CA 1.471 0.576 0 N-CA-C 114.375 1.25 . . . . 0.0 114.375 -173.888 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 65.32 -151.29 51.68 Favored Glycine 0 CA--C 1.533 1.203 0 C-N-CA 124.464 1.03 . . . . 0.0 112.355 -173.004 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -61.48 -13.65 22.58 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 125.535 1.534 . . . . 0.0 114.246 -178.286 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 59.1 ttm-85 -63.2 -25.43 68.33 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 125.022 1.329 . . . . 0.0 113.013 175.135 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 78.32 -171.63 55.15 Favored Glycine 0 N--CA 1.471 0.992 0 C-N-CA 124.582 1.087 . . . . 0.0 113.036 -178.785 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 50.3 p90 -162.0 166.67 25.68 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 125.028 1.331 . . . . 0.0 113.143 -170.544 . . . . . . . . 1 1 . 1 . 047 nuclear orig core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 83.9 t80 . . . . . 0 CA--C 1.538 0.511 0 C-N-CA 125.63 1.572 . . . . 0.0 109.766 167.81 . . . . . . . . 0 0 . 1 . 048 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 78.1 t . . . . . 0 N--CA 1.485 1.293 0 N-CA-C 111.86 0.319 . . . . 0.0 111.86 . . . . . . . . . 0 0 . 1 . 048 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 -79.09 -56.89 4.04 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 123.267 0.627 . . . . 0.0 109.957 169.632 . . . . . . . . 1 1 . 1 . 048 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 23.0 tt0 -67.28 -40.3 86.12 Favored 'General case' 0 N--CA 1.467 0.409 0 N-CA-C 112.823 0.675 . . . . 0.0 112.823 -164.483 . . . . . . . . 1 1 . 1 . 048 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 64.5 m -66.81 -24.08 66.12 Favored 'General case' 0 CA--C 1.534 0.334 0 N-CA-C 113.666 0.987 . . . . 0.0 113.666 178.635 . . . . . . . . 1 1 . 1 . 048 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 33.3 t -98.66 -37.5 9.48 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 124.015 0.926 . . . . 0.0 112.76 -175.376 . . . . . . . . 1 1 . 1 . 048 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 76.8 p -88.63 -33.51 17.6 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 125.077 1.351 . . . . 0.0 113.108 178.978 . . . . . . . . 1 1 . 1 . 048 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 49.0 m -117.39 -168.45 1.49 Allowed 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 125.883 1.673 . . . . 0.0 109.85 170.446 . . . . . . . . 1 1 . 1 . 048 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 12.0 tt -96.66 148.07 5.73 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.659 0 O-C-N 120.834 -1.166 . . . . 0.0 109.821 171.034 . . . . . . . . 1 1 . 1 . 048 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 11.0 p -138.83 166.79 23.51 Favored 'General case' 0 N--CA 1.475 0.785 0 O-C-N 121.251 -0.906 . . . . 0.0 112.828 177.714 . . . . . . . . 1 1 . 1 . 048 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 22.7 t -108.99 157.89 18.23 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-O 121.786 0.803 . . . . 0.0 112.936 -177.927 . . . . . . . . 1 1 . 1 . 048 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 44.4 mt -60.86 -31.12 70.59 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 123.572 0.749 . . . . 0.0 111.44 169.437 . . . . . . . . 1 1 . 1 . 048 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 85.1 t80 -62.96 -28.99 70.46 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.31 1.044 . . . . 0.0 113.223 172.439 . . . . . . . . 1 1 . 1 . 048 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 64.9 mt-30 -80.28 -38.18 31.31 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 123.494 0.718 . . . . 0.0 110.702 174.164 . . . . . . . . 1 1 . 1 . 048 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 42.1 mt -60.49 -37.24 80.44 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-N 118.639 0.654 . . . . 0.0 112.016 170.75 . . . . . . . . 1 1 . 1 . 048 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -61.31 -30.62 70.61 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 124.329 1.052 . . . . 0.0 112.923 178.881 . . . . . . . . 1 1 . 1 . 048 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 14.5 t-20 -65.14 -20.75 66.61 Favored 'General case' 0 CA--C 1.55 0.963 0 O-C-N 121.461 -0.774 . . . . 0.0 112.931 177.134 . . . . . . . . 1 1 . 1 . 048 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 45.4 m-85 -98.91 0.89 45.03 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 125.699 1.599 . . . . 0.0 113.74 179.964 . . . . . . . . 1 1 . 1 . 048 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 60.3 m . . . . . 0 CA--C 1.544 0.747 0 O-C-N 120.942 -1.099 . . . . 0.0 112.872 172.829 . . . . . . . . 0 0 . 1 . 048 nuclear orig core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 8.5 p30 . . . . . 0 CA--C 1.542 0.646 0 N-CA-C 112.516 0.561 . . . . 0.0 112.516 . . . . . . . . . 0 0 . 1 . 048 nuclear orig core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 54.0 mm-40 -153.42 161.18 42.55 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 125.412 1.485 . . . . 0.0 111.228 -164.985 . . . . . . . . 1 1 . 1 . 048 nuclear orig core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 92.9 m-70 -87.93 129.56 35.2 Favored 'General case' 0 CA--C 1.539 0.55 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 159.871 . . . . . . . . 1 1 . 1 . 048 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 87.3 mt -142.96 123.47 13.98 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 125.304 1.442 . . . . 0.0 109.895 -172.952 . . . . . . . . 1 1 . 1 . 048 nuclear orig core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 68.5 m -127.87 142.39 51.29 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 125.449 1.499 . . . . 0.0 110.177 178.164 . . . . . . . . 1 1 . 1 . 048 nuclear orig core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 51.78 -117.03 5.46 Favored Glycine 0 N--CA 1.472 1.041 0 C-N-CA 125.221 1.391 . . . . 0.0 113.941 167.031 . . . . . . . . 1 1 . 1 . 048 nuclear orig core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 20.2 t -60.05 -37.38 79.66 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 123.769 0.828 . . . . 0.0 112.266 -178.65 . . . . . . . . 1 1 . 1 . 048 nuclear orig core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 92.6 m-70 -68.0 -40.37 83.03 Favored 'General case' 0 CA--C 1.541 0.605 0 O-C-N 120.975 -1.078 . . . . 0.0 111.4 177.21 . . . . . . . . 1 1 . 1 . 048 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 52.5 tp -64.4 -46.03 85.03 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 123.763 0.825 . . . . 0.0 110.949 174.09 . . . . . . . . 1 1 . 1 . 048 nuclear orig core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 33.1 t -61.05 -38.91 80.6 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.797 0 C-N-CA 124.453 1.101 . . . . 0.0 111.988 176.475 . . . . . . . . 1 1 . 1 . 048 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -64.97 -48.04 75.46 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 123.45 0.7 . . . . 0.0 111.094 174.61 . . . . . . . . 1 1 . 1 . 048 nuclear orig core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.17 -43.38 98.96 Favored 'General case' 0 CA--C 1.542 0.646 0 O-C-N 121.638 -0.664 . . . . 0.0 112.116 178.246 . . . . . . . . 1 1 . 1 . 048 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 19.1 mt -56.31 -48.76 76.02 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 124.162 0.985 . . . . 0.0 111.302 172.707 . . . . . . . . 1 1 . 1 . 048 nuclear orig core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 64.1 t80 -64.91 -30.71 71.72 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 119.207 0.912 . . . . 0.0 113.095 176.845 . . . . . . . . 1 1 . 1 . 048 nuclear orig core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 73.8 mt -72.52 -36.17 68.27 Favored 'General case' 0 N--CA 1.471 0.578 0 O-C-N 121.091 -1.006 . . . . 0.0 112.981 174.799 . . . . . . . . 1 1 . 1 . 048 nuclear orig core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 73.3 t -77.14 -39.12 28.52 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.004 0 C-N-CA 123.851 0.86 . . . . 0.0 111.715 176.351 . . . . . . . . 1 1 . 1 . 048 nuclear orig core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 66.6 m -111.27 -4.3 15.01 Favored 'General case' 0 N--CA 1.476 0.843 0 N-CA-C 114.993 1.479 . . . . 0.0 114.993 -167.459 . . . . . . . . 1 1 . 1 . 048 nuclear orig core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . -74.04 145.67 35.32 Favored Glycine 0 CA--C 1.535 1.325 0 O-C-N 120.776 -1.203 . . . . 0.0 112.258 -177.246 . . . . . . . . 1 1 . 1 . 048 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -86.39 -0.13 55.28 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 128.041 2.537 . . . . 0.0 113.608 0.326 . . . . . . . . 1 1 . 1 . 048 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 35.7 mtp180 -63.32 -34.84 78.56 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 125.044 1.338 . . . . 0.0 113.407 -173.641 . . . . . . . . 1 1 . 1 . 048 nuclear orig core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 93.74 -179.48 38.53 Favored Glycine 0 N--CA 1.472 1.094 0 C-N-CA 125.097 1.332 . . . . 0.0 113.437 178.895 . . . . . . . . 1 1 . 1 . 048 nuclear orig core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 39.8 p90 -150.97 161.82 42.01 Favored 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 114.012 1.116 . . . . 0.0 114.012 -169.311 . . . . . . . . 1 1 . 1 . 048 nuclear orig core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 47.0 m-85 . . . . . 0 CA--C 1.548 0.874 0 C-N-CA 126.684 1.994 . . . . 0.0 113.123 -172.346 . . . . . . . . 0 0 . 1 . 049 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 41.8 t . . . . . 0 N--CA 1.482 1.132 0 N-CA-C 112.443 0.535 . . . . 0.0 112.443 . . . . . . . . . 0 0 . 1 . 049 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -89.71 -49.14 6.82 Favored 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 123.263 0.625 . . . . 0.0 110.376 169.408 . . . . . . . . 1 1 . 1 . 049 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 65.3 tt0 -66.45 -40.49 89.44 Favored 'General case' 0 N--CA 1.464 0.234 0 C-N-CA 124.6 1.16 . . . . 0.0 113.013 -168.013 . . . . . . . . 1 1 . 1 . 049 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 4.3 t -82.08 -15.29 53.99 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 119.096 0.862 . . . . 0.0 112.688 -178.526 . . . . . . . . 1 1 . 1 . 049 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 49.1 t -92.16 -40.71 10.86 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 124.6 1.16 . . . . 0.0 112.363 178.423 . . . . . . . . 1 1 . 1 . 049 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 63.0 p -84.01 -44.67 13.91 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 124.996 1.318 . . . . 0.0 112.007 177.6 . . . . . . . . 1 1 . 1 . 049 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 50.5 m -106.85 -141.73 0.37 Allowed 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 125.473 1.509 . . . . 0.0 109.529 167.028 . . . . . . . . 1 1 . 1 . 049 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 45.0 pt -127.02 165.64 25.24 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.667 0 C-N-CA 125.078 1.351 . . . . 0.0 111.396 179.77 . . . . . . . . 1 1 . 1 . 049 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 16.1 p -147.09 160.61 42.2 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 123.886 0.874 . . . . 0.0 112.543 168.286 . . . . . . . . 1 1 . 1 . 049 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 25.4 t -95.97 160.05 14.66 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 124.826 1.25 . . . . 0.0 112.451 176.802 . . . . . . . . 1 1 . 1 . 049 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 52.7 mt -60.6 -34.57 74.41 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 124.07 0.948 . . . . 0.0 111.101 171.089 . . . . . . . . 1 1 . 1 . 049 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 82.6 t80 -62.63 -26.72 68.77 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 124.596 1.158 . . . . 0.0 113.091 173.197 . . . . . . . . 1 1 . 1 . 049 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 83.0 mt-30 -86.46 -38.01 17.73 Favored 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 123.887 0.875 . . . . 0.0 110.856 175.524 . . . . . . . . 1 1 . 1 . 049 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 79.6 mt -56.64 -36.66 69.76 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-N 119.315 0.961 . . . . 0.0 111.893 170.821 . . . . . . . . 1 1 . 1 . 049 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 30.1 tt0 -57.11 -25.76 59.35 Favored 'General case' 0 CA--C 1.547 0.84 0 N-CA-C 113.618 0.97 . . . . 0.0 113.618 177.908 . . . . . . . . 1 1 . 1 . 049 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 14.5 t-20 -65.65 -24.29 66.99 Favored 'General case' 0 CA--C 1.548 0.895 0 O-C-N 120.947 -1.095 . . . . 0.0 113.319 176.018 . . . . . . . . 1 1 . 1 . 049 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 89.7 m-85 -95.91 -0.32 51.02 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 126.001 1.72 . . . . 0.0 113.369 -177.268 . . . . . . . . 1 1 . 1 . 049 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 60.1 m . . . . . 0 CA--C 1.544 0.723 0 C-N-CA 124.147 0.979 . . . . 0.0 113.127 170.073 . . . . . . . . 0 0 . 1 . 049 nuclear orig core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 1.7 p-10 . . . . . 0 CA--C 1.536 0.41 0 CA-C-O 120.649 0.261 . . . . 0.0 111.697 . . . . . . . . . 0 0 . 1 . 049 nuclear orig core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 38.6 mt-30 -148.96 163.19 38.22 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 123.858 0.863 . . . . 0.0 111.987 -161.69 . . . . . . . . 1 1 . 1 . 049 nuclear orig core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 97.9 m-70 -82.7 131.6 35.2 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 108.914 -0.772 . . . . 0.0 108.914 156.282 . . . . . . . . 1 1 . 1 . 049 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 86.7 mt -145.41 129.02 17.11 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 125.263 1.425 . . . . 0.0 110.042 -178.647 . . . . . . . . 1 1 . 1 . 049 nuclear orig core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 68.8 m -130.61 142.3 50.45 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 125.614 1.565 . . . . 0.0 110.099 179.744 . . . . . . . . 1 1 . 1 . 049 nuclear orig core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 52.33 -121.05 12.8 Favored Glycine 0 N--CA 1.47 0.929 0 C-N-CA 124.704 1.145 . . . . 0.0 114.087 166.588 . . . . . . . . 1 1 . 1 . 049 nuclear orig core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 21.5 m -59.53 -33.49 71.45 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 124.222 1.009 . . . . 0.0 112.558 -178.214 . . . . . . . . 1 1 . 1 . 049 nuclear orig core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 94.7 m-70 -71.06 -39.13 72.41 Favored 'General case' 0 CA--C 1.538 0.494 0 O-C-N 121.421 -0.799 . . . . 0.0 111.441 176.768 . . . . . . . . 1 1 . 1 . 049 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 48.1 tp -66.16 -42.53 88.87 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 123.653 0.781 . . . . 0.0 111.235 173.569 . . . . . . . . 1 1 . 1 . 049 nuclear orig core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 54.7 t -60.31 -45.0 97.01 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.888 0 C-N-CA 123.784 0.833 . . . . 0.0 111.471 173.714 . . . . . . . . 1 1 . 1 . 049 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -62.67 -46.92 85.95 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 123.869 0.867 . . . . 0.0 111.313 178.074 . . . . . . . . 1 1 . 1 . 049 nuclear orig core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.66 -46.66 87.16 Favored 'General case' 0 CA--C 1.54 0.56 0 O-C-N 121.674 -0.641 . . . . 0.0 111.778 178.733 . . . . . . . . 1 1 . 1 . 049 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 49.6 tp -59.6 -49.29 78.33 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 123.94 0.896 . . . . 0.0 111.091 177.526 . . . . . . . . 1 1 . 1 . 049 nuclear orig core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 53.9 t80 -52.46 -44.91 65.85 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 123.813 0.845 . . . . 0.0 112.902 173.403 . . . . . . . . 1 1 . 1 . 049 nuclear orig core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 82.3 mt -70.57 -32.49 69.91 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 123.813 0.845 . . . . 0.0 113.05 179.896 . . . . . . . . 1 1 . 1 . 049 nuclear orig core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 42.2 t -69.51 -43.12 80.87 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.814 0 C-N-CA 124.264 1.026 . . . . 0.0 111.238 172.5 . . . . . . . . 1 1 . 1 . 049 nuclear orig core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 64.7 m -83.23 -26.38 30.83 Favored 'General case' 0 N--CA 1.469 0.51 0 N-CA-C 114.392 1.256 . . . . 0.0 114.392 -173.987 . . . . . . . . 1 1 . 1 . 049 nuclear orig core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 63.29 -134.73 42.47 Favored Glycine 0 CA--C 1.532 1.108 0 C-N-CA 124.283 0.944 . . . . 0.0 112.252 -177.912 . . . . . . . . 1 1 . 1 . 049 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 32.4 mm-40 -66.92 -15.21 63.52 Favored 'General case' 0 CA--C 1.545 0.762 0 N-CA-C 114.06 1.133 . . . . 0.0 114.06 -176.913 . . . . . . . . 1 1 . 1 . 049 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 86.3 mtt-85 -61.25 -41.73 97.41 Favored 'General case' 0 N--CA 1.473 0.712 0 N-CA-C 113.571 0.952 . . . . 0.0 113.571 -178.768 . . . . . . . . 1 1 . 1 . 049 nuclear orig core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 79.0 -175.48 55.09 Favored Glycine 0 CA--C 1.534 1.28 0 C-N-CA 123.248 0.452 . . . . 0.0 111.997 -160.697 . . . . . . . . 1 1 . 1 . 049 nuclear orig core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 33.9 p90 -160.46 165.79 30.35 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 124.662 1.185 . . . . 0.0 113.18 -166.452 . . . . . . . . 1 1 . 1 . 049 nuclear orig core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 50.2 m-85 . . . . . 0 CA--C 1.542 0.635 0 C-N-CA 125.403 1.481 . . . . 0.0 113.336 -177.108 . . . . . . . . 0 0 . 1 . 050 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 85.3 t . . . . . 0 N--CA 1.479 1.009 0 CA-C-O 119.451 -0.309 . . . . 0.0 111.693 . . . . . . . . . 0 0 . 1 . 050 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 21.0 mm-40 -74.61 -46.24 39.79 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-N 118.315 0.507 . . . . 0.0 111.015 173.117 . . . . . . . . 1 1 . 1 . 050 nuclear orig core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 73.4 tp60 -59.48 -44.8 92.97 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 123.662 0.785 . . . . 0.0 111.653 -178.673 . . . . . . . . 1 1 . 1 . 050 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 62.5 m -70.44 -25.92 63.42 Favored 'General case' 0 N--CA 1.466 0.366 0 N-CA-C 114.758 1.392 . . . . 0.0 114.758 179.715 . . . . . . . . 1 1 . 1 . 050 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 17.3 t -106.74 -36.61 6.65 Favored 'General case' 0 CA--C 1.541 0.611 0 N-CA-C 113.701 1.001 . . . . 0.0 113.701 -168.937 . . . . . . . . 1 1 . 1 . 050 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 46.7 p -85.43 -33.02 22.02 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 124.637 1.175 . . . . 0.0 112.055 175.51 . . . . . . . . 1 1 . 1 . 050 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 65.6 m -121.42 -161.62 0.92 Allowed 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 126.68 1.992 . . . . 0.0 109.63 171.303 . . . . . . . . 1 1 . 1 . 050 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 48.4 pt -97.06 157.9 3.26 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.518 0 O-C-N 121.203 -0.935 . . . . 0.0 111.243 168.038 . . . . . . . . 1 1 . 1 . 050 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 21.4 p -137.55 163.83 30.23 Favored 'General case' 0 N--CA 1.466 0.359 0 C-N-CA 124.235 1.014 . . . . 0.0 111.498 170.431 . . . . . . . . 1 1 . 1 . 050 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 32.2 m -104.86 149.18 25.89 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 123.932 0.893 . . . . 0.0 111.215 -177.353 . . . . . . . . 1 1 . 1 . 050 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 56.3 mt -58.71 -32.12 68.89 Favored 'General case' 0 N--CA 1.471 0.611 0 O-C-N 121.358 -0.839 . . . . 0.0 111.686 174.876 . . . . . . . . 1 1 . 1 . 050 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 72.7 t80 -62.22 -27.98 69.37 Favored 'General case' 0 CA--C 1.542 0.646 0 N-CA-C 113.817 1.043 . . . . 0.0 113.817 171.649 . . . . . . . . 1 1 . 1 . 050 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 20.9 mm100 -83.5 -34.2 25.39 Favored 'General case' 0 N--CA 1.465 0.301 0 C-N-CA 124.124 0.97 . . . . 0.0 111.088 175.911 . . . . . . . . 1 1 . 1 . 050 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 10.9 mp -56.1 -49.14 74.68 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-N 118.692 0.678 . . . . 0.0 110.385 165.961 . . . . . . . . 1 1 . 1 . 050 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 4.0 tm-20 -61.99 -39.65 92.93 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 124.898 1.279 . . . . 0.0 112.39 178.694 . . . . . . . . 1 1 . 1 . 050 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 21.6 t30 -64.93 -35.12 80.15 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 123.989 0.916 . . . . 0.0 113.239 175.605 . . . . . . . . 1 1 . 1 . 050 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -74.37 -20.86 59.92 Favored 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 114.116 1.154 . . . . 0.0 114.116 178.969 . . . . . . . . 1 1 . 1 . 050 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 77.2 m . . . . . 0 CA--C 1.54 0.596 0 N-CA-C 114.407 1.262 . . . . 0.0 114.407 178.13 . . . . . . . . 0 0 . 1 . 050 nuclear orig core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.536 0.432 0 N-CA-C 112.345 0.498 . . . . 0.0 112.345 . . . . . . . . . 1 1 . 1 . 050 nuclear orig core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 27.7 mm-40 -148.88 164.22 35.14 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 124.968 1.307 . . . . 0.0 111.19 -165.438 . . . . . . . . 1 1 . 1 . 050 nuclear orig core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 94.7 m-70 -85.59 132.17 34.22 Favored 'General case' 0 CA--C 1.538 0.516 0 N-CA-C 108.991 -0.744 . . . . 0.0 108.991 155.407 . . . . . . . . 1 1 . 1 . 050 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 97.3 mt -144.55 130.6 19.44 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 125.706 1.603 . . . . 0.0 109.154 -178.216 . . . . . . . . 1 1 . 1 . 050 nuclear orig core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 86.0 m -137.67 147.51 44.94 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 125.06 1.344 . . . . 0.0 110.389 -176.436 . . . . . . . . 1 1 . 1 . 050 nuclear orig core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 55.66 -131.53 49.43 Favored Glycine 0 N--CA 1.472 1.052 0 C-N-CA 124.278 0.942 . . . . 0.0 113.658 166.178 . . . . . . . . 1 1 . 1 . 050 nuclear orig core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 21.1 m -61.28 -31.07 70.89 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 124.603 1.161 . . . . 0.0 112.524 -178.415 . . . . . . . . 1 1 . 1 . 050 nuclear orig core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 94.2 m-70 -70.09 -39.33 75.62 Favored 'General case' 0 CA--C 1.539 0.547 0 O-C-N 121.365 -0.835 . . . . 0.0 111.359 176.854 . . . . . . . . 1 1 . 1 . 050 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 51.4 tp -65.94 -44.4 85.19 Favored 'General case' 0 C--N 1.343 0.317 0 CA-C-O 118.594 -0.717 . . . . 0.0 111.043 170.964 . . . . . . . . 1 1 . 1 . 050 nuclear orig core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 71.3 t -57.96 -44.94 87.8 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.102 0 CA-C-N 118.884 0.766 . . . . 0.0 111.624 176.171 . . . . . . . . 1 1 . 1 . 050 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -63.55 -47.58 80.98 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 123.702 0.801 . . . . 0.0 111.248 177.664 . . . . . . . . 1 1 . 1 . 050 nuclear orig core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.71 -48.44 81.78 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 123.3 0.64 . . . . 0.0 111.409 178.524 . . . . . . . . 1 1 . 1 . 050 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 50.1 tp -58.49 -47.41 84.17 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 125.683 1.593 . . . . 0.0 111.622 179.24 . . . . . . . . 1 1 . 1 . 050 nuclear orig core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 82.0 t80 -59.16 -42.18 90.15 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 123.948 0.899 . . . . 0.0 113.2 174.032 . . . . . . . . 1 1 . 1 . 050 nuclear orig core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 89.4 mt -75.89 -33.04 59.93 Favored 'General case' 0 N--CA 1.471 0.614 0 N-CA-C 113.191 0.812 . . . . 0.0 113.191 -179.743 . . . . . . . . 1 1 . 1 . 050 nuclear orig core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 23.7 t -65.38 -45.54 92.86 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.734 0 C-N-CA 124.619 1.168 . . . . 0.0 110.598 173.792 . . . . . . . . 1 1 . 1 . 050 nuclear orig core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 71.5 m -90.72 -27.36 19.01 Favored 'General case' 0 N--CA 1.47 0.542 0 N-CA-C 114.349 1.241 . . . . 0.0 114.349 -172.467 . . . . . . . . 1 1 . 1 . 050 nuclear orig core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . -53.31 133.68 42.14 Favored Glycine 0 CA--C 1.536 1.379 0 C-N-CA 124.193 0.902 . . . . 0.0 112.851 -171.977 . . . . . . . . 1 1 . 1 . 050 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -77.71 -11.48 59.88 Favored 'General case' 0 CA--C 1.551 0.996 0 C-N-CA 128.501 2.72 . . . . 0.0 115.006 10.843 . . . . . . . . 1 1 . 1 . 050 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 55.0 ttp85 -65.67 140.9 58.52 Favored 'General case' 0 N--CA 1.473 0.708 0 O-C-N 120.826 -1.171 . . . . 0.0 111.87 178.669 . . . . . . . . 1 1 . 1 . 050 nuclear orig core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . -80.94 151.01 31.38 Favored Glycine 0 N--CA 1.47 0.931 0 C-N-CA 125.342 1.449 . . . . 0.0 112.648 -173.877 . . . . . . . . 1 1 . 1 . 050 nuclear orig core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 45.3 p90 -105.83 166.92 10.13 Favored 'General case' 0 CA--C 1.536 0.439 0 N-CA-C 114.57 1.322 . . . . 0.0 114.57 -173.393 . . . . . . . . 1 1 . 1 . 050 nuclear orig core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 45.1 t80 . . . . . 0 CA--C 1.537 0.477 0 C-N-CA 126.35 1.86 . . . . 0.0 109.206 171.553 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.563 0 N-CA-C 111.247 -0.741 . . . . 0.0 111.247 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 49.6 pt -68.92 -25.07 29.29 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.989 0 O-C-N 121.052 -1.264 . . . . 0.0 114.195 -170.317 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 44.6 t -61.47 -21.36 25.07 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.119 0 CA-C-N 119.229 0.922 . . . . 0.0 112.315 171.449 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -95.19 -52.95 3.97 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-N 119.478 1.035 . . . . 0.0 111.702 164.399 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 68.9 tp60 -64.18 -33.81 76.65 Favored 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 113.087 0.773 . . . . 0.0 113.087 -169.268 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 98.2 m -85.78 -28.17 24.72 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 119.5 1.045 . . . . 0.0 113.387 176.46 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 45.4 t -97.38 -60.1 1.65 Allowed 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 123.385 0.674 . . . . 0.0 112.65 -171.382 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 35.6 m -73.49 -41.71 62.75 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 125.748 1.619 . . . . 0.0 110.141 -179.157 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.4 t -102.49 -163.39 1.0 Allowed 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 124.045 0.938 . . . . 0.0 111.189 165.328 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 35.0 mt -108.25 145.1 15.73 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.743 0 C-N-CA 125.8 1.64 . . . . 0.0 110.499 175.916 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 10.2 p -133.32 163.83 28.45 Favored 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 112.957 0.725 . . . . 0.0 112.957 169.186 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 65.6 p -101.52 161.97 13.24 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 124.514 1.126 . . . . 0.0 113.703 176.519 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 52.5 mt -62.56 -34.37 76.81 Favored 'General case' 0 CA--C 1.539 0.532 0 O-C-N 121.308 -0.87 . . . . 0.0 111.696 171.0 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 91.2 t80 -63.61 -32.84 74.44 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 124.056 0.942 . . . . 0.0 112.748 173.356 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 91.6 mt-30 -73.62 -39.82 64.25 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-O 118.293 -0.861 . . . . 0.0 111.682 171.673 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 84.7 mt -59.82 -34.08 72.61 Favored 'General case' 0 N--CA 1.476 0.857 0 CA-C-N 119.825 1.193 . . . . 0.0 112.175 173.448 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 26.5 tt0 -60.56 -24.29 65.3 Favored 'General case' 0 CA--C 1.548 0.892 0 N-CA-C 113.326 0.861 . . . . 0.0 113.326 178.854 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 30.7 t30 -65.59 -25.65 67.5 Favored 'General case' 0 CA--C 1.546 0.799 0 O-C-N 121.046 -1.034 . . . . 0.0 113.058 173.837 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 97.0 m-85 -99.11 2.5 46.06 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 125.404 1.482 . . . . 0.0 113.899 -174.515 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 57.6 m -64.8 157.31 28.01 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 123.871 0.868 . . . . 0.0 112.768 165.358 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 25.1 t-20 . . . . . 0 C--O 1.25 1.114 0 C-N-CA 124.723 1.209 . . . . 0.0 113.079 177.765 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 31.1 p90 . . . . . 0 N--CA 1.489 1.477 0 CA-C-O 119.808 -0.139 . . . . 0.0 111.135 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 35.9 m -124.72 169.76 15.69 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.164 0 C-N-CA 125.587 1.555 . . . . 0.0 112.14 178.334 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 2.9 p-10 -142.23 145.11 33.73 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 125.698 1.599 . . . . 0.0 112.548 -179.138 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 30.2 mm-40 -153.79 168.58 25.82 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 125.084 1.354 . . . . 0.0 112.007 -168.147 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 80.0 m-70 -82.61 129.06 34.87 Favored 'General case' 0 CA--C 1.545 0.765 0 N-CA-C 109.241 -0.652 . . . . 0.0 109.241 155.289 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 79.7 mt -142.37 125.19 16.03 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 126.74 2.016 . . . . 0.0 108.977 -177.355 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 79.0 m -132.43 143.98 50.17 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 124.943 1.297 . . . . 0.0 111.392 -174.222 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 55.42 -122.52 26.77 Favored Glycine 0 N--CA 1.474 1.218 0 C-N-CA 124.923 1.249 . . . . 0.0 113.861 168.037 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 22.2 m -61.73 -33.43 74.02 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 123.747 0.819 . . . . 0.0 111.554 -179.644 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 20.9 m80 -72.69 -37.65 67.78 Favored 'General case' 0 CA--C 1.538 0.502 0 O-C-N 121.249 -0.907 . . . . 0.0 111.279 178.826 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 51.9 tp -63.12 -48.37 78.81 Favored 'General case' 0 N--CA 1.467 0.416 0 C-N-CA 124.056 0.943 . . . . 0.0 111.003 170.801 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 55.4 t -63.49 -37.74 80.38 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.87 0 C-N-CA 123.473 0.709 . . . . 0.0 111.946 178.743 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -66.5 -47.77 71.92 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 124.169 0.987 . . . . 0.0 111.839 174.207 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.69 -44.71 96.19 Favored 'General case' 0 CA--C 1.536 0.436 0 O-C-N 121.772 -0.58 . . . . 0.0 111.892 178.077 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 48.6 tp -58.55 -50.88 72.18 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 124.408 1.083 . . . . 0.0 110.858 174.932 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 50.8 t80 -56.92 -39.02 73.69 Favored 'General case' 0 CA--C 1.544 0.725 0 N-CA-C 113.286 0.847 . . . . 0.0 113.286 174.652 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 77.1 mt -71.12 -33.58 70.25 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 123.725 0.81 . . . . 0.0 112.878 177.94 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 42.5 t -68.31 -43.13 84.65 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.967 0 C-N-CA 124.067 0.947 . . . . 0.0 111.093 172.144 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 66.6 m -83.9 -29.31 27.27 Favored 'General case' 0 N--CA 1.471 0.625 0 N-CA-C 114.304 1.224 . . . . 0.0 114.304 -174.063 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 70.47 -159.23 53.63 Favored Glycine 0 CA--C 1.532 1.114 0 C-N-CA 124.653 1.12 . . . . 0.0 112.281 -170.721 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -64.1 -10.63 23.65 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 124.851 1.261 . . . . 0.0 114.185 -179.506 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 23.1 ttp85 -58.26 -31.62 67.6 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 125.287 1.435 . . . . 0.0 112.993 173.105 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 86.29 -176.65 48.59 Favored Glycine 0 CA--C 1.532 1.147 0 C-N-CA 124.412 1.006 . . . . 0.0 114.148 -179.671 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 49.5 p90 -163.91 172.67 13.65 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 124.654 1.181 . . . . 0.0 112.938 -164.091 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 91.5 t80 -150.27 112.98 4.75 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 125.417 1.487 . . . . 0.0 110.048 166.219 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 52.3 p90 -77.54 145.32 37.0 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 123.887 0.875 . . . . 0.0 112.747 176.919 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 24.0 p -93.46 142.11 24.79 Favored Pre-proline 0 C--O 1.24 0.58 0 C-N-CA 124.485 1.114 . . . . 0.0 111.379 173.574 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -74.41 -170.95 0.81 Allowed 'Trans proline' 0 C--N 1.352 0.722 0 C-N-CA 124.795 3.663 . . . . 0.0 111.911 -173.81 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 40.9 ttmt -52.73 -55.29 23.85 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 124.092 0.957 . . . . 0.0 112.141 -176.52 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 29.0 m . . . . . 0 C--O 1.251 1.18 0 C-N-CA 125.668 1.587 . . . . 0.0 110.988 175.896 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.606 0 N-CA-C 112.123 -0.391 . . . . 0.0 112.123 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 49.4 pt -59.83 -31.14 46.71 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.182 0 C-N-CA 124.158 0.983 . . . . 0.0 113.305 -173.368 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 78.3 t -59.81 -38.18 74.97 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.907 0 C-N-CA 123.153 0.581 . . . . 0.0 111.454 177.499 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -67.42 -48.57 66.92 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 118.343 0.519 . . . . 0.0 110.222 -178.886 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 22.2 tt0 -61.16 -55.84 27.64 Favored 'General case' 0 N--CA 1.466 0.357 0 C-N-CA 124.775 1.23 . . . . 0.0 111.284 -179.716 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 78.1 m -68.76 -19.76 64.34 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 114.271 1.211 . . . . 0.0 114.271 -175.129 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 17.9 t -90.44 -41.24 11.56 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 124.398 1.079 . . . . 0.0 112.893 176.946 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 1.4 t -79.61 -37.68 35.6 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 123.632 0.773 . . . . 0.0 112.413 179.15 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 10.3 t -107.63 -149.96 0.44 Allowed 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 125.907 1.683 . . . . 0.0 109.637 169.098 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 27.1 pt -123.08 149.35 26.81 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.444 0 C-N-CA 125.61 1.564 . . . . 0.0 111.481 177.092 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 58.2 m -128.18 162.86 25.96 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 125.399 1.48 . . . . 0.0 111.005 172.453 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 99.5 p -114.47 165.29 12.89 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 124.748 1.219 . . . . 0.0 112.698 -178.415 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 61.1 mt -62.0 -33.41 74.27 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 123.245 0.618 . . . . 0.0 111.756 173.522 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 88.7 t80 -67.26 -34.46 77.47 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 123.566 0.746 . . . . 0.0 113.0 172.806 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 38.9 mt-30 -72.19 -38.17 69.14 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-O 118.768 -0.634 . . . . 0.0 111.052 173.321 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 85.9 mt -60.58 -40.82 93.1 Favored 'General case' 0 CA--C 1.538 0.498 0 CA-C-N 119.128 0.877 . . . . 0.0 111.476 169.03 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 25.7 tt0 -65.45 -33.62 76.36 Favored 'General case' 0 CA--C 1.543 0.709 0 CA-C-N 118.517 0.598 . . . . 0.0 112.406 177.844 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 34.3 t30 -65.15 -22.94 66.99 Favored 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 123.755 0.822 . . . . 0.0 113.032 173.228 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 13.9 m-85 -87.41 -6.59 58.38 Favored 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 124.908 1.283 . . . . 0.0 113.636 176.069 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 70.2 m -65.76 159.18 25.74 Favored 'General case' 0 N--CA 1.473 0.71 0 O-C-N 120.914 -1.116 . . . . 0.0 113.518 177.302 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.254 1.304 0 C-N-CA 127.5 2.32 . . . . 0.0 111.808 178.973 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 87.4 m-85 . . . . . 0 N--CA 1.487 1.421 0 CA-C-O 119.735 -0.174 . . . . 0.0 111.027 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 8.2 p -69.67 139.74 19.81 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.918 0 O-C-N 121.742 -0.599 . . . . 0.0 110.785 175.07 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 7.4 m-80 -117.67 146.89 43.39 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 125.602 1.561 . . . . 0.0 111.536 177.909 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 38.3 mt-30 -145.58 158.71 43.81 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 125.565 1.546 . . . . 0.0 110.617 -173.877 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 99.5 m-70 -82.34 130.19 35.04 Favored 'General case' 0 CA--C 1.539 0.535 0 N-CA-C 108.289 -1.004 . . . . 0.0 108.289 158.305 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 85.2 mt -138.02 121.53 17.25 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 124.582 1.153 . . . . 0.0 109.732 -173.8 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 33.5 m -131.22 135.19 47.16 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.741 1.216 . . . . 0.0 110.476 -172.91 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 50.42 -120.7 8.92 Favored Glycine 0 CA--C 1.529 0.914 0 C-N-CA 125.163 1.363 . . . . 0.0 114.526 168.54 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 25.2 p -62.02 -32.52 73.02 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 124.484 1.114 . . . . 0.0 113.063 -179.686 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 94.0 m-70 -68.98 -38.62 79.45 Favored 'General case' 0 CA--C 1.538 0.519 0 O-C-N 121.172 -0.955 . . . . 0.0 111.385 175.269 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 8.7 tt -64.0 -48.98 74.25 Favored 'General case' 0 C--N 1.344 0.355 0 CA-C-O 118.875 -0.583 . . . . 0.0 110.552 171.459 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 53.9 t -59.85 -40.5 82.91 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.994 0 C-N-CA 123.234 0.614 . . . . 0.0 111.841 179.864 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -63.4 -49.9 71.96 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 123.676 0.79 . . . . 0.0 111.807 175.404 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.01 -45.98 91.23 Favored 'General case' 0 CA--C 1.539 0.523 0 O-C-N 121.79 -0.569 . . . . 0.0 111.564 178.957 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 40.4 tp -58.26 -51.53 69.4 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 125.619 1.567 . . . . 0.0 111.395 177.857 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 68.7 t80 -55.44 -42.59 74.41 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 123.762 0.825 . . . . 0.0 112.652 174.454 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 87.7 mt -73.7 -32.19 63.8 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 123.951 0.9 . . . . 0.0 113.179 -179.31 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 34.5 t -69.1 -45.25 80.17 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.885 0 C-N-CA 124.025 0.93 . . . . 0.0 110.341 171.883 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 74.0 m -77.06 -35.39 56.71 Favored 'General case' 0 N--CA 1.468 0.44 0 N-CA-C 113.385 0.883 . . . . 0.0 113.385 -175.181 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 62.58 -129.79 42.61 Favored Glycine 0 CA--C 1.532 1.094 0 C-N-CA 123.982 0.801 . . . . 0.0 111.254 -175.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -66.57 -14.36 62.26 Favored 'General case' 0 CA--C 1.546 0.802 0 N-CA-C 114.073 1.138 . . . . 0.0 114.073 179.344 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 84.5 mtm180 -69.09 -24.64 64.16 Favored 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 113.672 0.989 . . . . 0.0 113.672 -177.457 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 69.09 -175.48 31.86 Favored Glycine 0 N--CA 1.472 1.064 0 C-N-CA 124.027 0.822 . . . . 0.0 112.446 -170.697 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 44.2 p90 -154.11 157.66 39.26 Favored 'General case' 0 CA--C 1.539 0.545 0 N-CA-C 115.187 1.551 . . . . 0.0 115.187 -174.367 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 91.6 t80 -91.98 147.44 22.96 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 126.476 1.911 . . . . 0.0 109.981 161.514 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 26.2 t80 -156.53 141.11 16.85 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 124.523 1.129 . . . . 0.0 112.105 -173.075 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 15.9 p -141.32 122.68 8.97 Favored Pre-proline 0 CA--C 1.54 0.582 0 C-N-CA 125.31 1.444 . . . . 0.0 111.489 178.567 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -83.83 -163.09 0.19 Allowed 'Trans proline' 0 CA--C 1.546 1.087 0 C-N-CA 124.328 3.352 . . . . 0.0 110.455 169.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 24.9 ttmm -66.14 -30.86 71.43 Favored 'General case' 0 CA--C 1.549 0.941 0 O-C-N 121.32 -0.862 . . . . 0.0 113.264 170.365 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 8.7 m . . . . . 0 C--O 1.253 1.279 0 C-N-CA 126.608 1.963 . . . . 0.0 112.937 -176.714 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.617 0 N-CA-C 112.36 -0.296 . . . . 0.0 112.36 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 41.0 pt -64.37 -24.67 36.2 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.127 0 O-C-N 121.103 -1.234 . . . . 0.0 113.45 -177.83 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 70.5 t -58.82 -30.04 41.69 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.016 0 C-N-CA 123.774 0.829 . . . . 0.0 111.781 171.222 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -83.18 -50.23 8.66 Favored 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 123.779 0.832 . . . . 0.0 110.898 171.357 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 31.7 tt0 -64.7 -45.93 84.53 Favored 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 123.6 0.76 . . . . 0.0 112.298 -169.386 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 11.6 m -67.36 -17.89 64.93 Favored 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 113.501 0.926 . . . . 0.0 113.501 175.983 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 28.1 t -95.21 -42.56 8.5 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 124.396 1.078 . . . . 0.0 112.293 -176.506 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 54.3 p -87.2 -33.21 19.42 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 126.002 1.721 . . . . 0.0 112.571 -178.823 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 7.8 t -109.79 -170.25 1.62 Allowed 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 124.805 1.242 . . . . 0.0 110.103 165.797 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 11.8 tt -101.76 147.04 9.01 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.629 0 C-N-CA 125.28 1.432 . . . . 0.0 110.093 173.614 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 16.7 p -140.61 157.91 44.76 Favored 'General case' 0 N--CA 1.474 0.772 0 N-CA-C 112.974 0.731 . . . . 0.0 112.974 176.985 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 83.8 p -104.29 157.57 17.05 Favored 'General case' 0 N--CA 1.469 0.492 0 N-CA-C 114.361 1.245 . . . . 0.0 114.361 -173.916 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 62.5 mt -58.26 -32.53 68.46 Favored 'General case' 0 N--CA 1.47 0.526 0 O-C-N 121.633 -0.667 . . . . 0.0 111.675 173.203 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 84.6 t80 -66.21 -29.68 70.0 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 124.379 1.072 . . . . 0.0 113.685 172.754 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 89.0 mt-30 -81.23 -32.25 33.49 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 124.08 0.952 . . . . 0.0 111.07 174.636 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 8.4 mp -62.88 -42.67 99.85 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 123.437 0.695 . . . . 0.0 111.491 167.75 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 29.4 tt0 -62.64 -25.02 67.91 Favored 'General case' 0 CA--C 1.545 0.766 0 N-CA-C 113.532 0.938 . . . . 0.0 113.532 -177.357 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 24.8 t30 -55.03 -27.51 45.05 Favored 'General case' 0 CA--C 1.547 0.827 0 C-N-CA 124.281 1.032 . . . . 0.0 113.22 173.805 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 97.8 m-85 -97.58 0.87 48.14 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 125.443 1.497 . . . . 0.0 114.487 -176.458 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 65.2 m -66.61 154.69 39.85 Favored 'General case' 0 N--CA 1.474 0.726 0 O-C-N 121.369 -0.832 . . . . 0.0 112.818 174.261 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 20.8 t-20 . . . . . 0 C--O 1.25 1.115 0 C-N-CA 125.747 1.619 . . . . 0.0 112.77 -177.876 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 2.8 p90 . . . . . 0 N--CA 1.485 1.324 0 N-CA-C 111.285 0.106 . . . . 0.0 111.285 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 95.7 t -87.29 145.93 6.94 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.076 0 C-N-CA 125.278 1.431 . . . . 0.0 109.748 176.867 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 52.3 p-10 -131.04 148.68 52.78 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 125.437 1.495 . . . . 0.0 112.975 172.856 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 41.3 mt-30 -151.05 161.34 42.91 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 125.532 1.533 . . . . 0.0 110.845 -167.018 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 98.4 m-70 -89.85 128.72 36.23 Favored 'General case' 0 CA--C 1.54 0.57 0 N-CA-C 109.297 -0.631 . . . . 0.0 109.297 159.691 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 90.8 mt -141.1 126.6 18.82 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 125.246 1.418 . . . . 0.0 109.577 -172.653 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 39.9 m -128.65 135.9 49.93 Favored 'General case' 0 N--CA 1.466 0.334 0 C-N-CA 124.516 1.126 . . . . 0.0 110.967 -175.218 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 49.68 -117.02 4.19 Favored Glycine 0 CA--C 1.529 0.916 0 C-N-CA 125.415 1.484 . . . . 0.0 113.694 168.365 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 22.3 m -59.56 -32.92 70.79 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 124.609 1.164 . . . . 0.0 112.931 -179.389 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 94.0 m-70 -72.26 -37.64 69.04 Favored 'General case' 0 CA--C 1.539 0.547 0 O-C-N 121.23 -0.919 . . . . 0.0 111.423 177.129 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 59.8 tp -67.11 -43.12 83.26 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 123.155 0.582 . . . . 0.0 110.99 171.981 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 40.4 t -60.17 -42.76 91.32 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.907 0 C-N-CA 124.335 1.054 . . . . 0.0 111.915 175.589 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -63.42 -47.31 82.5 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 123.65 0.78 . . . . 0.0 111.337 173.717 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.6 -42.83 99.42 Favored 'General case' 0 CA--C 1.541 0.606 0 O-C-N 121.303 -0.873 . . . . 0.0 112.446 178.439 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 28.7 mt -57.75 -50.56 72.83 Favored 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 124.124 0.969 . . . . 0.0 110.931 174.453 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 80.5 t80 -55.94 -41.16 74.21 Favored 'General case' 0 CA--C 1.541 0.632 0 N-CA-C 112.997 0.74 . . . . 0.0 112.997 175.007 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 88.2 mt -73.8 -35.97 64.97 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 123.834 0.854 . . . . 0.0 113.234 179.73 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 26.1 t -66.96 -44.29 88.67 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.948 0 C-N-CA 124.687 1.195 . . . . 0.0 110.542 173.84 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 71.0 m -77.62 -32.15 53.3 Favored 'General case' 0 CA--C 1.537 0.449 0 N-CA-C 112.803 0.668 . . . . 0.0 112.803 -176.235 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 68.62 -113.88 5.57 Favored Glycine 0 CA--C 1.529 0.926 0 C-N-CA 124.406 1.003 . . . . 0.0 111.814 173.055 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 37.6 mm-40 -71.09 -21.55 62.21 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 123.853 0.861 . . . . 0.0 112.711 174.882 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 83.6 mtm180 -75.18 155.49 36.86 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 124.923 1.289 . . . . 0.0 111.215 174.534 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . -74.89 179.63 44.37 Favored Glycine 0 CA--C 1.53 1.017 0 C-N-CA 124.246 0.927 . . . . 0.0 111.253 168.087 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 32.2 p90 -154.42 171.24 19.65 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 124.416 1.086 . . . . 0.0 112.61 -177.255 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 76.9 t80 -155.63 152.07 28.26 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 125.348 1.459 . . . . 0.0 111.582 178.59 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 36.5 p90 -139.24 140.07 37.61 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 126.243 1.817 . . . . 0.0 111.997 176.926 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 18.3 p -90.73 122.32 67.1 Favored Pre-proline 0 C--O 1.24 0.58 0 C-N-CA 124.234 1.014 . . . . 0.0 109.97 171.002 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_endo -82.34 -174.33 2.06 Favored 'Trans proline' 0 CA--C 1.539 0.74 0 C-N-CA 124.157 3.238 . . . . 0.0 111.386 179.728 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 50.6 tttp -75.44 -21.44 58.15 Favored 'General case' 0 CA--C 1.548 0.885 0 N-CA-C 113.233 0.827 . . . . 0.0 113.233 168.952 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 9.5 m . . . . . 0 C--O 1.254 1.308 0 C-N-CA 126.945 2.098 . . . . 0.0 112.915 -176.971 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.653 0 N-CA-C 111.901 -0.479 . . . . 0.0 111.901 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 2.6 pp -66.3 -28.24 42.96 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.249 0 N-CA-C 113.887 1.069 . . . . 0.0 113.887 -169.45 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 54.8 t -65.48 -45.84 91.64 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.066 0 CA-C-N 118.754 0.707 . . . . 0.0 110.782 171.352 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -62.77 -43.99 97.35 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 118.705 0.684 . . . . 0.0 110.572 178.925 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 16.9 tt0 -56.78 -55.68 31.24 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 123.961 0.904 . . . . 0.0 111.25 175.44 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -80.03 -16.92 54.08 Favored 'General case' 0 CA--C 1.541 0.608 0 N-CA-C 114.558 1.318 . . . . 0.0 114.558 -172.209 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 38.4 t -99.33 -50.47 4.11 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 124.127 0.971 . . . . 0.0 112.513 -176.817 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 29.8 m -78.99 -39.83 33.16 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 124.611 1.164 . . . . 0.0 110.726 -178.059 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 10.5 t -104.24 -154.54 0.51 Allowed 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 124.236 1.014 . . . . 0.0 109.908 159.419 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 29.8 pt -112.4 161.47 11.17 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.651 0 C-N-CA 126.117 1.767 . . . . 0.0 111.595 175.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 1.6 p -147.08 169.34 19.46 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 123.457 0.703 . . . . 0.0 112.477 165.015 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 70.5 m -112.32 154.19 26.07 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 124.048 0.939 . . . . 0.0 112.956 -170.104 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 62.2 mt -59.09 -29.95 67.73 Favored 'General case' 0 N--CA 1.468 0.456 0 O-C-N 121.197 -0.94 . . . . 0.0 112.189 176.757 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 79.2 t80 -67.48 -26.37 66.33 Favored 'General case' 0 CA--C 1.545 0.77 0 N-CA-C 113.889 1.07 . . . . 0.0 113.889 171.97 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 59.9 mt-30 -77.85 -40.43 40.23 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 123.517 0.727 . . . . 0.0 109.655 171.719 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 9.2 mp -57.47 -39.93 77.45 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 118.401 0.546 . . . . 0.0 111.459 169.571 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -64.7 -37.35 87.31 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 124.307 1.043 . . . . 0.0 112.34 175.854 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 21.8 t30 -66.76 -27.63 67.75 Favored 'General case' 0 CA--C 1.545 0.762 0 O-C-N 121.213 -0.929 . . . . 0.0 112.732 172.721 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 18.9 m-85 -85.31 -4.02 59.02 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 125.14 1.376 . . . . 0.0 113.638 177.699 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 79.2 m -62.94 147.39 50.57 Favored 'General case' 0 CA--C 1.541 0.619 0 O-C-N 120.8 -1.188 . . . . 0.0 112.718 172.596 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 33.6 t30 . . . . . 0 C--O 1.251 1.145 0 C-N-CA 125.437 1.495 . . . . 0.0 112.329 177.525 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 52.6 m-85 . . . . . 0 N--CA 1.487 1.423 0 CA-C-O 119.528 -0.272 . . . . 0.0 110.98 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 99.0 t -79.91 129.95 36.77 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.941 0 CA-C-N 118.962 0.801 . . . . 0.0 109.239 174.278 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 5.4 p-10 -118.97 145.36 45.87 Favored 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 125.975 1.71 . . . . 0.0 111.618 177.387 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 38.9 mt-30 -149.25 163.63 37.1 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 124.429 1.091 . . . . 0.0 111.045 -171.625 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 96.0 m-70 -88.49 126.38 35.22 Favored 'General case' 0 CA--C 1.542 0.641 0 N-CA-C 107.991 -1.114 . . . . 0.0 107.991 154.411 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 85.1 mt -136.64 129.21 30.38 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 125.383 1.473 . . . . 0.0 109.008 -179.979 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 60.2 m -131.67 137.09 48.17 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 124.434 1.094 . . . . 0.0 110.788 -173.614 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 49.37 -120.23 7.21 Favored Glycine 0 N--CA 1.47 0.935 0 C-N-CA 125.06 1.315 . . . . 0.0 113.897 169.648 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 26.9 m -59.28 -31.3 68.99 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 124.81 1.244 . . . . 0.0 112.668 -178.167 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 96.8 m-70 -73.35 -35.96 66.07 Favored 'General case' 0 CA--C 1.541 0.603 0 O-C-N 121.317 -0.864 . . . . 0.0 111.561 177.697 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 32.9 tp -70.3 -40.8 74.04 Favored 'General case' 0 CA--C 1.536 0.44 0 O-C-N 121.667 -0.646 . . . . 0.0 111.392 171.237 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 56.1 t -58.61 -43.48 87.46 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.159 0 C-N-CA 123.569 0.748 . . . . 0.0 111.546 173.093 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -64.41 -45.92 85.48 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 123.703 0.801 . . . . 0.0 111.572 175.194 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.06 -44.31 96.95 Favored 'General case' 0 CA--C 1.541 0.606 0 O-C-N 121.592 -0.693 . . . . 0.0 112.141 178.438 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 34.5 mt -58.51 -48.13 81.82 Favored 'General case' 0 N--CA 1.464 0.253 0 C-N-CA 124.264 1.025 . . . . 0.0 110.876 174.257 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 90.7 t80 -57.63 -38.9 75.78 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-N 118.821 0.737 . . . . 0.0 112.495 175.465 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 84.6 mt -75.78 -36.75 59.71 Favored 'General case' 0 CA--C 1.538 0.483 0 N-CA-C 113.405 0.891 . . . . 0.0 113.405 179.573 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 55.2 t -70.74 -40.4 76.8 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.007 0 C-N-CA 123.695 0.798 . . . . 0.0 110.954 175.796 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 63.3 m -92.95 -23.81 18.6 Favored 'General case' 0 N--CA 1.471 0.604 0 N-CA-C 114.465 1.283 . . . . 0.0 114.465 -172.911 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 63.15 -142.26 47.25 Favored Glycine 0 CA--C 1.531 1.087 0 C-N-CA 124.118 0.866 . . . . 0.0 112.365 -175.829 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -63.52 -12.9 35.97 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 125.626 1.57 . . . . 0.0 114.46 -177.459 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 75.2 mtp180 -59.57 -38.81 82.13 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 124.28 1.032 . . . . 0.0 113.128 178.752 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 82.1 -179.62 53.19 Favored Glycine 0 CA--C 1.536 1.358 0 C-N-CA 124.484 1.04 . . . . 0.0 112.193 -161.994 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 34.9 p90 -157.74 157.92 34.33 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 124.339 1.056 . . . . 0.0 113.653 -169.945 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 81.5 t80 -79.49 144.61 33.83 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 126.084 1.754 . . . . 0.0 110.84 166.187 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 71.4 t80 -158.07 146.09 18.63 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 125.831 1.653 . . . . 0.0 111.039 -179.726 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 10.0 t -160.95 134.47 4.86 Favored Pre-proline 0 N--CA 1.474 0.746 0 C-N-CA 124.794 1.237 . . . . 0.0 111.584 175.045 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 91.5 Cg_endo -76.78 -26.37 8.24 Favored 'Trans proline' 0 C--N 1.353 0.798 0 C-N-CA 123.576 2.85 . . . . 0.0 113.177 -179.968 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 40.0 tttp -166.35 141.11 4.4 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 124.748 1.219 . . . . 0.0 112.364 -174.539 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 40.2 p . . . . . 0 C--O 1.252 1.222 0 C-N-CA 126.07 1.748 . . . . 0.0 112.802 176.153 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.634 0 N-CA-C 111.639 -0.584 . . . . 0.0 111.639 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 11.2 tp -66.74 -38.34 81.34 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.0 0 CA-C-N 118.758 1.279 . . . . 0.0 112.824 -170.112 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 60.0 t -69.05 -38.5 78.39 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.823 0 CA-C-N 118.561 0.619 . . . . 0.0 111.05 -174.746 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 35.7 mm-40 -71.94 -44.75 63.09 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-O 118.684 -0.674 . . . . 0.0 111.041 173.281 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 5.5 tt0 -59.43 -53.6 56.33 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 119.253 0.933 . . . . 0.0 111.281 -178.914 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 57.2 m -60.17 -27.6 67.24 Favored 'General case' 0 CA--C 1.535 0.395 0 N-CA-C 113.793 1.035 . . . . 0.0 113.793 -177.571 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 24.9 t -102.37 -41.0 6.48 Favored 'General case' 0 CA--C 1.538 0.508 0 N-CA-C 113.622 0.971 . . . . 0.0 113.622 -170.772 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 59.4 p -84.62 -25.55 28.49 Favored 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 124.166 0.986 . . . . 0.0 112.683 176.989 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 79.8 p -126.06 -139.54 0.27 Allowed 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 125.669 1.588 . . . . 0.0 109.194 166.369 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 38.4 pt -123.46 161.4 25.56 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.524 0 C-N-CA 125.017 1.327 . . . . 0.0 110.844 177.184 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 29.0 p -141.54 156.04 45.74 Favored 'General case' 0 C--O 1.237 0.422 0 C-N-CA 123.354 0.662 . . . . 0.0 112.67 172.421 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 58.5 p -96.42 160.55 14.35 Favored 'General case' 0 N--CA 1.467 0.377 0 N-CA-C 113.343 0.868 . . . . 0.0 113.343 -176.314 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 65.7 mt -61.76 -33.38 73.96 Favored 'General case' 0 CA--C 1.539 0.522 0 O-C-N 121.366 -0.834 . . . . 0.0 111.843 173.066 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 89.5 t80 -66.68 -32.12 73.22 Favored 'General case' 0 CA--C 1.543 0.702 0 N-CA-C 113.066 0.765 . . . . 0.0 113.066 172.665 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 80.4 mt-30 -73.12 -37.76 66.55 Favored 'General case' 0 N--CA 1.466 0.352 0 O-C-N 121.442 -0.786 . . . . 0.0 111.186 171.671 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 46.5 mt -60.4 -40.01 89.4 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 119.413 1.006 . . . . 0.0 111.227 169.824 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -63.98 -40.12 95.68 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 124.285 1.034 . . . . 0.0 112.316 176.16 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 18.5 t30 -60.98 -28.57 69.1 Favored 'General case' 0 CA--C 1.548 0.873 0 O-C-N 121.226 -0.921 . . . . 0.0 112.797 174.538 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 22.4 m-85 -92.38 4.15 53.99 Favored 'General case' 0 CA--C 1.547 0.827 0 C-N-CA 125.063 1.345 . . . . 0.0 114.316 177.438 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 83.4 m -68.76 155.28 40.44 Favored 'General case' 0 N--CA 1.471 0.617 0 O-C-N 120.737 -1.227 . . . . 0.0 112.526 166.327 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 95.7 m-20 . . . . . 0 C--O 1.25 1.111 0 C-N-CA 124.133 0.973 . . . . 0.0 112.079 170.503 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 78.1 m-85 . . . . . 0 N--CA 1.487 1.423 0 N-CA-C 111.237 0.088 . . . . 0.0 111.237 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 2.0 t 62.75 27.55 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.535 0 C-N-CA 125.889 1.675 . . . . 0.0 113.018 171.72 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 12.7 m-80 -142.34 149.34 39.32 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 126.9 2.08 . . . . 0.0 111.638 -175.566 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 41.0 mt-30 -147.15 160.35 42.54 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 124.834 1.254 . . . . 0.0 111.283 -178.528 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 92.8 m-70 -79.97 130.1 35.01 Favored 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 108.399 -0.963 . . . . 0.0 108.399 153.139 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 88.4 mt -143.36 126.21 16.17 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 125.213 1.405 . . . . 0.0 109.661 -176.892 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 66.4 m -135.41 144.15 46.36 Favored 'General case' 0 N--CA 1.468 0.428 0 C-N-CA 125.337 1.455 . . . . 0.0 110.35 -178.034 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 55.4 -124.55 33.59 Favored Glycine 0 N--CA 1.473 1.102 0 C-N-CA 124.495 1.045 . . . . 0.0 113.953 165.843 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 22.5 p -59.02 -37.12 76.19 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 124.765 1.226 . . . . 0.0 112.755 179.064 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 26.3 m80 -67.36 -38.77 85.31 Favored 'General case' 0 CA--C 1.54 0.576 0 O-C-N 121.171 -0.956 . . . . 0.0 111.577 177.219 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 51.5 tp -68.92 -43.24 75.54 Favored 'General case' 0 N--CA 1.465 0.325 0 O-C-N 121.667 -0.646 . . . . 0.0 111.388 173.387 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 6.4 t -56.88 -43.74 80.86 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.908 0 C-N-CA 124.463 1.105 . . . . 0.0 111.393 174.369 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 30.2 mm-40 -66.75 -44.56 81.15 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 124.1 0.96 . . . . 0.0 111.979 175.169 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -63.43 -45.1 92.49 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-N 118.969 0.804 . . . . 0.0 112.32 179.652 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 40.8 mt -57.44 -52.33 65.83 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 124.145 0.978 . . . . 0.0 110.408 172.058 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 87.9 t80 -55.8 -38.76 70.38 Favored 'General case' 0 CA--C 1.546 0.813 0 CA-C-N 119.321 0.964 . . . . 0.0 113.268 176.989 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 74.2 mt -72.2 -36.14 69.11 Favored 'General case' 0 N--CA 1.47 0.545 0 N-CA-C 113.224 0.824 . . . . 0.0 113.224 178.085 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 58.3 t -74.01 -38.73 49.93 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.133 0 C-N-CA 123.365 0.666 . . . . 0.0 111.53 175.307 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 60.8 m -90.34 -22.75 21.37 Favored 'General case' 0 N--CA 1.473 0.689 0 N-CA-C 114.666 1.358 . . . . 0.0 114.666 -172.906 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 65.99 -145.2 47.65 Favored Glycine 0 CA--C 1.532 1.129 0 C-N-CA 124.171 0.891 . . . . 0.0 112.202 -173.66 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -67.21 -12.37 59.88 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 124.602 1.161 . . . . 0.0 114.044 -178.642 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 76.2 mtp85 -63.85 -33.87 76.67 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 124.17 0.988 . . . . 0.0 113.235 178.832 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 77.01 -170.42 55.13 Favored Glycine 0 CA--C 1.531 1.033 0 C-N-CA 124.476 1.036 . . . . 0.0 113.096 -170.747 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 45.9 p90 -154.66 170.66 21.02 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 125.079 1.352 . . . . 0.0 112.729 -169.109 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 43.3 p90 -117.93 157.98 25.72 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 125.263 1.425 . . . . 0.0 111.042 169.011 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 49.4 t80 -146.78 63.42 1.19 Allowed 'General case' 0 N--CA 1.475 0.808 0 CA-C-O 121.958 0.885 . . . . 0.0 111.781 -148.478 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 49.1 p -72.35 133.24 83.32 Favored Pre-proline 0 N--CA 1.475 0.82 0 C-N-CA 124.377 1.071 . . . . 0.0 112.356 -172.681 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_endo -79.6 -124.74 0.01 OUTLIER 'Trans proline' 0 C--N 1.355 0.892 0 C-N-CA 125.239 3.96 . . . . 0.0 109.343 176.152 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 19.9 ttpp -71.67 137.87 48.17 Favored 'General case' 0 CA--C 1.545 0.754 0 O-C-N 120.918 -1.114 . . . . 0.0 111.276 173.589 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 26.4 m . . . . . 0 C--O 1.253 1.243 0 C-N-CA 125.203 1.401 . . . . 0.0 111.452 171.494 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.463 0 N-CA-C 112.276 -0.329 . . . . 0.0 112.276 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 46.4 pt -89.11 -31.25 5.38 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.115 0 N-CA-C 113.842 1.053 . . . . 0.0 113.842 -176.594 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 38.3 t -59.04 -38.24 72.73 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.067 0 CA-C-N 119.409 1.004 . . . . 0.0 111.793 -176.401 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -68.72 -8.65 44.71 Favored 'General case' 0 CA--C 1.545 0.764 0 N-CA-C 114.5 1.296 . . . . 0.0 114.5 178.379 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 71.5 tp60 -101.46 -55.74 2.46 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 124.191 0.996 . . . . 0.0 110.101 168.695 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 72.5 m -68.66 -28.69 67.1 Favored 'General case' 0 N--CA 1.468 0.436 0 N-CA-C 115.084 1.513 . . . . 0.0 115.084 -171.483 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 22.1 t -90.34 -45.2 9.18 Favored 'General case' 0 N--CA 1.476 0.839 0 N-CA-C 112.989 0.737 . . . . 0.0 112.989 -167.055 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 18.2 p -89.07 -53.97 4.33 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 126.001 1.721 . . . . 0.0 110.986 -177.785 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.9 t -87.69 -160.6 0.63 Allowed 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 124.65 1.18 . . . . 0.0 110.535 164.523 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 2.1 pp -105.03 167.81 2.79 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.535 0 C-N-CA 124.728 1.211 . . . . 0.0 111.98 175.494 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 20.5 p -147.99 160.09 43.2 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 123.71 0.804 . . . . 0.0 112.198 166.576 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 12.5 m -106.57 154.57 20.7 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 124.419 1.088 . . . . 0.0 111.988 -171.488 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 30.4 mt -61.32 -33.45 73.63 Favored 'General case' 0 N--CA 1.47 0.531 0 O-C-N 121.346 -0.846 . . . . 0.0 112.026 178.896 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 59.3 m-85 -60.73 -32.45 71.72 Favored 'General case' 0 CA--C 1.541 0.609 0 N-CA-C 113.565 0.95 . . . . 0.0 113.565 171.976 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 21.3 mm100 -81.6 -31.79 32.34 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 124.373 1.069 . . . . 0.0 110.992 176.707 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 64.1 mt -64.85 -37.73 88.62 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-N 119.23 0.923 . . . . 0.0 111.692 169.186 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 26.7 tt0 -63.07 -27.05 69.13 Favored 'General case' 0 CA--C 1.546 0.825 0 N-CA-C 113.194 0.813 . . . . 0.0 113.194 179.245 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 25.1 t30 -58.73 -24.88 62.32 Favored 'General case' 0 CA--C 1.547 0.841 0 O-C-N 121.103 -0.998 . . . . 0.0 112.91 172.963 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 85.7 m-85 -102.7 9.36 39.23 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 126.074 1.749 . . . . 0.0 113.464 -178.726 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 69.1 m -65.19 146.92 54.34 Favored 'General case' 0 CA--C 1.539 0.551 0 O-C-N 120.916 -1.115 . . . . 0.0 111.558 164.337 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 6.0 t30 . . . . . 0 C--O 1.25 1.109 0 C-N-CA 125.663 1.585 . . . . 0.0 112.739 175.814 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 32.5 t80 . . . . . 0 N--CA 1.485 1.295 0 CA-C-O 118.73 -0.653 . . . . 0.0 110.396 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 43.9 t 85.2 127.17 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 C-N-CA 129.023 2.929 . . . . 0.0 111.01 174.198 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 7.3 p30 -141.68 139.22 32.91 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 125.417 1.487 . . . . 0.0 110.773 169.612 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 49.4 mm-40 -153.72 163.56 39.81 Favored 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 123.842 0.857 . . . . 0.0 111.882 -162.787 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 99.2 m-70 -78.86 129.28 34.39 Favored 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 109.088 -0.708 . . . . 0.0 109.088 161.823 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 79.6 mt -144.97 132.64 20.99 Favored 'General case' 0 N--CA 1.465 0.294 0 C-N-CA 125.743 1.617 . . . . 0.0 109.079 -174.674 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 2.7 t -153.16 152.96 31.84 Favored 'General case' 0 N--CA 1.467 0.382 0 O-C-N 121.488 -0.757 . . . . 0.0 111.893 -176.898 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 49.69 -126.05 19.89 Favored Glycine 0 N--CA 1.47 0.954 0 C-N-CA 124.794 1.188 . . . . 0.0 113.596 177.751 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 15.1 m -60.28 -31.53 70.32 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 124.765 1.226 . . . . 0.0 112.761 -179.637 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 98.2 m-70 -73.87 -35.53 64.74 Favored 'General case' 0 CA--C 1.539 0.537 0 O-C-N 120.994 -1.066 . . . . 0.0 111.667 178.18 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 33.9 tp -68.81 -43.26 75.96 Favored 'General case' 0 N--CA 1.467 0.405 0 O-C-N 121.485 -0.759 . . . . 0.0 110.753 171.844 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 50.6 t -58.54 -41.38 81.76 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.018 0 C-N-CA 123.81 0.844 . . . . 0.0 111.595 173.249 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -66.26 -44.4 83.73 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 123.885 0.874 . . . . 0.0 112.295 175.336 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.66 -44.72 96.42 Favored 'General case' 0 CA--C 1.54 0.578 0 O-C-N 121.614 -0.679 . . . . 0.0 112.088 177.171 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 30.3 mt -56.16 -50.89 69.88 Favored 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 124.204 1.002 . . . . 0.0 111.169 172.177 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 67.5 t80 -56.24 -40.53 74.28 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 113.081 0.771 . . . . 0.0 113.081 176.017 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 89.7 mt -76.99 -33.5 57.58 Favored 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 113.546 0.943 . . . . 0.0 113.546 -179.408 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 38.7 t -69.95 -44.74 78.34 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.879 0 C-N-CA 124.189 0.995 . . . . 0.0 110.828 173.033 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 76.2 m -85.25 -33.18 22.24 Favored 'General case' 0 N--CA 1.466 0.371 0 N-CA-C 113.4 0.889 . . . . 0.0 113.4 -172.76 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 64.44 -135.25 39.06 Favored Glycine 0 CA--C 1.531 1.071 0 C-N-CA 124.229 0.919 . . . . 0.0 111.659 -177.928 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 30.0 tt0 -64.5 -16.81 63.16 Favored 'General case' 0 CA--C 1.549 0.906 0 C-N-CA 124.9 1.28 . . . . 0.0 113.503 -179.511 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 82.6 mtm180 -61.06 -32.51 72.15 Favored 'General case' 0 N--CA 1.473 0.69 0 N-CA-C 113.642 0.979 . . . . 0.0 113.642 179.965 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 85.39 173.36 49.64 Favored Glycine 0 CA--C 1.533 1.175 0 C-N-CA 124.748 1.166 . . . . 0.0 112.21 -169.388 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 51.1 p90 -159.0 166.81 30.92 Favored 'General case' 0 N--CA 1.47 0.545 0 N-CA-C 113.886 1.069 . . . . 0.0 113.886 -170.432 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 31.3 m-85 -121.93 153.53 38.35 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 127.078 2.151 . . . . 0.0 110.711 178.467 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 41.1 t80 -143.33 138.38 29.45 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.406 1.482 . . . . 0.0 110.906 -177.423 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 21.2 p -141.75 128.71 11.43 Favored Pre-proline 0 N--CA 1.475 0.819 0 C-N-CA 124.85 1.26 . . . . 0.0 112.11 -178.689 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 75.4 Cg_exo -59.27 -163.02 0.02 OUTLIER 'Trans proline' 0 CA--C 1.541 0.845 1 C-N-CA 125.324 4.016 . . . . 0.0 114.458 168.422 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 65.3 pttt -70.4 12.02 0.28 Allowed 'General case' 0 CA--C 1.556 1.191 0 N-CA-C 114.644 1.35 . . . . 0.0 114.644 170.112 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 10.8 p . . . . . 0 C--O 1.25 1.129 0 C-N-CA 127.367 2.267 . . . . 0.0 113.729 -179.708 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.552 0 N-CA-C 111.101 -0.799 . . . . 0.0 111.101 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 13.1 tt -55.07 -22.96 12.12 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.367 0 N-CA-C 115.876 1.806 . . . . 0.0 115.876 -160.594 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 4.5 t -51.1 -36.44 16.22 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.059 0 C-N-CA 124.923 1.289 . . . . 0.0 112.252 172.465 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -74.3 -11.05 60.16 Favored 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 113.856 1.058 . . . . 0.0 113.856 -179.69 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 60.5 tp60 -98.74 -53.61 3.25 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 123.811 0.844 . . . . 0.0 109.8 166.268 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 32.9 m -61.37 -33.54 73.82 Favored 'General case' 0 N--CA 1.466 0.333 0 N-CA-C 114.542 1.312 . . . . 0.0 114.542 -171.242 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 23.6 t -91.98 -41.92 10.29 Favored 'General case' 0 CA--C 1.537 0.448 0 O-C-N 121.955 -0.465 . . . . 0.0 111.681 -176.632 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 21.4 m -69.27 -34.77 75.26 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 126.409 1.884 . . . . 0.0 112.532 179.942 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 11.6 t -145.14 -162.56 1.53 Allowed 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 125.525 1.53 . . . . 0.0 110.593 -178.287 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 82.1 mt -80.76 135.93 24.24 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.614 0 O-C-N 120.691 -1.255 . . . . 0.0 109.958 172.38 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 21.0 p -119.13 157.2 28.37 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-O 121.718 0.77 . . . . 0.0 111.255 161.641 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 62.2 m -102.97 153.9 19.76 Favored 'General case' 0 N--CA 1.466 0.36 0 C-N-CA 123.659 0.784 . . . . 0.0 112.726 -173.86 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 57.1 mt -59.96 -32.73 71.08 Favored 'General case' 0 N--CA 1.467 0.416 0 O-C-N 121.388 -0.82 . . . . 0.0 112.034 178.995 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 84.6 m-85 -67.55 -29.08 68.37 Favored 'General case' 0 CA--C 1.54 0.594 0 N-CA-C 113.909 1.077 . . . . 0.0 113.909 172.962 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 92.6 mt-30 -75.87 -39.87 55.64 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 123.707 0.803 . . . . 0.0 110.292 172.829 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 94.2 mt -58.54 -41.31 85.24 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-N 118.454 0.57 . . . . 0.0 110.964 170.127 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -65.28 -40.48 93.91 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 124.575 1.15 . . . . 0.0 112.174 177.27 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 35.1 t30 -63.72 -23.88 67.55 Favored 'General case' 0 CA--C 1.548 0.903 0 O-C-N 121.246 -0.909 . . . . 0.0 112.69 172.949 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -90.05 3.95 51.74 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 125.587 1.555 . . . . 0.0 114.658 175.976 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 83.1 m -71.53 151.09 44.18 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 123.533 0.733 . . . . 0.0 112.807 169.718 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.249 1.055 0 C-N-CA 127.046 2.138 . . . . 0.0 109.4 169.394 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 60.9 t80 . . . . . 0 N--CA 1.488 1.446 0 CA-C-O 119.877 -0.106 . . . . 0.0 111.054 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 34.0 m -69.76 151.69 9.59 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.064 0 C-N-CA 124.588 1.155 . . . . 0.0 112.637 -177.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 15.2 m-20 72.63 123.76 0.04 OUTLIER 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 128.062 2.545 . . . . 0.0 111.983 177.146 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 68.4 mm-40 -152.19 166.87 30.38 Favored 'General case' 0 N--CA 1.471 0.604 0 O-C-N 121.232 -0.918 . . . . 0.0 113.068 -158.462 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 17.5 m-70 -78.6 133.46 37.29 Favored 'General case' 0 CA--C 1.544 0.741 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 154.915 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 77.7 mt -145.83 127.39 15.11 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 126.743 2.017 . . . . 0.0 109.137 -176.009 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 84.2 m -132.74 147.41 52.32 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 124.629 1.172 . . . . 0.0 110.696 -177.683 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 55.39 -128.26 43.93 Favored Glycine 0 N--CA 1.469 0.876 0 C-N-CA 124.832 1.206 . . . . 0.0 113.965 165.474 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 14.3 m -58.42 -34.22 70.54 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 124.395 1.078 . . . . 0.0 112.641 179.916 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 79.2 m-70 -77.44 -27.06 52.04 Favored 'General case' 0 CA--C 1.54 0.562 0 O-C-N 121.292 -0.88 . . . . 0.0 112.918 177.566 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 38.9 tp -71.85 -43.4 65.57 Favored 'General case' 0 N--CA 1.47 0.567 0 O-C-N 121.135 -0.978 . . . . 0.0 111.124 167.386 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 42.1 t -57.8 -41.64 80.19 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.992 0 C-N-CA 123.556 0.743 . . . . 0.0 111.603 172.971 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 44.2 tt0 -62.33 -49.32 76.07 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 125.395 1.478 . . . . 0.0 111.822 173.324 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -63.46 -45.19 91.96 Favored 'General case' 0 CA--C 1.541 0.606 0 O-C-N 121.681 -0.637 . . . . 0.0 112.391 -179.269 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 52.0 mt -54.45 -56.37 19.4 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 124.135 0.974 . . . . 0.0 110.392 171.95 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 74.0 t80 -52.9 -41.38 64.34 Favored 'General case' 0 CA--C 1.542 0.669 0 N-CA-C 113.371 0.878 . . . . 0.0 113.371 177.38 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 86.3 mt -73.46 -34.53 65.43 Favored 'General case' 0 CA--C 1.537 0.479 0 N-CA-C 113.884 1.068 . . . . 0.0 113.884 179.569 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 54.2 t -72.25 -39.97 64.94 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.049 0 CA-C-N 118.7 0.682 . . . . 0.0 110.834 173.417 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 73.4 m -79.85 -28.68 40.03 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 124.38 1.072 . . . . 0.0 113.72 -176.089 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 65.1 -111.43 4.18 Favored Glycine 0 CA--C 1.528 0.899 0 C-N-CA 124.472 1.035 . . . . 0.0 112.082 175.504 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -71.93 -21.0 61.67 Favored 'General case' 0 CA--C 1.544 0.73 0 N-CA-C 113.82 1.045 . . . . 0.0 113.82 175.101 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 84.6 mtp180 -78.63 157.79 28.59 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 124.752 1.221 . . . . 0.0 111.272 175.449 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . -81.83 -167.23 38.85 Favored Glycine 0 CA--C 1.529 0.921 0 C-N-CA 124.092 0.853 . . . . 0.0 111.778 170.676 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 43.7 p90 -156.64 152.17 26.82 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 125.384 1.474 . . . . 0.0 112.162 178.067 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 58.9 m-85 -91.59 -28.24 17.65 Favored 'General case' 0 CA--C 1.543 0.698 0 N-CA-C 114.313 1.227 . . . . 0.0 114.313 -172.414 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 57.8 t80 54.58 -96.47 0.06 Allowed 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 125.601 1.56 . . . . 0.0 113.122 179.215 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 88.3 m 63.88 90.13 0.09 OUTLIER Pre-proline 0 N--CA 1.483 1.191 0 C-N-CA 127.621 2.368 . . . . 0.0 113.072 169.446 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 93.8 Cg_endo -74.28 179.79 5.49 Favored 'Trans proline' 0 CA--C 1.54 0.8 0 C-N-CA 123.454 2.769 . . . . 0.0 110.971 164.909 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 28.9 mtpp -79.0 -5.73 54.6 Favored 'General case' 0 CA--C 1.548 0.901 0 N-CA-C 115.134 1.531 . . . . 0.0 115.134 -174.496 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 32.4 p . . . . . 0 C--O 1.252 1.237 0 C-N-CA 125.406 1.482 . . . . 0.0 113.724 -176.612 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.771 0 N-CA-C 111.419 -0.673 . . . . 0.0 111.419 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 10.1 tp -61.11 -36.76 74.77 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.959 0 N-CA-C 114.096 1.147 . . . . 0.0 114.096 -166.94 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 61.4 t -69.46 -33.93 59.62 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.07 0 CA-C-N 119.472 1.033 . . . . 0.0 111.562 -178.981 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -72.49 -45.49 59.19 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 118.499 0.591 . . . . 0.0 110.311 173.404 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 70.6 tp60 -59.88 -47.76 84.43 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 123.127 0.571 . . . . 0.0 111.745 178.979 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 73.1 m -72.0 -30.86 65.67 Favored 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 114.794 1.405 . . . . 0.0 114.794 -177.778 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 22.3 t -103.46 -41.77 5.89 Favored 'General case' 0 N--CA 1.47 0.574 0 N-CA-C 113.711 1.004 . . . . 0.0 113.711 -169.638 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 33.8 m -81.93 -38.01 25.9 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 124.127 0.971 . . . . 0.0 110.911 177.591 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 11.0 t -111.35 -152.58 0.5 Allowed 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 125.055 1.342 . . . . 0.0 110.422 166.073 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 45.3 pt -108.81 158.43 8.64 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.543 0 C-N-CA 125.474 1.51 . . . . 0.0 111.104 170.388 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 21.1 p -137.86 156.09 48.28 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 123.791 0.836 . . . . 0.0 112.588 171.233 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 59.7 p -93.56 165.41 12.75 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 124.456 1.103 . . . . 0.0 112.979 173.942 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 72.7 mt -63.61 -34.05 76.96 Favored 'General case' 0 CA--C 1.537 0.454 0 O-C-N 121.369 -0.832 . . . . 0.0 111.798 171.976 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 91.4 t80 -64.07 -34.97 79.24 Favored 'General case' 0 CA--C 1.544 0.721 0 O-C-N 121.598 -0.689 . . . . 0.0 112.687 171.893 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 91.4 mt-30 -73.77 -32.91 64.04 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-O 118.537 -0.744 . . . . 0.0 112.218 174.022 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 92.4 mt -57.96 -48.84 78.75 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-N 119.612 1.096 . . . . 0.0 110.283 165.989 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 29.3 tt0 -63.75 -30.83 71.88 Favored 'General case' 0 CA--C 1.544 0.74 0 N-CA-C 113.338 0.866 . . . . 0.0 113.338 179.904 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 18.0 t30 -60.29 -27.76 67.55 Favored 'General case' 0 CA--C 1.544 0.74 0 O-C-N 121.131 -0.981 . . . . 0.0 113.231 178.346 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 40.8 m-85 -93.96 8.04 42.83 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 125.604 1.561 . . . . 0.0 113.223 176.071 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 56.2 m -106.16 175.84 5.37 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 125.51 1.524 . . . . 0.0 112.619 174.713 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.254 1.314 0 C-N-CA 123.8 0.84 . . . . 0.0 111.792 171.93 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 45.1 t80 . . . . . 0 N--CA 1.49 1.533 0 CA-C-O 119.442 -0.313 . . . . 0.0 110.8 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 37.9 t 78.81 127.3 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.481 1.083 0 C-N-CA 128.482 2.713 . . . . 0.0 111.162 178.591 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -147.64 130.18 15.87 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 125.227 1.411 . . . . 0.0 111.394 171.097 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 21.5 mm100 -146.28 163.94 33.92 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 124.542 1.137 . . . . 0.0 111.244 -159.81 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 96.7 m-70 -80.79 131.75 35.44 Favored 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 108.885 -0.783 . . . . 0.0 108.885 157.743 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 77.0 mt -144.37 128.58 17.73 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 125.878 1.671 . . . . 0.0 108.895 -178.937 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 85.4 m -137.08 148.0 46.45 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 125.067 1.347 . . . . 0.0 110.569 -177.614 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 56.03 -128.54 45.78 Favored Glycine 0 CA--C 1.531 1.047 0 C-N-CA 124.762 1.172 . . . . 0.0 114.245 165.095 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 25.5 p -56.54 -42.78 79.08 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 124.524 1.129 . . . . 0.0 112.599 179.935 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 73.4 m-70 -70.57 -29.61 66.1 Favored 'General case' 0 CA--C 1.541 0.616 0 O-C-N 121.142 -0.974 . . . . 0.0 113.304 176.473 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 55.0 tp -67.7 -47.14 70.25 Favored 'General case' 0 N--CA 1.469 0.507 0 O-C-N 121.299 -0.876 . . . . 0.0 111.215 169.265 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 76.4 t -60.25 -39.62 81.26 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.016 0 C-N-CA 123.248 0.619 . . . . 0.0 111.211 175.931 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 44.3 tt0 -62.02 -50.06 73.57 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 125.464 1.506 . . . . 0.0 111.594 174.759 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -63.94 -45.36 89.53 Favored 'General case' 0 N--CA 1.469 0.501 0 O-C-N 121.628 -0.67 . . . . 0.0 112.066 178.985 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 33.5 tp -60.12 -44.56 94.78 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 124.722 1.209 . . . . 0.0 111.234 177.133 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 74.4 t80 -61.65 -37.36 83.72 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 124.126 0.97 . . . . 0.0 113.011 171.359 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 65.5 mt -71.11 -28.38 64.26 Favored 'General case' 0 N--CA 1.471 0.602 0 O-C-N 120.754 -1.216 . . . . 0.0 113.1 177.396 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 96.7 t -80.6 -39.74 18.7 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.152 0 C-N-CA 123.703 0.801 . . . . 0.0 111.478 173.283 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 72.6 m -124.06 -1.02 8.31 Favored 'General case' 0 N--CA 1.479 0.987 0 N-CA-C 116.281 1.956 . . . . 0.0 116.281 -162.216 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . -63.0 -22.15 64.45 Favored Glycine 0 N--CA 1.476 1.308 0 CA-C-N 119.707 1.14 . . . . 0.0 115.837 -165.167 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 35.2 mm-40 -74.47 -23.91 58.96 Favored 'General case' 0 CA--C 1.547 0.837 0 CA-C-N 118.416 1.108 . . . . 0.0 112.897 172.574 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 74.3 mtt180 -102.48 -39.36 7.16 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 125.857 1.663 . . . . 0.0 113.132 -177.503 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 99.97 148.49 22.72 Favored Glycine 0 CA--C 1.534 1.278 0 C-N-CA 125.775 1.655 . . . . 0.0 112.159 -166.694 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 39.8 p90 -133.49 167.88 19.64 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 125.288 1.435 . . . . 0.0 113.238 -175.053 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 98.1 m-85 -124.37 144.81 49.82 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 125.89 1.676 . . . . 0.0 110.713 173.734 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 59.9 t80 -133.7 123.26 24.66 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 125.146 1.379 . . . . 0.0 110.806 -169.018 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 8.8 t -167.64 143.77 3.42 Favored Pre-proline 0 N--CA 1.48 1.047 0 C-N-CA 125.322 1.449 . . . . 0.0 112.099 -175.052 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 87.0 Cg_endo -79.18 -29.37 3.21 Favored 'Trans proline' 0 C--N 1.348 0.53 0 C-N-CA 122.905 2.404 . . . . 0.0 112.21 167.705 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 40.8 pttt 164.21 148.32 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 129.793 3.237 . . . . 0.0 111.191 -172.251 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 17.5 p . . . . . 0 C--O 1.255 1.391 0 C-N-CA 125.874 1.67 . . . . 0.0 113.858 178.845 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 1.321 0 N-CA-C 110.655 -0.978 . . . . 0.0 110.655 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 14.5 tt -104.38 4.52 10.51 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.492 0 C-N-CA 130.119 3.368 . . . . 0.0 113.644 6.834 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 27.2 t -51.49 -44.09 32.45 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.166 0 C-N-CA 125.57 1.548 . . . . 0.0 112.449 -172.552 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 3.5 pm0 -72.15 -5.17 33.65 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 125.37 1.468 . . . . 0.0 113.957 -177.789 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 57.1 tp60 -104.18 -53.93 2.64 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 124.508 1.123 . . . . 0.0 110.076 165.849 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 1.8 t -81.12 -17.73 48.9 Favored 'General case' 0 N--CA 1.469 0.477 0 N-CA-C 114.67 1.359 . . . . 0.0 114.67 -165.457 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 27.4 t -87.93 -37.48 16.39 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 123.231 0.612 . . . . 0.0 112.139 -179.947 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 16.7 p -88.94 -52.65 4.98 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 126.71 2.004 . . . . 0.0 111.363 -178.916 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 14.2 t -102.37 -149.91 0.4 Allowed 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 125.778 1.631 . . . . 0.0 109.889 168.044 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 48.0 pt -113.12 160.89 12.44 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.659 0 C-N-CA 125.165 1.386 . . . . 0.0 111.882 178.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 15.5 p -139.48 163.2 33.15 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 123.99 0.916 . . . . 0.0 112.108 164.358 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 6.9 t -108.25 162.02 14.47 Favored 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 124.214 1.006 . . . . 0.0 112.925 179.852 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 6.7 mp -61.69 -32.3 72.49 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 124.412 1.085 . . . . 0.0 110.783 176.542 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 86.1 m-85 -65.3 -25.85 67.81 Favored 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 113.45 0.907 . . . . 0.0 113.45 173.932 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 75.2 mt-30 -82.32 -38.79 23.77 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 124.408 1.083 . . . . 0.0 110.921 172.887 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 85.3 mt -59.75 -38.07 80.72 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 119.257 0.935 . . . . 0.0 111.364 170.349 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 -64.95 -21.47 66.84 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 124.778 1.231 . . . . 0.0 113.022 173.184 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 21.9 t30 -82.91 -28.47 29.93 Favored 'General case' 0 CA--C 1.547 0.843 0 O-C-N 121.06 -1.025 . . . . 0.0 112.995 172.419 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 23.5 m-85 -78.36 -23.31 46.98 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 124.133 0.973 . . . . 0.0 113.198 171.234 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 14.0 t -62.0 145.82 51.94 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 124.537 1.135 . . . . 0.0 111.434 160.529 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.251 1.136 0 N-CA-C 113.019 0.748 . . . . 0.0 113.019 172.103 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 81.0 m-85 . . . . . 0 N--CA 1.489 1.475 0 CA-C-O 119.734 -0.174 . . . . 0.0 111.195 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 25.6 m -144.03 164.46 14.43 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.087 0 C-N-CA 125.448 1.499 . . . . 0.0 111.604 179.552 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -65.48 141.77 58.38 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 124.596 1.159 . . . . 0.0 112.228 169.23 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 39.9 mt-30 -145.42 161.52 39.48 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 123.747 0.819 . . . . 0.0 111.769 -163.43 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 97.8 m-70 -81.29 130.57 35.09 Favored 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 108.45 -0.944 . . . . 0.0 108.45 157.235 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 89.8 mt -147.37 138.42 23.69 Favored 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 125.133 1.373 . . . . 0.0 108.501 -177.604 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 3.6 t -149.64 154.85 39.27 Favored 'General case' 0 C--O 1.236 0.351 0 O-C-N 121.575 -0.703 . . . . 0.0 112.25 -178.462 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 54.11 -129.81 43.23 Favored Glycine 0 CA--C 1.53 0.986 0 C-N-CA 125.711 1.624 . . . . 0.0 113.668 174.334 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 33.4 p -57.75 -40.19 79.13 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 124.41 1.084 . . . . 0.0 112.821 -179.621 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 73.7 m-70 -71.57 -28.99 64.22 Favored 'General case' 0 CA--C 1.54 0.585 0 O-C-N 120.951 -1.093 . . . . 0.0 113.108 178.308 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 45.7 tp -70.22 -44.73 67.98 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 119.037 0.835 . . . . 0.0 111.449 169.9 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 76.3 t -62.55 -37.99 80.29 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.056 0 C-N-CA 122.961 0.504 . . . . 0.0 111.558 174.932 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -62.37 -51.0 69.33 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 125.593 1.557 . . . . 0.0 111.149 173.95 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.88 -45.44 93.76 Favored 'General case' 0 CA--C 1.542 0.635 0 O-C-N 121.809 -0.557 . . . . 0.0 111.74 179.264 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 31.0 tp -59.44 -47.48 85.31 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 124.835 1.254 . . . . 0.0 111.228 176.762 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 56.2 t80 -58.24 -43.04 87.62 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 123.978 0.911 . . . . 0.0 113.109 172.304 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 77.1 mt -70.65 -34.45 72.05 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 113.154 0.798 . . . . 0.0 113.154 -179.502 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 41.2 t -70.27 -43.27 78.69 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.011 0 C-N-CA 123.787 0.835 . . . . 0.0 111.146 172.099 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 44.6 t -81.0 -30.23 35.01 Favored 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 114.394 1.257 . . . . 0.0 114.394 -173.157 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 67.93 -147.1 47.52 Favored Glycine 0 CA--C 1.533 1.173 0 C-N-CA 124.604 1.097 . . . . 0.0 112.348 -172.992 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -69.7 -13.57 62.36 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 124.879 1.271 . . . . 0.0 113.616 -177.744 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 40.6 mtp85 -59.05 -37.24 76.54 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 124.773 1.229 . . . . 0.0 113.948 -173.67 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 90.98 150.4 24.87 Favored Glycine 0 CA--C 1.536 1.365 0 C-N-CA 124.94 1.257 . . . . 0.0 113.515 -176.141 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 35.2 p90 -137.46 159.94 40.53 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 125.086 1.354 . . . . 0.0 112.605 -171.448 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 69.5 t80 -88.66 145.99 25.34 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 124.811 1.245 . . . . 0.0 110.125 165.791 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 70.6 t80 -161.66 127.69 3.71 Favored 'General case' 0 C--O 1.239 0.55 0 C-N-CA 124.806 1.242 . . . . 0.0 111.845 179.775 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 27.9 p -144.35 146.11 31.75 Favored Pre-proline 0 N--CA 1.471 0.613 0 C-N-CA 126.183 1.793 . . . . 0.0 111.533 172.739 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 48.4 Cg_endo -79.02 178.34 7.64 Favored 'Trans proline' 0 CA--C 1.539 0.75 0 C-N-CA 123.925 3.083 . . . . 0.0 111.022 167.908 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 25.7 tptp -61.98 135.92 57.75 Favored 'General case' 0 CA--C 1.547 0.835 0 O-C-N 121.592 -0.693 . . . . 0.0 111.991 171.577 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 14.3 p . . . . . 0 C--O 1.249 1.078 0 C-N-CA 125.972 1.709 . . . . 0.0 114.326 175.981 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.451 0 N-CA-C 112.473 -0.251 . . . . 0.0 112.473 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 9.0 tp -66.5 -37.84 80.44 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 C-N-CA 123.946 0.898 . . . . 0.0 113.018 -171.258 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 98.5 t -70.3 -38.13 73.34 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.905 0 CA-C-N 119.204 0.911 . . . . 0.0 111.425 175.015 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -57.86 -46.54 84.67 Favored 'General case' 0 N--CA 1.472 0.674 0 CA-C-N 119.894 1.225 . . . . 0.0 110.398 174.546 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 8.3 tp-100 -64.2 -56.31 15.6 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 124.051 0.94 . . . . 0.0 111.04 178.96 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 4.2 t -79.62 -15.12 58.19 Favored 'General case' 0 N--CA 1.469 0.518 0 N-CA-C 114.777 1.399 . . . . 0.0 114.777 -169.027 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 14.0 t -92.99 -31.09 15.01 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 123.602 0.761 . . . . 0.0 112.606 178.347 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 56.4 p -94.44 -43.2 8.48 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 124.076 0.95 . . . . 0.0 112.144 175.856 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 60.4 m -108.64 -140.69 0.38 Allowed 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 126.203 1.801 . . . . 0.0 109.162 167.486 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 30.2 pt -127.81 163.04 32.38 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.974 0 C-N-CA 124.945 1.298 . . . . 0.0 112.508 -174.96 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 18.7 p -145.76 165.71 28.02 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 125.399 1.479 . . . . 0.0 110.88 167.297 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 95.3 p -111.56 164.1 13.35 Favored 'General case' 0 N--CA 1.467 0.416 0 C-N-CA 124.474 1.11 . . . . 0.0 112.093 177.461 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 70.7 mt -59.64 -32.49 70.49 Favored 'General case' 0 CA--C 1.537 0.447 0 O-C-N 121.576 -0.703 . . . . 0.0 111.489 170.56 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 62.2 m-85 -69.69 -29.09 66.43 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 125.21 1.404 . . . . 0.0 113.047 175.541 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 16.8 mm100 -75.6 -39.65 57.64 Favored 'General case' 0 N--CA 1.467 0.419 0 O-C-N 121.703 -0.623 . . . . 0.0 111.339 168.873 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 87.5 mt -62.15 -34.63 76.75 Favored 'General case' 0 N--CA 1.473 0.702 0 CA-C-N 119.492 1.042 . . . . 0.0 111.693 172.558 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -61.19 -30.11 70.21 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 124.199 0.999 . . . . 0.0 112.335 174.6 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 13.8 t-20 -72.7 -22.56 60.88 Favored 'General case' 0 CA--C 1.548 0.892 0 O-C-N 121.401 -0.812 . . . . 0.0 112.857 175.394 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 27.8 m-85 -85.25 -9.56 57.58 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 124.833 1.253 . . . . 0.0 113.736 173.188 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 61.3 m -65.82 149.4 50.23 Favored 'General case' 0 CA--C 1.543 0.699 0 CA-C-N 119.543 1.065 . . . . 0.0 112.409 172.186 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.253 1.238 0 C-N-CA 125.62 1.568 . . . . 0.0 112.267 178.311 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 95.9 m-85 . . . . . 0 N--CA 1.488 1.432 0 CA-C-O 119.66 -0.209 . . . . 0.0 111.097 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 12.5 p -160.94 142.18 3.67 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.982 0 C-N-CA 125.198 1.399 . . . . 0.0 110.514 176.443 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 11.4 p30 -135.54 152.22 51.09 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 125.594 1.558 . . . . 0.0 111.709 179.949 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 40.4 mt-30 -150.25 164.58 35.37 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.615 1.166 . . . . 0.0 111.09 -165.712 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 98.7 m-70 -86.78 132.54 33.82 Favored 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 108.462 -0.94 . . . . 0.0 108.462 153.527 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 89.2 mt -145.82 143.16 29.47 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 125.566 1.546 . . . . 0.0 108.767 -179.211 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 2.0 t -148.3 149.51 31.97 Favored 'General case' 0 N--CA 1.466 0.344 0 N-CA-C 112.608 0.595 . . . . 0.0 112.608 -173.185 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 44.2 -125.9 5.99 Favored Glycine 0 N--CA 1.471 1.006 0 C-N-CA 126.271 1.891 . . . . 0.0 114.349 173.641 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 19.8 m -60.13 -30.75 69.49 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 124.549 1.139 . . . . 0.0 113.021 -178.249 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 78.7 m-70 -78.63 -28.11 45.53 Favored 'General case' 0 CA--C 1.538 0.516 0 O-C-N 120.891 -1.131 . . . . 0.0 112.661 176.631 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 6.8 tt -68.21 -45.24 73.88 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 119.445 1.02 . . . . 0.0 110.644 165.884 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 73.3 t -57.56 -41.31 78.76 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.007 0 C-N-CA 123.631 0.772 . . . . 0.0 111.749 174.985 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 45.4 tt0 -61.56 -51.08 70.05 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 125.236 1.414 . . . . 0.0 111.279 174.293 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.43 -46.44 90.08 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 123.275 0.63 . . . . 0.0 111.547 179.09 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 51.5 tp -57.48 -53.52 57.19 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 126.185 1.794 . . . . 0.0 111.118 177.246 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 52.4 t80 -53.91 -43.56 69.81 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 123.656 0.783 . . . . 0.0 112.531 174.166 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 81.7 mt -70.24 -35.03 73.55 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 124.002 0.921 . . . . 0.0 113.065 179.726 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 37.1 t -65.09 -44.64 95.65 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.908 0 C-N-CA 124.369 1.068 . . . . 0.0 110.669 170.987 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 64.3 m -75.52 -28.61 59.18 Favored 'General case' 0 CA--C 1.541 0.607 0 N-CA-C 113.539 0.94 . . . . 0.0 113.539 -177.226 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 68.69 -116.5 7.43 Favored Glycine 0 CA--C 1.528 0.888 0 C-N-CA 124.646 1.117 . . . . 0.0 111.792 175.793 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 1.7 pm0 -73.21 -20.28 60.91 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 124.2 1.0 . . . . 0.0 113.474 174.196 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 76.9 mtp180 -74.32 147.27 42.42 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 124.227 1.011 . . . . 0.0 110.346 173.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . -76.78 -173.81 38.46 Favored Glycine 0 CA--C 1.53 1.013 0 C-N-CA 123.496 0.57 . . . . 0.0 111.937 167.607 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 42.8 p90 -149.01 153.74 38.32 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.192 0.997 . . . . 0.0 113.651 178.752 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 61.3 t80 -88.64 156.91 18.76 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 125.394 1.478 . . . . 0.0 109.645 159.699 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 65.9 t80 -157.33 144.95 18.82 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 124.022 0.929 . . . . 0.0 112.841 -171.237 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 2.2 p -137.72 119.75 10.95 Favored Pre-proline 0 N--CA 1.473 0.682 0 C-N-CA 125.699 1.599 . . . . 0.0 110.389 175.91 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 65.8 Cg_endo -79.16 -178.03 4.33 Favored 'Trans proline' 0 C--N 1.353 0.774 0 C-N-CA 124.603 3.535 . . . . 0.0 112.261 -174.742 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 52.0 tttt -69.79 -15.85 63.19 Favored 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 124.163 0.985 . . . . 0.0 113.593 178.259 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 11.5 m . . . . . 0 C--O 1.252 1.185 0 C-N-CA 127.363 2.265 . . . . 0.0 113.2 -174.404 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.192 0 N-CA-C 110.508 -1.037 . . . . 0.0 110.508 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 43.0 pt -107.74 -25.16 3.74 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.045 0 N-CA-C 113.872 1.064 . . . . 0.0 113.872 170.065 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 53.1 t -66.03 -34.48 70.52 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.036 0 C-N-CA 123.936 0.894 . . . . 0.0 112.608 -173.258 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -88.47 -43.45 11.44 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 118.568 0.622 . . . . 0.0 111.3 169.419 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 43.3 tp60 -63.91 -40.72 97.14 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 123.354 0.662 . . . . 0.0 112.725 -171.022 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 11.9 t -77.87 -13.39 59.9 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 118.953 0.797 . . . . 0.0 112.982 175.527 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 17.1 t -84.77 -40.08 17.67 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.05 0.94 . . . . 0.0 112.25 175.059 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 47.1 p -87.25 -48.41 8.04 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 124.937 1.295 . . . . 0.0 111.928 178.194 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 10.3 t -97.92 -146.89 0.31 Allowed 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 125.55 1.54 . . . . 0.0 109.996 166.753 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 31.0 pt -124.31 164.27 22.92 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.865 0 C-N-CA 125.915 1.686 . . . . 0.0 112.488 -177.522 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 19.7 p -149.26 173.33 13.6 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 125.264 1.425 . . . . 0.0 110.993 166.05 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 2.8 m -131.14 164.11 26.2 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 124.225 1.01 . . . . 0.0 111.473 -170.929 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 30.4 mt -62.33 -39.44 93.08 Favored 'General case' 0 N--CA 1.468 0.458 0 O-C-N 121.292 -0.88 . . . . 0.0 111.755 -175.521 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 20.2 p90 -65.68 -31.26 72.17 Favored 'General case' 0 N--CA 1.471 0.581 0 O-C-N 121.277 -0.889 . . . . 0.0 113.27 173.685 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 49.4 mt-30 -76.48 -31.16 57.6 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 123.475 0.71 . . . . 0.0 111.516 176.617 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 80.5 mt -66.52 -43.7 84.52 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 123.996 0.918 . . . . 0.0 111.062 168.459 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 31.8 tt0 -61.3 -23.64 65.84 Favored 'General case' 0 CA--C 1.547 0.83 0 N-CA-C 113.536 0.939 . . . . 0.0 113.536 -178.22 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 22.1 t30 -55.14 -28.43 52.68 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 124.404 1.082 . . . . 0.0 113.539 171.867 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 97.8 m-85 -93.35 5.71 50.63 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.819 1.648 . . . . 0.0 113.646 -178.404 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 68.7 m -105.51 164.35 11.95 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 125.862 1.665 . . . . 0.0 113.886 178.724 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.253 1.244 0 C-N-CA 124.744 1.218 . . . . 0.0 112.513 178.563 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 62.3 m-85 . . . . . 0 N--CA 1.487 1.386 0 CA-C-O 120.207 0.051 . . . . 0.0 110.982 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 14.6 p -150.33 144.39 17.29 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.981 0 C-N-CA 125.548 1.539 . . . . 0.0 110.649 177.914 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 5.9 p-10 -107.05 152.29 24.21 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 125.568 1.547 . . . . 0.0 112.611 177.644 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 43.2 mt-30 -148.2 165.26 31.45 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 125.45 1.5 . . . . 0.0 110.77 -177.578 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 96.1 m-70 -89.02 128.31 35.71 Favored 'General case' 0 CA--C 1.542 0.655 0 N-CA-C 108.178 -1.045 . . . . 0.0 108.178 156.236 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 74.5 mt -140.53 131.49 26.11 Favored 'General case' 0 N--CA 1.466 0.356 0 C-N-CA 124.738 1.215 . . . . 0.0 109.414 -176.884 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 57.0 m -125.94 136.82 53.46 Favored 'General case' 0 N--CA 1.467 0.4 0 C-N-CA 124.72 1.208 . . . . 0.0 110.726 -175.667 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 47.3 -118.02 3.67 Favored Glycine 0 N--CA 1.473 1.145 0 C-N-CA 125.404 1.478 . . . . 0.0 114.564 164.976 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 21.0 p -57.95 -35.9 71.78 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 124.563 1.145 . . . . 0.0 113.254 178.932 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 86.6 m-70 -76.33 -27.93 56.71 Favored 'General case' 0 CA--C 1.542 0.645 0 O-C-N 120.756 -1.215 . . . . 0.0 112.775 176.353 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 8.2 tt -67.03 -46.1 75.47 Favored 'General case' 0 N--CA 1.468 0.434 0 O-C-N 121.24 -0.912 . . . . 0.0 110.78 166.385 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 55.0 t -62.95 -36.39 75.5 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.142 0 C-N-CA 123.622 0.769 . . . . 0.0 111.638 177.543 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 44.2 tt0 -62.48 -51.03 69.07 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 125.503 1.521 . . . . 0.0 111.217 172.548 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.94 -46.42 90.77 Favored 'General case' 0 CA--C 1.539 0.542 0 O-C-N 121.777 -0.577 . . . . 0.0 111.797 177.543 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 53.8 tp -56.29 -49.25 74.78 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 125.688 1.595 . . . . 0.0 111.432 177.069 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 44.6 t80 -58.61 -42.55 88.41 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 123.628 0.771 . . . . 0.0 113.003 173.436 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 83.1 mt -74.6 -31.4 62.02 Favored 'General case' 0 N--CA 1.473 0.682 0 N-CA-C 113.208 0.818 . . . . 0.0 113.208 -177.845 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 41.4 t -67.27 -46.85 83.06 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.877 0 C-N-CA 124.333 1.053 . . . . 0.0 110.474 171.913 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 72.1 m -93.31 -24.96 17.95 Favored 'General case' 0 N--CA 1.469 0.497 0 N-CA-C 114.587 1.329 . . . . 0.0 114.587 -168.147 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 64.65 -136.46 38.87 Favored Glycine 0 CA--C 1.532 1.147 0 C-N-CA 124.478 1.037 . . . . 0.0 112.696 177.444 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -63.3 -17.47 62.56 Favored 'General case' 0 CA--C 1.544 0.728 0 N-CA-C 114.659 1.355 . . . . 0.0 114.659 -177.727 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 83.3 mtm180 -61.71 -31.52 71.68 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 124.506 1.122 . . . . 0.0 113.301 -177.952 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 79.41 166.87 33.01 Favored Glycine 0 CA--C 1.533 1.205 0 C-N-CA 124.403 1.002 . . . . 0.0 113.515 -177.03 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 47.7 p90 -152.7 165.47 35.18 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 124.584 1.154 . . . . 0.0 113.694 -168.15 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 87.4 t80 -152.94 104.82 2.87 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 125.15 1.38 . . . . 0.0 110.287 166.543 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 50.8 p90 -73.98 157.88 35.37 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 125.326 1.451 . . . . 0.0 113.149 177.493 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 34.4 m -93.0 120.33 67.12 Favored Pre-proline 0 N--CA 1.477 0.894 0 CA-C-O 118.173 -0.917 . . . . 0.0 109.382 166.921 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 79.9 Cg_endo -74.57 -170.97 0.82 Allowed 'Trans proline' 0 CA--C 1.538 0.701 0 C-N-CA 124.108 3.205 . . . . 0.0 111.45 -177.775 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 20.1 ptpt -61.73 137.02 58.21 Favored 'General case' 0 CA--C 1.548 0.866 0 O-C-N 121.544 -0.722 . . . . 0.0 112.891 175.433 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 34.8 p . . . . . 0 N--CA 1.485 1.279 0 C-N-CA 124.877 1.271 . . . . 0.0 112.928 -176.823 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.514 0 N-CA-C 111.809 -0.516 . . . . 0.0 111.809 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 43.4 pt -66.4 -24.4 33.25 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.098 0 N-CA-C 114.321 1.23 . . . . 0.0 114.321 -171.6 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 84.5 t -63.11 -32.55 56.67 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.114 0 CA-C-N 118.652 0.66 . . . . 0.0 111.539 174.371 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 44.1 tt0 -83.99 -53.7 5.38 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 118.431 0.559 . . . . 0.0 110.262 168.429 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 31.7 tt0 -64.81 -41.38 95.83 Favored 'General case' 0 CA--C 1.535 0.367 0 N-CA-C 113.275 0.842 . . . . 0.0 113.275 -165.448 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 4.5 t -85.24 -10.37 56.62 Favored 'General case' 0 N--CA 1.476 0.851 0 CA-C-N 119.907 1.231 . . . . 0.0 113.298 179.768 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 21.7 t -89.98 -34.55 15.95 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 124.863 1.265 . . . . 0.0 111.907 176.243 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 46.2 p -95.94 -45.33 6.98 Favored 'General case' 0 N--CA 1.478 0.925 0 C-N-CA 126.106 1.762 . . . . 0.0 112.518 179.151 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.6 t -104.42 -161.11 0.8 Allowed 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 125.177 1.391 . . . . 0.0 110.029 166.394 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 7.8 tt -113.45 154.06 14.9 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.903 0 C-N-CA 125.685 1.594 . . . . 0.0 111.289 -177.63 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 14.8 p -141.6 162.33 35.75 Favored 'General case' 0 N--CA 1.475 0.779 0 O-C-N 121.259 -0.9 . . . . 0.0 113.154 173.436 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 83.3 p -104.87 166.91 10.06 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 125.429 1.492 . . . . 0.0 113.1 -177.846 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 62.2 mt -63.83 -37.99 89.45 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 123.72 0.808 . . . . 0.0 111.87 174.419 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 20.8 p90 -68.4 -32.56 72.71 Favored 'General case' 0 N--CA 1.469 0.499 0 N-CA-C 113.296 0.85 . . . . 0.0 113.296 175.048 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 16.7 mm100 -70.57 -35.06 72.85 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-O 119.069 -0.491 . . . . 0.0 111.885 172.314 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 88.9 mt -66.94 -37.07 83.63 Favored 'General case' 0 N--CA 1.472 0.674 0 CA-C-N 119.15 0.886 . . . . 0.0 112.226 170.926 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -62.69 -25.6 68.24 Favored 'General case' 0 CA--C 1.543 0.694 0 N-CA-C 113.335 0.865 . . . . 0.0 113.335 -178.73 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 25.9 t30 -53.93 -28.5 37.38 Favored 'General case' 0 CA--C 1.548 0.877 0 C-N-CA 124.287 1.035 . . . . 0.0 113.347 171.74 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 98.7 m-85 -96.77 2.89 52.44 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 125.8 1.64 . . . . 0.0 114.19 -175.43 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 70.0 m -69.98 157.49 37.38 Favored 'General case' 0 CA--C 1.544 0.748 0 N-CA-C 113.418 0.895 . . . . 0.0 113.418 174.194 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.254 1.293 0 C-N-CA 126.367 1.867 . . . . 0.0 110.795 -179.72 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 79.1 m-85 . . . . . 0 N--CA 1.487 1.422 0 N-CA-C 111.373 0.138 . . . . 0.0 111.373 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 30.1 m -133.98 160.36 41.91 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.088 0 C-N-CA 126.127 1.771 . . . . 0.0 110.735 174.727 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 3.3 m120 -122.45 144.75 48.86 Favored 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 125.508 1.523 . . . . 0.0 111.654 -179.057 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 90.4 mt-30 -146.15 157.92 43.85 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 124.921 1.288 . . . . 0.0 110.569 -177.767 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 96.8 m-70 -86.26 131.08 34.31 Favored 'General case' 0 CA--C 1.541 0.615 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 162.67 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 83.5 mt -145.53 134.2 22.21 Favored 'General case' 0 N--CA 1.464 0.244 0 C-N-CA 124.899 1.28 . . . . 0.0 109.493 -168.652 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 2.0 t -151.12 153.31 34.77 Favored 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 123.857 0.863 . . . . 0.0 111.517 -176.601 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 48.14 -126.11 14.02 Favored Glycine 0 CA--C 1.532 1.116 0 C-N-CA 125.115 1.341 . . . . 0.0 113.707 176.137 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 19.4 m -60.19 -31.49 70.18 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 124.359 1.064 . . . . 0.0 112.938 -179.001 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 99.2 m-70 -74.41 -35.46 63.42 Favored 'General case' 0 CA--C 1.54 0.589 0 O-C-N 121.157 -0.964 . . . . 0.0 111.918 178.021 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 60.0 tp -67.32 -43.03 82.62 Favored 'General case' 0 N--CA 1.47 0.551 0 O-C-N 121.749 -0.594 . . . . 0.0 111.23 170.43 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 42.7 t -59.91 -42.16 88.38 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.951 0 C-N-CA 124.151 0.98 . . . . 0.0 111.583 174.448 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -64.66 -46.1 83.9 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 124.215 1.006 . . . . 0.0 111.828 174.596 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.3 -46.27 90.45 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 123.27 0.628 . . . . 0.0 112.319 177.641 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 42.3 mt -56.55 -51.95 66.63 Favored 'General case' 0 N--CA 1.466 0.34 0 C-N-CA 124.003 0.921 . . . . 0.0 111.191 173.584 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 59.1 t80 -54.25 -43.18 70.69 Favored 'General case' 0 CA--C 1.542 0.658 0 N-CA-C 112.767 0.655 . . . . 0.0 112.767 176.298 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 91.2 mt -74.05 -36.66 64.39 Favored 'General case' 0 N--CA 1.469 0.494 0 N-CA-C 113.516 0.932 . . . . 0.0 113.516 -179.664 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 33.4 t -66.65 -43.96 90.02 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.958 0 C-N-CA 124.358 1.063 . . . . 0.0 110.637 174.206 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 79.1 m -79.78 -30.61 40.71 Favored 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 113.262 0.838 . . . . 0.0 113.262 -175.291 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 69.21 -113.32 5.08 Favored Glycine 0 CA--C 1.53 0.989 0 C-N-CA 124.489 1.042 . . . . 0.0 111.836 173.041 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 39.7 mm-40 -71.54 -22.38 61.77 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 123.884 0.874 . . . . 0.0 112.819 174.882 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 84.0 mtm180 -75.27 154.25 37.54 Favored 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 124.749 1.22 . . . . 0.0 110.954 175.137 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . -77.72 -174.21 41.71 Favored Glycine 0 N--CA 1.472 1.047 0 C-N-CA 123.814 0.721 . . . . 0.0 111.692 169.321 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 55.1 p90 -157.73 165.5 35.23 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 124.835 1.254 . . . . 0.0 112.7 178.912 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 88.6 t80 -145.68 124.08 12.36 Favored 'General case' 0 N--CA 1.466 0.333 0 C-N-CA 124.867 1.267 . . . . 0.0 111.504 170.25 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 18.1 p90 -85.58 119.26 25.73 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 125.135 1.374 . . . . 0.0 111.335 175.981 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 22.3 p -78.45 129.46 74.55 Favored Pre-proline 0 N--CA 1.473 0.717 0 CA-C-O 118.378 -0.82 . . . . 0.0 110.38 177.477 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 26.7 Cg_endo -85.33 -135.41 0.02 OUTLIER 'Trans proline' 0 CA--C 1.543 0.926 0 C-N-CA 124.36 3.373 . . . . 0.0 111.032 -170.417 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 55.8 tptt -62.82 -26.72 68.88 Favored 'General case' 0 CA--C 1.55 0.947 0 C-N-CA 125.205 1.402 . . . . 0.0 113.366 175.966 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 19.4 m . . . . . 0 C--O 1.251 1.177 0 C-N-CA 127.4 2.28 . . . . 0.0 113.211 179.947 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.784 0 N-CA-C 112.261 -0.336 . . . . 0.0 112.261 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 9.4 tp -59.59 -39.57 79.8 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.069 0 N-CA-C 113.806 1.039 . . . . 0.0 113.806 -172.065 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 91.0 t -65.63 -48.56 82.15 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.986 0 CA-C-N 119.164 0.893 . . . . 0.0 109.73 -179.296 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 59.8 tt0 -55.8 -47.9 76.33 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 123.976 0.91 . . . . 0.0 111.355 174.831 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 20.6 tt0 -62.75 -48.33 79.63 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 123.01 0.524 . . . . 0.0 111.492 -179.238 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 65.9 m -63.63 -34.37 77.68 Favored 'General case' 0 N--CA 1.466 0.373 0 N-CA-C 113.766 1.024 . . . . 0.0 113.766 178.643 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 74.7 m -77.25 -38.61 50.7 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.753 0.821 . . . . 0.0 112.277 -179.013 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 78.9 p -95.97 -23.08 17.01 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 124.87 1.268 . . . . 0.0 113.74 -174.186 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.2 t -141.95 -169.3 2.89 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 125.599 1.56 . . . . 0.0 111.154 -177.844 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 38.0 mm -86.24 133.93 28.57 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.704 0 O-C-N 120.696 -1.253 . . . . 0.0 109.793 175.87 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 16.1 p -127.11 163.53 23.6 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 124.193 0.997 . . . . 0.0 112.163 170.908 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 96.5 p -108.28 158.64 17.3 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 124.259 1.024 . . . . 0.0 112.959 -177.581 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 55.6 mt -64.22 -34.18 77.51 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 123.738 0.815 . . . . 0.0 111.391 173.402 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 82.5 t80 -62.66 -35.83 80.89 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 123.756 0.823 . . . . 0.0 113.149 172.474 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 37.1 mt-30 -73.72 -32.76 64.04 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-O 118.502 -0.761 . . . . 0.0 112.121 173.775 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 81.7 mt -65.16 -40.4 94.27 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 119.594 1.088 . . . . 0.0 111.707 168.526 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -60.81 -26.93 67.66 Favored 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 113.478 0.918 . . . . 0.0 113.478 -177.1 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 18.9 t30 -55.34 -27.76 49.33 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 123.921 0.888 . . . . 0.0 113.323 172.522 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 97.0 m-85 -98.79 5.48 47.47 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 125.838 1.655 . . . . 0.0 114.251 -175.451 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 73.5 m -68.92 160.21 31.19 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 123.719 0.808 . . . . 0.0 113.09 169.936 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.252 1.224 0 C-N-CA 126.384 1.874 . . . . 0.0 110.871 -179.427 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 83.6 m-85 . . . . . 0 N--CA 1.485 1.303 0 N-CA-C 110.481 -0.192 . . . . 0.0 110.481 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 14.2 p -146.29 145.61 19.75 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.012 0 C-N-CA 129.182 2.993 . . . . 0.0 110.479 0.219 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 55.3 m-20 -80.31 139.86 36.41 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 124.539 1.136 . . . . 0.0 110.935 -178.069 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 28.9 mm-40 -149.69 167.92 25.08 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 124.1 0.96 . . . . 0.0 112.48 -165.359 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 88.1 m-70 -79.16 138.88 38.06 Favored 'General case' 0 CA--C 1.542 0.646 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 155.092 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 43.1 mt -151.17 136.17 17.42 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 124.78 1.232 . . . . 0.0 108.61 -175.617 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 2.3 t -155.41 153.97 31.21 Favored 'General case' 0 CA--C 1.534 0.328 0 O-C-N 121.549 -0.719 . . . . 0.0 112.343 -176.357 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 54.32 -130.97 45.5 Favored Glycine 0 CA--C 1.532 1.149 0 C-N-CA 125.195 1.379 . . . . 0.0 113.617 175.034 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 25.4 p -57.59 -38.0 74.15 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 124.353 1.061 . . . . 0.0 112.803 178.323 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 73.4 m-70 -71.95 -29.51 64.34 Favored 'General case' 0 CA--C 1.544 0.735 0 O-C-N 121.107 -0.995 . . . . 0.0 112.801 177.533 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 9.7 tt -66.74 -47.19 73.06 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 119.527 1.058 . . . . 0.0 110.877 168.123 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 58.3 t -61.87 -38.78 81.42 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.897 0 C-N-CA 123.239 0.616 . . . . 0.0 111.403 178.971 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -61.73 -51.86 66.62 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 125.709 1.604 . . . . 0.0 111.509 172.425 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.58 -46.16 91.07 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 123.231 0.612 . . . . 0.0 112.01 179.608 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 46.7 tp -58.19 -51.67 68.79 Favored 'General case' 0 CA--C 1.53 0.182 0 C-N-CA 124.807 1.243 . . . . 0.0 111.014 176.699 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 56.8 t80 -54.37 -42.59 70.5 Favored 'General case' 0 CA--C 1.543 0.678 0 N-CA-C 112.868 0.692 . . . . 0.0 112.868 174.262 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 83.0 mt -71.53 -34.68 70.26 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 124.093 0.957 . . . . 0.0 113.163 178.911 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 25.2 t -64.47 -44.42 96.99 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.844 0 C-N-CA 124.534 1.133 . . . . 0.0 110.419 171.277 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 79.4 m -72.61 -34.08 67.13 Favored 'General case' 0 CA--C 1.538 0.513 0 N-CA-C 113.129 0.789 . . . . 0.0 113.129 -178.651 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 69.78 -111.63 3.96 Favored Glycine 0 CA--C 1.529 0.927 0 C-N-CA 124.743 1.163 . . . . 0.0 111.797 173.619 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -70.16 -26.65 64.02 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 124.33 1.052 . . . . 0.0 112.061 174.955 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 83.6 mtm180 -72.44 154.37 40.91 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 124.886 1.274 . . . . 0.0 111.137 176.211 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . -79.86 -167.61 35.47 Favored Glycine 0 N--CA 1.471 0.977 0 C-N-CA 124.255 0.931 . . . . 0.0 111.353 167.817 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 52.9 p90 -159.53 162.85 35.53 Favored 'General case' 0 CA--C 1.538 0.506 0 N-CA-C 113.789 1.033 . . . . 0.0 113.789 179.248 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 83.1 t80 -156.94 106.31 2.23 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 125.733 1.613 . . . . 0.0 110.025 168.908 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 29.2 p90 -77.33 170.05 17.24 Favored 'General case' 0 CA--C 1.55 0.979 0 C-N-CA 125.073 1.349 . . . . 0.0 114.067 -179.331 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 63.3 m -133.91 122.36 16.4 Favored Pre-proline 0 N--CA 1.477 0.913 0 C-N-CA 125.25 1.42 . . . . 0.0 111.407 179.634 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 28.2 Cg_endo -88.53 -124.0 0.01 OUTLIER 'Trans proline' 0 CA--C 1.542 0.885 0 C-N-CA 124.916 3.744 . . . . 0.0 109.639 170.139 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 15.8 tppt? -71.0 -30.65 66.95 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 124.604 1.162 . . . . 0.0 113.391 177.483 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 33.7 m . . . . . 0 C--O 1.254 1.296 0 C-N-CA 126.265 1.826 . . . . 0.0 110.982 -172.63 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.553 0 N-CA-C 111.838 -0.505 . . . . 0.0 111.838 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . 0.433 HG21 ' H ' ' B' ' 27' ' ' THR . 19.1 tt -59.89 -35.99 63.94 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.079 0 CA-C-O 117.909 -1.044 . . . . 0.0 113.122 -175.524 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 29.5 t -66.25 -43.84 91.56 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.043 0 CA-C-N 120.16 1.346 . . . . 0.0 110.723 179.066 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 46.6 tt0 -62.65 -47.62 82.89 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 118.623 0.647 . . . . 0.0 111.078 174.085 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 63.1 tp60 -63.26 -37.11 85.97 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 123.005 0.522 . . . . 0.0 112.095 -177.426 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 78.2 m -85.64 -29.3 24.15 Favored 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 114.607 1.336 . . . . 0.0 114.607 -179.828 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 41.7 t -98.48 -57.16 2.26 Favored 'General case' 0 N--CA 1.473 0.724 0 N-CA-C 113.272 0.841 . . . . 0.0 113.272 -166.301 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 36.5 p -88.7 -33.02 17.69 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 124.178 0.991 . . . . 0.0 111.914 179.228 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.0 t -94.13 -162.61 0.96 Allowed 'General case' 0 CA--C 1.551 0.982 0 C-N-CA 123.531 0.733 . . . . 0.0 110.935 158.396 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 12.0 tt -118.22 146.55 22.6 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.907 0 C-N-CA 125.926 1.69 . . . . 0.0 111.048 174.95 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 14.9 p -132.45 159.23 39.95 Favored 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 113.122 0.786 . . . . 0.0 113.122 177.675 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 52.6 m -99.72 154.03 18.63 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 125.315 1.446 . . . . 0.0 112.186 -179.612 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 43.9 mt -59.37 -33.13 70.81 Favored 'General case' 0 N--CA 1.472 0.653 0 O-C-N 120.86 -1.15 . . . . 0.0 112.042 173.487 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 83.2 t80 -62.41 -30.69 71.4 Favored 'General case' 0 CA--C 1.546 0.804 0 N-CA-C 113.368 0.877 . . . . 0.0 113.368 171.673 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 94.0 mt-30 -80.15 -33.95 38.08 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 123.83 0.852 . . . . 0.0 111.365 174.895 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 56.3 mt -56.93 -48.49 78.15 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 118.841 0.746 . . . . 0.0 110.397 166.444 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -66.19 -31.7 72.69 Favored 'General case' 0 CA--C 1.544 0.712 0 N-CA-C 112.853 0.686 . . . . 0.0 112.853 179.279 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 32.8 t30 -62.9 -27.25 69.24 Favored 'General case' 0 CA--C 1.55 0.973 0 O-C-N 120.965 -1.084 . . . . 0.0 113.24 176.035 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 10.9 m-85 -80.6 -4.19 53.19 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 124.697 1.199 . . . . 0.0 113.894 172.324 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 72.1 m -102.86 172.79 6.63 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 124.905 1.282 . . . . 0.0 113.738 178.286 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 24.5 t-20 . . . . . 0 C--O 1.252 1.186 0 C-N-CA 125.167 1.387 . . . . 0.0 112.969 171.146 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 87.2 m-85 . . . . . 0 N--CA 1.485 1.285 0 N-CA-C 111.489 0.181 . . . . 0.0 111.489 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 69.0 t -80.95 136.31 23.43 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.989 0 C-N-CA 127.66 2.384 . . . . 0.0 109.758 -1.311 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -143.54 139.09 29.58 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 125.283 1.433 . . . . 0.0 111.201 -179.856 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 47.9 mm-40 -149.11 155.07 40.15 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 124.293 1.037 . . . . 0.0 110.694 -161.685 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 97.7 m-70 -87.69 122.95 32.0 Favored 'General case' 0 CA--C 1.539 0.552 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 164.545 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 77.5 mt -140.71 130.83 24.81 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 125.869 1.668 . . . . 0.0 109.139 -172.086 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 64.8 m -134.17 143.16 47.74 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 125.024 1.33 . . . . 0.0 111.091 -175.374 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 55.61 -125.66 37.31 Favored Glycine 0 N--CA 1.472 1.099 0 C-N-CA 124.763 1.173 . . . . 0.0 114.427 166.225 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 24.5 p -62.57 -34.57 77.24 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 124.382 1.073 . . . . 0.0 112.607 179.34 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 24.7 m80 -68.13 -38.7 82.5 Favored 'General case' 0 CA--C 1.541 0.622 0 O-C-N 121.275 -0.89 . . . . 0.0 111.422 176.038 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 50.4 tp -63.8 -49.43 72.91 Favored 'General case' 0 N--CA 1.464 0.272 0 C-N-CA 123.469 0.708 . . . . 0.0 111.172 170.889 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 47.8 t -58.32 -39.94 76.04 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.905 0 C-N-CA 123.093 0.557 . . . . 0.0 111.83 177.938 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -64.68 -49.75 69.71 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 123.786 0.835 . . . . 0.0 111.82 175.384 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.9 -46.89 88.86 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 123.34 0.656 . . . . 0.0 111.932 179.362 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 52.4 tp -56.0 -50.71 70.11 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 126.365 1.866 . . . . 0.0 111.409 175.482 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 91.4 t80 -61.14 -40.09 92.53 Favored 'General case' 0 CA--C 1.54 0.572 0 N-CA-C 112.998 0.74 . . . . 0.0 112.998 175.093 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 79.0 mt -72.7 -36.05 67.76 Favored 'General case' 0 N--CA 1.471 0.621 0 N-CA-C 113.284 0.846 . . . . 0.0 113.284 -179.828 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 25.5 t -63.31 -45.86 97.09 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.081 0 C-N-CA 123.43 0.692 . . . . 0.0 110.45 171.408 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 69.7 m -83.6 -19.18 35.97 Favored 'General case' 0 CA--C 1.54 0.576 0 N-CA-C 114.193 1.183 . . . . 0.0 114.193 -173.685 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 76.44 -126.09 7.98 Favored Glycine 0 CA--C 1.53 1.019 0 C-N-CA 124.724 1.154 . . . . 0.0 111.574 174.146 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -72.5 -13.39 61.41 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 123.78 0.832 . . . . 0.0 113.121 175.677 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 87.7 mtm180 -71.07 159.16 35.22 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 124.645 1.178 . . . . 0.0 112.511 178.504 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . -91.76 157.72 24.64 Favored Glycine 0 CA--C 1.528 0.873 0 C-N-CA 125.631 1.586 . . . . 0.0 112.246 174.981 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 49.1 p90 -127.42 151.8 48.35 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 125.255 1.422 . . . . 0.0 112.757 -178.553 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 30.2 t80 -94.25 162.82 13.69 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 126.38 1.872 . . . . 0.0 110.267 165.413 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 38.5 t80 -158.22 126.61 5.41 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 123.754 0.821 . . . . 0.0 112.21 -168.671 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 27' ' ' THR . . . . . 0.433 ' H ' HG21 ' A' ' 2' ' ' ILE . 38.0 p -143.18 133.63 12.26 Favored Pre-proline 0 N--CA 1.478 0.946 0 C-N-CA 125.549 1.54 . . . . 0.0 112.62 -172.81 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 88.5 Cg_endo -82.04 -85.34 0.0 OUTLIER 'Trans proline' 0 CA--C 1.538 0.677 0 C-N-CA 123.75 2.967 . . . . 0.0 110.546 171.523 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 57.2 tttp -157.84 139.84 14.16 Favored 'General case' 0 CA--C 1.549 0.92 0 C-N-CA 126.519 1.928 . . . . 0.0 110.555 -175.772 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 17.8 p . . . . . 0 C--O 1.251 1.168 0 C-N-CA 128.524 2.73 . . . . 0.0 112.339 -6.563 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.651 0 N-CA-C 111.286 -0.726 . . . . 0.0 111.286 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 12.4 tt -74.57 -24.48 18.57 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.987 0 N-CA-C 114.868 1.433 . . . . 0.0 114.868 -174.697 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 91.3 t -64.26 -42.21 94.76 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.922 0 CA-C-N 119.33 0.968 . . . . 0.0 110.441 -174.403 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -62.33 -44.01 97.5 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 124.855 1.262 . . . . 0.0 111.359 176.731 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 17.5 tt0 -61.96 -56.44 19.18 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.074 0.949 . . . . 0.0 110.138 177.763 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 70.3 m -56.1 -33.43 65.08 Favored 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 113.759 1.022 . . . . 0.0 113.759 -179.728 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 12.6 t -91.38 -34.84 14.71 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 124.251 1.02 . . . . 0.0 113.691 -171.77 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 43.2 p -108.43 -26.08 10.65 Favored 'General case' 0 N--CA 1.482 1.134 0 N-CA-C 114.485 1.291 . . . . 0.0 114.485 -176.149 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 95.8 p -115.41 -131.28 0.32 Allowed 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 124.43 1.092 . . . . 0.0 109.129 162.337 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 10.0 tt -135.22 149.54 28.9 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 C-N-CA 125.219 1.408 . . . . 0.0 110.46 -177.95 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 15.6 p -140.26 157.19 45.97 Favored 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 113.427 0.899 . . . . 0.0 113.427 178.062 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 22.8 t -100.16 158.8 15.59 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-O 122.254 1.026 . . . . 0.0 113.151 178.271 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 52.7 mt -63.38 -33.92 76.6 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 123.847 0.859 . . . . 0.0 110.947 170.838 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 77.2 t80 -63.06 -29.58 70.92 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 124.103 0.961 . . . . 0.0 112.962 173.481 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 98.5 mt-30 -81.55 -38.88 25.49 Favored 'General case' 0 N--CA 1.467 0.381 0 C-N-CA 123.769 0.828 . . . . 0.0 110.736 176.101 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 86.8 mt -59.23 -36.06 74.75 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-N 119.135 0.88 . . . . 0.0 111.96 170.128 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -59.57 -26.98 65.86 Favored 'General case' 0 CA--C 1.546 0.799 0 N-CA-C 113.462 0.912 . . . . 0.0 113.462 178.722 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 26.4 t30 -60.86 -24.51 65.97 Favored 'General case' 0 CA--C 1.55 0.978 0 O-C-N 120.903 -1.123 . . . . 0.0 113.119 173.654 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 84.2 m-85 -98.47 5.96 47.59 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 126.429 1.892 . . . . 0.0 113.247 -178.079 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 71.1 m -72.63 163.6 27.8 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 123.881 0.872 . . . . 0.0 112.753 166.12 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.251 1.15 0 C-N-CA 126.595 1.958 . . . . 0.0 110.712 179.228 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 86.8 m-85 . . . . . 0 N--CA 1.49 1.556 0 N-CA-C 111.217 0.081 . . . . 0.0 111.217 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 28.5 m -138.32 158.81 32.05 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.134 0 C-N-CA 125.769 1.628 . . . . 0.0 110.457 176.019 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -121.96 142.91 49.83 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 124.89 1.276 . . . . 0.0 113.417 178.086 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 38.5 mt-30 -147.4 163.04 37.73 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 124.961 1.305 . . . . 0.0 111.434 -168.427 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 98.2 m-70 -80.11 132.68 35.99 Favored 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 109.02 -0.733 . . . . 0.0 109.02 156.74 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 76.5 mt -148.21 139.13 23.14 Favored 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 125.327 1.451 . . . . 0.0 109.082 -176.464 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 2.8 t -159.14 155.7 27.7 Favored 'General case' 0 N--CA 1.468 0.474 0 O-C-N 121.587 -0.695 . . . . 0.0 111.904 -177.472 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 54.1 -135.17 44.02 Favored Glycine 0 CA--C 1.53 1.004 0 C-N-CA 124.922 1.249 . . . . 0.0 113.593 175.072 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 20.0 m -58.15 -33.02 68.73 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 124.056 0.942 . . . . 0.0 112.552 -179.712 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 76.2 m-70 -75.67 -28.76 58.83 Favored 'General case' 0 CA--C 1.543 0.688 0 O-C-N 121.102 -0.999 . . . . 0.0 112.85 178.565 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 9.3 tt -66.15 -46.52 77.19 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 119.312 0.96 . . . . 0.0 110.757 166.198 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 95.4 t -62.36 -38.93 82.45 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.766 0 C-N-CA 122.906 0.482 . . . . 0.0 111.396 179.364 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -62.13 -51.27 68.55 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 125.751 1.62 . . . . 0.0 111.691 172.234 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.04 -46.09 92.14 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 123.159 0.584 . . . . 0.0 111.913 179.151 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 58.5 tp -57.59 -53.19 60.96 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 124.66 1.184 . . . . 0.0 110.84 175.858 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 38.6 t80 -53.73 -41.42 67.05 Favored 'General case' 0 CA--C 1.543 0.693 0 N-CA-C 112.886 0.699 . . . . 0.0 112.886 175.308 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 83.2 mt -72.93 -33.08 65.72 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 124.203 1.001 . . . . 0.0 113.457 178.813 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 25.6 t -65.83 -43.91 93.07 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.922 0 C-N-CA 124.343 1.057 . . . . 0.0 110.344 170.78 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 69.5 m -73.07 -39.56 65.78 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 122.952 0.501 . . . . 0.0 112.335 -178.206 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 62.83 -104.35 0.78 Allowed Glycine 0 CA--C 1.533 1.176 0 C-N-CA 124.244 0.926 . . . . 0.0 112.059 174.006 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -77.05 -21.42 54.51 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 124.362 1.065 . . . . 0.0 113.854 175.045 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 1.4 mpp_? -73.52 154.01 40.05 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 123.528 0.731 . . . . 0.0 109.985 166.866 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . -77.4 -171.31 35.75 Favored Glycine 0 CA--C 1.534 1.267 0 C-N-CA 124.154 0.883 . . . . 0.0 111.248 166.101 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 43.8 p90 -156.53 162.96 39.9 Favored 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 113.969 1.1 . . . . 0.0 113.969 179.405 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 92.0 t80 -155.39 109.05 2.82 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 125.436 1.494 . . . . 0.0 110.412 169.584 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 31.3 p90 -79.81 155.05 28.05 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 124.776 1.23 . . . . 0.0 112.199 173.99 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 46.2 p -117.75 86.08 23.46 Favored Pre-proline 0 N--CA 1.478 0.955 0 C-N-CA 125.317 1.447 . . . . 0.0 111.328 -176.601 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 23.5 Cg_endo -91.36 -174.79 0.66 Allowed 'Trans proline' 0 CA--C 1.541 0.868 0 C-N-CA 124.373 3.382 . . . . 0.0 112.442 -177.157 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 2.4 ptpp? -159.06 161.46 36.51 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 126.227 1.811 . . . . 0.0 112.124 164.414 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 17.4 p . . . . . 0 C--O 1.253 1.267 0 C-N-CA 125.779 1.632 . . . . 0.0 113.181 177.676 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.581 0 N-CA-C 111.833 -0.507 . . . . 0.0 111.833 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 18.8 tt -61.95 -38.52 80.89 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.986 0 N-CA-C 114.432 1.271 . . . . 0.0 114.432 -167.696 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 61.5 t -68.51 -36.26 73.94 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.075 0 CA-C-N 120.004 1.274 . . . . 0.0 110.971 -176.653 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 79.5 mm-40 -72.13 -43.32 64.89 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 118.761 0.71 . . . . 0.0 111.149 171.912 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 66.3 tp60 -63.08 -36.24 82.93 Favored 'General case' 0 CA--C 1.534 0.34 0 O-C-N 121.744 -0.598 . . . . 0.0 112.135 -178.794 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 68.3 m -85.77 -29.8 23.55 Favored 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 114.575 1.324 . . . . 0.0 114.575 179.641 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 17.6 t -107.47 -41.67 5.01 Favored 'General case' 0 N--CA 1.473 0.698 0 N-CA-C 113.59 0.959 . . . . 0.0 113.59 -169.53 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 44.3 m -84.54 -46.34 11.69 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 125.013 1.325 . . . . 0.0 109.596 176.132 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 31.4 m -96.8 -162.74 0.98 Allowed 'General case' 0 CA--C 1.55 0.961 0 C-N-CA 124.643 1.177 . . . . 0.0 111.278 166.63 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 12.1 tt -111.38 148.3 14.74 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.944 0 C-N-CA 125.469 1.508 . . . . 0.0 110.154 170.996 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 14.7 p -135.5 163.12 30.81 Favored 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 113.554 0.946 . . . . 0.0 113.554 179.911 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 36.2 t -103.0 156.45 17.66 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 124.46 1.104 . . . . 0.0 112.6 177.07 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 69.0 mt -60.12 -30.0 69.0 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 123.977 0.911 . . . . 0.0 111.606 169.964 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 77.2 t80 -65.07 -27.39 68.74 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 123.997 0.919 . . . . 0.0 113.287 171.66 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 86.9 mt-30 -85.32 -33.16 22.15 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 124.061 0.944 . . . . 0.0 110.826 175.685 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 9.5 mp -56.18 -47.52 78.16 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 118.555 0.616 . . . . 0.0 110.749 165.274 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -66.35 -31.22 71.87 Favored 'General case' 0 CA--C 1.546 0.79 0 N-CA-C 112.817 0.673 . . . . 0.0 112.817 177.68 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 24.3 t30 -64.36 -26.94 68.69 Favored 'General case' 0 CA--C 1.547 0.856 0 O-C-N 120.953 -1.092 . . . . 0.0 112.902 173.934 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 10.7 m-85 -85.03 8.07 19.16 Favored 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 125.329 1.452 . . . . 0.0 114.02 171.901 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 73.3 m -112.11 168.32 9.7 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 125.153 1.381 . . . . 0.0 113.408 175.556 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 23.7 t-20 . . . . . 0 C--O 1.253 1.241 0 C-N-CA 124.875 1.27 . . . . 0.0 113.084 179.337 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 12.7 p90 . . . . . 0 N--CA 1.485 1.3 0 N-CA-C 111.359 0.133 . . . . 0.0 111.359 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 30.6 m -137.98 160.54 33.08 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.225 0 C-N-CA 125.832 1.653 . . . . 0.0 110.857 176.315 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 44.4 p-10 -113.4 147.39 37.84 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 124.842 1.257 . . . . 0.0 113.541 177.308 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 44.8 mt-30 -150.86 158.9 44.72 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 125.796 1.638 . . . . 0.0 110.953 -172.334 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 96.9 m-70 -87.52 127.78 35.24 Favored 'General case' 0 CA--C 1.54 0.59 0 N-CA-C 108.963 -0.754 . . . . 0.0 108.963 159.989 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 87.4 mt -140.62 131.41 25.84 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 125.876 1.67 . . . . 0.0 108.715 -173.476 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 71.7 m -138.07 146.23 42.7 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 124.483 1.113 . . . . 0.0 111.56 -172.861 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 55.57 -131.67 49.33 Favored Glycine 0 N--CA 1.471 0.978 0 C-N-CA 124.961 1.267 . . . . 0.0 114.208 165.262 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 22.6 m -59.13 -33.17 70.55 Favored 'General case' 0 N--CA 1.468 0.465 0 C-N-CA 124.241 1.016 . . . . 0.0 112.375 -179.543 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 75.2 m-70 -75.88 -27.8 57.89 Favored 'General case' 0 CA--C 1.542 0.639 0 O-C-N 121.065 -1.022 . . . . 0.0 112.813 176.336 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 54.9 tp -70.15 -46.79 63.98 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-N 119.104 0.865 . . . . 0.0 110.604 167.26 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 74.4 t -55.93 -43.0 73.41 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.306 0 CA-C-N 118.744 0.702 . . . . 0.0 111.43 174.675 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -60.45 -48.99 79.37 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 125.442 1.497 . . . . 0.0 111.477 173.039 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.35 -42.87 99.4 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 123.467 0.707 . . . . 0.0 112.673 179.215 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -52.71 -55.16 24.69 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-N 119.432 1.014 . . . . 0.0 110.58 172.576 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 70.6 t80 -60.21 -35.12 74.71 Favored 'General case' 0 CA--C 1.543 0.691 0 N-CA-C 113.471 0.915 . . . . 0.0 113.471 178.753 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 83.9 mt -74.93 -34.07 62.05 Favored 'General case' 0 N--CA 1.472 0.649 0 N-CA-C 113.524 0.935 . . . . 0.0 113.524 177.43 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 49.5 t -71.16 -42.89 75.58 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.918 0 C-N-CA 123.812 0.845 . . . . 0.0 110.765 174.544 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 70.2 m -102.67 -24.63 13.74 Favored 'General case' 0 N--CA 1.468 0.463 0 N-CA-C 114.771 1.397 . . . . 0.0 114.771 -165.76 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 64.59 -140.6 42.93 Favored Glycine 0 CA--C 1.534 1.231 0 C-N-CA 124.094 0.854 . . . . 0.0 112.315 -178.536 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 57.3 mp0 -65.03 -11.87 44.03 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 125.732 1.613 . . . . 0.0 114.19 -178.412 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 82.6 mtm180 -61.95 -28.79 69.79 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 124.195 0.998 . . . . 0.0 113.322 177.662 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 81.04 162.35 28.23 Favored Glycine 0 CA--C 1.532 1.155 0 C-N-CA 124.53 1.062 . . . . 0.0 112.918 -178.195 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 54.7 p90 -143.54 158.75 43.41 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 125.201 1.4 . . . . 0.0 113.48 -169.501 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 78.3 m-85 -108.0 159.37 16.61 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 126.573 1.949 . . . . 0.0 110.648 169.912 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 62.2 t80 -157.87 126.68 5.65 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 125.158 1.383 . . . . 0.0 110.682 -169.0 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 11.8 t -169.62 143.73 2.28 Favored Pre-proline 0 N--CA 1.482 1.164 0 C-N-CA 125.162 1.385 . . . . 0.0 112.679 -170.752 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 41.2 Cg_endo -81.42 -132.8 0.01 OUTLIER 'Trans proline' 0 CA--C 1.54 0.8 0 C-N-CA 125.051 3.834 . . . . 0.0 110.179 172.826 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 28.4 ttpp -60.59 119.91 9.0 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 124.294 1.038 . . . . 0.0 112.592 -174.993 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 8.2 p . . . . . 0 C--O 1.253 1.248 0 C-N-CA 126.934 2.094 . . . . 0.0 112.423 -179.403 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.467 0 N-CA-C 111.841 -0.504 . . . . 0.0 111.841 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 48.5 pt -59.97 -29.46 43.42 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.968 0 C-N-CA 124.08 0.952 . . . . 0.0 113.142 -176.91 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 56.1 t -61.55 -31.66 51.28 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.07 0 CA-C-N 118.918 0.781 . . . . 0.0 112.08 177.938 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 14.4 mm-40 -82.84 -56.25 3.93 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 118.286 0.493 . . . . 0.0 110.618 167.333 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 1.2 tm0? -60.86 -46.41 90.71 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 123.035 0.534 . . . . 0.0 112.237 -166.673 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 70.4 m -76.65 -21.41 55.49 Favored 'General case' 0 N--CA 1.467 0.398 0 N-CA-C 114.289 1.218 . . . . 0.0 114.289 -177.339 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 10.6 t -100.69 -32.3 10.8 Favored 'General case' 0 CA--C 1.541 0.598 0 N-CA-C 113.244 0.831 . . . . 0.0 113.244 -173.851 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 44.5 p -95.76 -14.63 23.16 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 125.211 1.404 . . . . 0.0 113.429 176.586 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 84.3 p -144.34 -174.49 4.32 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 125.546 1.538 . . . . 0.0 110.173 174.279 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 16.9 tt -91.38 138.05 20.54 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.817 0 O-C-N 120.614 -1.304 . . . . 0.0 110.388 178.652 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 8.7 p -132.29 159.05 40.25 Favored 'General case' 0 N--CA 1.469 0.51 0 O-C-N 121.207 -0.933 . . . . 0.0 113.014 178.547 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 36.7 m -106.96 162.32 13.94 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 124.787 1.235 . . . . 0.0 111.145 -175.852 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 24.8 mt -59.32 -33.0 70.58 Favored 'General case' 0 CA--C 1.535 0.393 0 O-C-N 121.164 -0.96 . . . . 0.0 110.934 172.108 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 89.3 t80 -60.15 -33.16 71.78 Favored 'General case' 0 CA--C 1.546 0.815 0 N-CA-C 113.821 1.045 . . . . 0.0 113.821 170.68 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 14.0 mm100 -75.18 -33.92 61.5 Favored 'General case' 0 N--CA 1.471 0.589 0 O-C-N 121.537 -0.727 . . . . 0.0 111.217 174.941 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 93.2 mt -65.85 -44.33 85.8 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-N 118.307 0.503 . . . . 0.0 111.165 170.45 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -68.67 -26.83 65.51 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 125.325 1.45 . . . . 0.0 112.94 -177.078 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 18.6 t30 -52.73 -32.65 44.18 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 124.922 1.289 . . . . 0.0 113.771 179.773 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 84.3 m-85 -96.1 0.37 51.32 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 125.112 1.365 . . . . 0.0 114.365 -177.366 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 88.8 m -91.35 167.03 12.59 Favored 'General case' 0 CA--C 1.542 0.635 0 N-CA-C 114.333 1.234 . . . . 0.0 114.333 178.941 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.252 1.204 0 C-N-CA 127.129 2.172 . . . . 0.0 110.919 -176.008 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 67.0 m-85 . . . . . 0 N--CA 1.484 1.257 0 CA-C-O 119.807 -0.139 . . . . 0.0 111.184 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 7.1 p -158.45 155.83 4.32 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.082 0 C-N-CA 125.005 1.322 . . . . 0.0 111.1 -175.982 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 44.2 p-10 -69.18 146.99 51.96 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 124.541 1.136 . . . . 0.0 112.403 172.806 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 41.4 mt-30 -148.34 162.55 39.3 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.039 0.936 . . . . 0.0 111.625 -160.535 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 95.7 m-70 -88.26 132.63 34.31 Favored 'General case' 0 CA--C 1.54 0.57 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 157.689 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 91.5 mt -144.43 132.5 21.6 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 125.347 1.459 . . . . 0.0 109.406 -174.668 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 62.6 m -139.52 151.2 45.94 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 125.159 1.384 . . . . 0.0 110.641 -175.909 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 57.78 -133.14 52.79 Favored Glycine 0 N--CA 1.473 1.112 0 C-N-CA 124.499 1.047 . . . . 0.0 114.466 165.558 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 13.5 t -59.1 -39.41 82.14 Favored 'General case' 0 N--CA 1.472 0.645 0 O-C-N 121.928 -0.748 . . . . 0.0 111.776 -179.875 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 22.1 m-70 -67.39 -29.56 69.1 Favored 'General case' 0 CA--C 1.544 0.716 0 O-C-N 120.524 -1.36 . . . . 0.0 112.62 178.285 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 55.9 tp -69.46 -40.32 77.21 Favored 'General case' 0 CA--C 1.54 0.572 0 O-C-N 121.524 -0.735 . . . . 0.0 111.508 169.753 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 85.5 t -60.87 -45.49 98.07 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.269 0 C-N-CA 123.101 0.56 . . . . 0.0 110.794 172.926 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -61.26 -48.1 82.98 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 124.039 0.936 . . . . 0.0 111.138 177.639 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.48 -47.59 84.95 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 118.499 0.59 . . . . 0.0 111.686 -179.612 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 61.6 tp -55.3 -52.67 62.71 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 124.57 1.148 . . . . 0.0 111.571 176.164 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 25.9 t80 -57.55 -42.27 82.64 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 123.733 0.813 . . . . 0.0 112.629 175.863 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 81.8 mt -74.95 -32.25 61.69 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 124.145 0.978 . . . . 0.0 113.195 -177.678 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 26.8 t -66.08 -47.42 85.0 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 C-N-CA 123.882 0.873 . . . . 0.0 110.405 171.563 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 85.7 m -84.1 -27.46 28.19 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 113.059 0.763 . . . . 0.0 113.059 -172.2 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 69.1 -118.33 8.65 Favored Glycine 0 N--CA 1.468 0.786 0 C-N-CA 124.837 1.208 . . . . 0.0 112.221 169.141 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -70.58 -19.53 62.85 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 124.38 1.072 . . . . 0.0 113.702 175.591 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 89.3 mtm180 -72.59 158.77 35.04 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 124.976 1.31 . . . . 0.0 111.524 177.433 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . -78.22 147.62 31.86 Favored Glycine 0 N--CA 1.467 0.745 0 N-CA-C 110.939 -0.864 . . . . 0.0 110.939 175.152 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 52.6 p90 -128.02 160.1 32.96 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 124.141 0.976 . . . . 0.0 113.054 179.572 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 27.6 t80 -138.46 119.56 14.51 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 124.818 1.247 . . . . 0.0 110.67 175.376 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 81.4 t80 -87.57 89.63 8.07 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 125.808 1.643 . . . . 0.0 110.255 -175.319 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 27.8 p -72.44 123.9 90.11 Favored Pre-proline 0 N--CA 1.472 0.631 0 C-N-CA 123.287 0.635 . . . . 0.0 111.662 -172.426 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 16.5 Cg_endo -86.72 -142.11 0.02 OUTLIER 'Trans proline' 0 CA--C 1.54 0.797 0 C-N-CA 124.432 3.422 . . . . 0.0 111.724 -166.574 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 71.3 mmtt -69.78 12.47 0.2 Allowed 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 128.721 2.809 . . . . 0.0 115.081 -177.033 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 14.2 p . . . . . 0 C--O 1.252 1.205 0 C-N-CA 126.216 1.807 . . . . 0.0 113.985 176.682 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.765 0 N-CA-C 111.854 -0.498 . . . . 0.0 111.854 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 10.5 tp -59.69 -31.49 47.22 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.159 0 C-N-CA 124.116 0.967 . . . . 0.0 113.118 -174.258 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 82.9 t -59.22 -45.2 93.11 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.963 0 CA-C-N 118.465 0.575 . . . . 0.0 111.422 176.308 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -70.63 -42.79 70.42 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-N 119.108 0.867 . . . . 0.0 111.15 176.02 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 71.0 tp60 -58.96 -42.83 90.84 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 123.172 0.589 . . . . 0.0 111.647 -179.62 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 97.9 m -76.1 -31.35 58.66 Favored 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 114.487 1.292 . . . . 0.0 114.487 177.707 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 30.3 t -98.06 -43.5 7.02 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 113.468 0.914 . . . . 0.0 113.468 -167.852 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 64.3 m -88.97 -38.47 14.43 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 125.216 1.406 . . . . 0.0 110.926 179.81 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 9.5 t -107.91 -155.86 0.56 Allowed 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 124.923 1.289 . . . . 0.0 110.758 167.561 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 29.8 pt -107.81 152.39 9.55 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.565 0 C-N-CA 125.715 1.606 . . . . 0.0 111.609 172.912 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 14.0 p -139.57 164.21 30.52 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 123.799 0.84 . . . . 0.0 112.276 171.997 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 32.8 t -107.23 156.65 18.62 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 124.111 0.964 . . . . 0.0 113.068 179.251 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 62.9 mt -60.21 -33.08 71.74 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 124.176 0.991 . . . . 0.0 111.081 170.051 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 79.9 t80 -61.85 -28.6 69.6 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 124.685 1.194 . . . . 0.0 113.287 172.241 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 86.1 mt-30 -82.1 -39.56 23.19 Favored 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 123.642 0.777 . . . . 0.0 110.955 174.033 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 40.5 mt -58.16 -37.52 74.86 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-N 118.905 0.775 . . . . 0.0 112.218 172.662 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -59.01 -30.81 68.27 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 124.271 1.028 . . . . 0.0 113.181 179.216 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 89.0 m-20 -66.46 -18.78 65.55 Favored 'General case' 0 CA--C 1.544 0.725 0 O-C-N 121.127 -0.983 . . . . 0.0 113.511 179.196 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 92.2 m-85 -92.93 -7.41 46.13 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.177 1.391 . . . . 0.0 113.341 177.163 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 13.7 t -72.38 154.34 40.96 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 124.835 1.254 . . . . 0.0 112.162 171.323 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 20.1 t-20 . . . . . 0 C--O 1.251 1.144 0 C-N-CA 124.562 1.145 . . . . 0.0 111.929 170.446 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 20.7 p90 . . . . . 0 N--CA 1.486 1.368 0 N-CA-C 111.346 0.128 . . . . 0.0 111.346 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 27.1 m -141.14 158.38 22.74 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.113 0 C-N-CA 125.782 1.633 . . . . 0.0 111.162 -179.582 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 11.2 p30 -108.33 149.41 28.7 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 124.857 1.263 . . . . 0.0 112.562 173.235 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 39.3 mt-30 -151.69 167.81 26.99 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.836 1.654 . . . . 0.0 111.224 -171.857 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 99.5 m-70 -87.02 133.34 33.6 Favored 'General case' 0 CA--C 1.541 0.63 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 153.312 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 85.4 mt -145.55 138.72 26.25 Favored 'General case' 0 N--CA 1.466 0.374 0 C-N-CA 126.039 1.736 . . . . 0.0 108.806 -177.812 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 3.3 t -155.79 153.88 30.51 Favored 'General case' 0 N--CA 1.47 0.53 0 O-C-N 121.373 -0.83 . . . . 0.0 112.357 -175.899 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 50.6 -127.44 26.9 Favored Glycine 0 N--CA 1.472 1.042 0 C-N-CA 125.185 1.374 . . . . 0.0 113.69 175.327 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 16.1 m -58.27 -34.75 70.85 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 124.193 0.997 . . . . 0.0 112.556 178.881 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 80.5 m-70 -76.19 -27.54 56.94 Favored 'General case' 0 CA--C 1.541 0.614 0 O-C-N 121.363 -0.836 . . . . 0.0 113.121 178.477 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 56.3 tp -69.17 -45.41 70.08 Favored 'General case' 0 N--CA 1.469 0.492 0 O-C-N 121.423 -0.798 . . . . 0.0 110.889 168.042 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 77.7 t -62.59 -37.28 78.52 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.08 0 C-N-CA 123.607 0.763 . . . . 0.0 111.467 175.715 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 43.9 tt0 -63.54 -48.55 77.02 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 125.174 1.389 . . . . 0.0 111.462 172.507 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.51 -43.54 98.57 Favored 'General case' 0 CA--C 1.54 0.593 0 O-C-N 121.563 -0.71 . . . . 0.0 112.253 178.243 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 18.4 mt -54.7 -48.69 72.15 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 124.244 1.017 . . . . 0.0 111.008 171.67 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 80.6 t80 -62.85 -37.33 86.41 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 113.201 0.815 . . . . 0.0 113.201 176.193 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 78.5 mt -72.95 -34.65 66.66 Favored 'General case' 0 N--CA 1.47 0.564 0 O-C-N 121.266 -0.896 . . . . 0.0 112.891 178.551 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 44.8 t -73.3 -41.86 57.62 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 C-N-CA 124.236 1.014 . . . . 0.0 111.299 174.935 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 44.5 t -90.05 -30.73 17.53 Favored 'General case' 0 CA--C 1.537 0.479 0 N-CA-C 113.957 1.095 . . . . 0.0 113.957 -171.995 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 71.01 -155.71 52.89 Favored Glycine 0 CA--C 1.532 1.102 0 C-N-CA 124.223 0.916 . . . . 0.0 112.078 -171.093 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -71.34 -3.77 22.44 Favored 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 124.746 1.218 . . . . 0.0 113.98 179.734 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 58.5 mtp180 -57.8 -34.09 69.26 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 124.845 1.258 . . . . 0.0 113.178 175.49 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 88.04 147.0 12.5 Favored Glycine 0 CA--C 1.531 1.061 0 C-N-CA 125.349 1.452 . . . . 0.0 112.83 178.746 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 52.2 p90 -137.87 166.66 23.49 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 125.27 1.428 . . . . 0.0 112.21 -173.234 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 88.7 t80 -146.42 103.35 3.68 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 124.661 1.184 . . . . 0.0 110.279 174.377 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 44.6 p90 -76.07 178.84 6.03 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 125.246 1.418 . . . . 0.0 112.765 176.093 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 12.2 t -136.94 128.77 16.87 Favored Pre-proline 0 N--CA 1.476 0.843 0 C-N-CA 124.287 1.035 . . . . 0.0 111.673 173.017 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 42.5 Cg_endo -84.49 -175.65 2.22 Favored 'Trans proline' 0 C--N 1.351 0.659 0 C-N-CA 123.841 3.027 . . . . 0.0 112.102 -177.801 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 80.6 tttt -72.78 -25.39 61.15 Favored 'General case' 0 CA--C 1.55 0.943 0 C-N-CA 123.827 0.851 . . . . 0.0 112.843 168.671 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 8.3 m . . . . . 0 C--O 1.253 1.241 0 C-N-CA 127.011 2.125 . . . . 0.0 113.368 -175.279 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 1.275 0 N-CA-C 110.465 -1.054 . . . . 0.0 110.465 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 10.3 tp -111.15 -30.64 2.28 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.126 0 N-CA-C 113.161 0.8 . . . . 0.0 113.161 174.076 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 86.5 t -63.47 -44.85 98.98 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.036 0 CA-C-N 119.792 1.178 . . . . 0.0 112.334 -176.459 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -73.8 -36.44 65.01 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 119.344 0.974 . . . . 0.0 111.312 175.595 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 8.0 tt0 -61.42 -36.79 81.32 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 124.317 1.047 . . . . 0.0 111.882 179.699 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 95.6 m -88.65 -27.93 20.96 Favored 'General case' 0 CA--C 1.534 0.353 0 N-CA-C 114.679 1.363 . . . . 0.0 114.679 176.807 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 20.7 t -102.04 -46.05 4.98 Favored 'General case' 0 N--CA 1.475 0.781 0 N-CA-C 113.281 0.845 . . . . 0.0 113.281 -169.456 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 22.8 m -86.24 -44.72 11.93 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 125.39 1.476 . . . . 0.0 109.829 178.636 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 69.0 m -95.26 -169.55 2.0 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 124.567 1.147 . . . . 0.0 110.739 163.251 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 32.4 pt -108.35 144.94 16.03 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.755 0 C-N-CA 124.914 1.286 . . . . 0.0 110.403 169.485 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 19.3 p -126.41 151.82 47.17 Favored 'General case' 0 N--CA 1.47 0.575 0 C-N-CA 123.744 0.818 . . . . 0.0 112.332 176.683 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 90.1 p -91.05 166.93 12.74 Favored 'General case' 0 C--N 1.323 -0.56 0 C-N-CA 124.392 1.077 . . . . 0.0 113.428 174.648 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 46.6 mt -61.65 -34.78 76.3 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 123.339 0.656 . . . . 0.0 111.505 169.74 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 59.5 m-85 -66.4 -33.92 76.8 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.599 1.159 . . . . 0.0 112.698 175.001 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 85.5 mt-30 -75.29 -35.27 61.33 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 124.323 1.049 . . . . 0.0 112.026 173.056 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 93.3 mt -61.52 -42.04 98.21 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-N 119.582 1.083 . . . . 0.0 111.049 168.19 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -60.0 -30.18 68.96 Favored 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 123.936 0.895 . . . . 0.0 112.682 179.463 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 15.9 t-20 -64.54 -22.49 66.98 Favored 'General case' 0 CA--C 1.55 0.962 0 N-CA-C 113.402 0.889 . . . . 0.0 113.402 176.486 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 61.7 m-85 -99.34 2.4 45.32 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.644 1.578 . . . . 0.0 114.126 178.905 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 37.7 m -65.74 147.89 52.65 Favored 'General case' 0 N--CA 1.474 0.73 0 O-C-N 121.144 -0.973 . . . . 0.0 111.135 163.124 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.252 1.204 0 C-N-CA 123.835 0.854 . . . . 0.0 112.764 174.327 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 77.7 m-85 . . . . . 0 N--CA 1.486 1.357 0 CA-C-O 119.885 -0.102 . . . . 0.0 110.769 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 2.0 t 61.62 36.93 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.334 0 C-N-CA 125.27 1.428 . . . . 0.0 111.943 -179.185 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 9.3 m120 -79.71 138.11 37.24 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 125.854 1.662 . . . . 0.0 111.557 178.194 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 43.5 mt-30 -145.5 159.33 43.27 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 125.212 1.405 . . . . 0.0 110.64 -174.628 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 62.4 m-70 -82.31 127.46 33.24 Favored 'General case' 0 CA--C 1.537 0.456 0 N-CA-C 108.766 -0.827 . . . . 0.0 108.766 156.359 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 93.0 mt -141.87 132.68 25.75 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 126.014 1.726 . . . . 0.0 108.092 -177.726 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 3.0 t -153.84 153.92 32.99 Favored 'General case' 0 N--CA 1.468 0.434 0 O-C-N 121.044 -1.035 . . . . 0.0 112.279 -173.91 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 55.45 -129.54 46.59 Favored Glycine 0 CA--C 1.529 0.96 0 C-N-CA 125.097 1.332 . . . . 0.0 113.331 176.676 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 20.5 p -60.96 -33.99 74.05 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 124.506 1.123 . . . . 0.0 112.734 177.718 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 26.1 m80 -68.7 -36.66 78.76 Favored 'General case' 0 CA--C 1.542 0.652 0 O-C-N 121.229 -0.919 . . . . 0.0 111.708 176.292 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 55.7 tp -67.07 -46.04 75.49 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 123.072 0.549 . . . . 0.0 111.004 171.409 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 55.1 t -58.52 -42.56 84.86 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.992 0 C-N-CA 122.959 0.503 . . . . 0.0 111.126 177.011 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -64.98 -47.81 76.24 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 124.175 0.99 . . . . 0.0 111.415 176.562 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.7 -47.5 83.36 Favored 'General case' 0 CA--C 1.54 0.568 0 O-C-N 121.42 -0.8 . . . . 0.0 111.789 -179.508 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 31.0 tp -60.87 -45.65 93.7 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 124.388 1.075 . . . . 0.0 111.019 177.778 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 83.9 t80 -56.79 -43.66 81.14 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 123.621 0.768 . . . . 0.0 112.926 172.758 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 79.7 mt -72.75 -33.41 66.35 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 123.677 0.791 . . . . 0.0 113.04 -179.619 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 41.2 t -68.14 -43.34 85.13 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.739 0 C-N-CA 123.742 0.817 . . . . 0.0 111.105 172.837 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 83.5 m -82.35 -30.27 30.46 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 113.664 0.987 . . . . 0.0 113.664 -175.407 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 62.77 -131.24 43.36 Favored Glycine 0 CA--C 1.531 1.053 0 C-N-CA 124.487 1.041 . . . . 0.0 112.176 -178.771 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 31.1 mm-40 -64.9 -18.95 65.64 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 124.929 1.292 . . . . 0.0 114.193 -176.246 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -70.52 -43.08 70.34 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 124.128 0.971 . . . . 0.0 112.763 -174.19 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 86.19 -179.44 49.58 Favored Glycine 0 CA--C 1.534 1.28 0 C-N-CA 124.359 0.98 . . . . 0.0 113.017 -168.278 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 43.4 p90 -152.65 166.31 32.5 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 125.35 1.46 . . . . 0.0 113.261 -170.032 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 47.7 t80 -114.42 108.08 16.41 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.648 1.179 . . . . 0.0 110.01 169.137 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 60.2 t80 -75.05 94.48 2.89 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 125.089 1.355 . . . . 0.0 110.979 -177.112 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 52.1 m -93.52 117.47 67.35 Favored Pre-proline 0 N--CA 1.475 0.808 0 C-N-CA 124.4 1.08 . . . . 0.0 111.139 -168.623 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 67.0 Cg_endo -75.12 -169.5 0.65 Allowed 'Trans proline' 0 C--N 1.352 0.733 0 C-N-CA 124.504 3.469 . . . . 0.0 111.759 -176.613 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 22.9 tptm -55.02 121.9 9.74 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 123.865 0.866 . . . . 0.0 111.676 171.065 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 25.5 p . . . . . 0 C--O 1.254 1.32 0 C-N-CA 124.882 1.273 . . . . 0.0 112.634 176.272 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.684 0 N-CA-C 111.684 -0.566 . . . . 0.0 111.684 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 24.7 pt -85.24 -24.07 7.07 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.374 0 CA-C-N 118.805 1.302 . . . . 0.0 114.132 -179.37 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 45.4 t -63.19 -44.84 99.53 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.032 0 C-N-CA 123.9 0.88 . . . . 0.0 111.144 -168.194 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 14.2 pm0 -69.55 -30.61 68.46 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 125.398 1.479 . . . . 0.0 112.651 176.828 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 33.5 tt0 -73.5 -45.4 54.15 Favored 'General case' 0 N--CA 1.465 0.315 0 C-N-CA 124.093 0.957 . . . . 0.0 110.422 177.25 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 67.0 m -60.01 -24.07 64.18 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 124.545 1.138 . . . . 0.0 113.326 170.835 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 9.5 t -84.78 -51.36 6.84 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 124.129 0.972 . . . . 0.0 111.095 -179.644 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 47.2 p -79.68 -23.47 42.43 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 125.531 1.532 . . . . 0.0 113.721 -175.913 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.5 t -140.37 -173.7 3.75 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 125.857 1.663 . . . . 0.0 110.818 175.008 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 39.1 pt -81.86 144.37 10.49 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.398 0 O-C-N 120.905 -1.122 . . . . 0.0 111.539 175.634 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 12.6 p -137.29 165.69 25.57 Favored 'General case' 0 N--CA 1.466 0.329 0 C-N-CA 124.677 1.191 . . . . 0.0 110.979 166.958 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 96.0 p -108.54 166.55 10.7 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 124.374 1.07 . . . . 0.0 113.73 -174.92 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 56.1 mt -64.38 -35.26 80.32 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 123.376 0.67 . . . . 0.0 112.092 175.013 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 29.1 p90 -68.95 -32.23 71.67 Favored 'General case' 0 N--CA 1.468 0.452 0 O-C-N 121.103 -0.998 . . . . 0.0 113.19 174.034 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 39.0 mt-30 -70.92 -33.69 70.77 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-O 118.819 -0.61 . . . . 0.0 112.187 171.819 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 76.0 mt -65.29 -40.39 93.79 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-N 119.417 1.008 . . . . 0.0 111.608 167.086 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 23.1 tt0 -62.54 -24.02 67.29 Favored 'General case' 0 CA--C 1.54 0.579 0 N-CA-C 113.213 0.82 . . . . 0.0 113.213 -178.125 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 19.9 t-20 -57.58 -26.39 61.41 Favored 'General case' 0 CA--C 1.552 1.034 0 O-C-N 120.967 -1.083 . . . . 0.0 113.367 171.883 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 2.4 m-30 -89.73 -10.35 46.0 Favored 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 125.008 1.323 . . . . 0.0 113.839 174.705 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 64.0 m -70.41 158.76 35.41 Favored 'General case' 0 N--CA 1.479 1.003 0 CA-C-N 120.315 1.416 . . . . 0.0 111.823 171.77 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.253 1.255 0 N-CA-C 112.743 0.645 . . . . 0.0 112.743 166.86 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 69.5 m-85 . . . . . 0 N--CA 1.488 1.436 0 CA-C-O 120.466 0.174 . . . . 0.0 111.438 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 12.6 p -154.74 153.78 7.75 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.83 0 C-N-CA 126.558 1.943 . . . . 0.0 109.396 179.258 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -126.97 142.72 51.48 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 124.842 1.257 . . . . 0.0 113.414 179.54 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 44.7 mt-30 -149.06 163.93 36.11 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 125.683 1.593 . . . . 0.0 110.904 -170.822 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 36.0 m-70 -81.96 132.49 35.26 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 108.915 -0.772 . . . . 0.0 108.915 156.345 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 86.7 mt -146.11 135.2 22.68 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 126.541 1.936 . . . . 0.0 108.851 -177.06 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 4.4 t -151.91 153.57 34.39 Favored 'General case' 0 N--CA 1.467 0.424 0 O-C-N 121.445 -0.785 . . . . 0.0 112.395 -173.386 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 51.53 -132.05 35.02 Favored Glycine 0 CA--C 1.531 1.075 0 C-N-CA 125.38 1.466 . . . . 0.0 113.831 174.817 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 19.8 m -58.56 -36.7 74.32 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 124.341 1.056 . . . . 0.0 112.108 -179.899 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 19.5 m-70 -71.54 -30.8 66.32 Favored 'General case' 0 CA--C 1.541 0.603 0 O-C-N 121.148 -0.97 . . . . 0.0 112.478 179.007 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 7.8 tt -67.01 -44.54 80.08 Favored 'General case' 0 C--N 1.343 0.288 0 O-C-N 121.37 -0.831 . . . . 0.0 111.227 166.381 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 72.4 t -60.1 -38.3 76.42 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.072 0 CA-C-N 118.907 0.776 . . . . 0.0 111.525 177.467 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -63.74 -50.49 68.9 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.496 1.118 . . . . 0.0 111.669 171.604 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.45 -44.23 97.47 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 118.578 0.626 . . . . 0.0 112.21 179.946 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 48.0 tp -57.99 -53.05 62.66 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 125.738 1.615 . . . . 0.0 110.698 175.375 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 51.9 t80 -54.34 -42.21 69.97 Favored 'General case' 0 CA--C 1.543 0.676 0 N-CA-C 112.952 0.723 . . . . 0.0 112.952 174.053 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 77.3 mt -69.94 -35.44 74.52 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 123.983 0.913 . . . . 0.0 112.857 178.682 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 39.6 t -64.21 -44.39 97.45 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.853 0 C-N-CA 124.483 1.113 . . . . 0.0 111.039 170.603 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 56.5 m -73.17 -29.04 62.56 Favored 'General case' 0 CA--C 1.54 0.591 0 N-CA-C 112.961 0.726 . . . . 0.0 112.961 -179.002 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 70.57 -120.1 8.84 Favored Glycine 0 CA--C 1.529 0.918 0 C-N-CA 125.03 1.3 . . . . 0.0 110.748 177.492 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 37.4 mp0 -67.3 -22.4 65.63 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 124.581 1.152 . . . . 0.0 112.659 173.566 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 56.2 mtm-85 -79.18 153.97 29.63 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 124.479 1.111 . . . . 0.0 111.451 -179.724 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . -86.76 -178.35 49.21 Favored Glycine 0 CA--C 1.529 0.943 0 C-N-CA 125.128 1.347 . . . . 0.0 112.618 172.327 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 42.0 p90 -146.06 151.94 38.53 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 124.659 1.183 . . . . 0.0 114.15 -176.74 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 64.1 t80 -81.21 160.38 24.32 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 126.458 1.903 . . . . 0.0 109.76 161.151 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 68.8 t80 -159.41 139.12 11.6 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 124.966 1.306 . . . . 0.0 111.718 -178.886 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 9.6 t -170.0 127.42 0.78 Allowed Pre-proline 0 N--CA 1.479 0.987 0 C-N-CA 126.144 1.778 . . . . 0.0 111.486 171.585 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 21.5 Cg_endo -87.96 -156.5 0.06 OUTLIER 'Trans proline' 0 CA--C 1.54 0.79 0 C-N-CA 124.641 3.561 . . . . 0.0 111.268 179.767 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 47.2 tttp -60.53 139.45 57.76 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 124.271 1.028 . . . . 0.0 113.34 176.646 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 28.4 m . . . . . 0 C--O 1.253 1.247 0 C-N-CA 125.986 1.714 . . . . 0.0 111.065 165.225 . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.533 0 N-CA-C 111.533 -0.627 . . . . 0.0 111.533 . . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . 0.4 ' H ' ' C ' ' B' ' 30' ' ' THR . 13.9 tt -166.97 -58.6 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.474 0.761 0 C-N-CA 126.374 1.869 . . . . 0.0 112.801 -171.557 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 78.0 t -74.56 -23.94 18.29 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.321 0 CA-C-N 120.798 1.636 . . . . 0.0 113.525 -169.217 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 68.5 mm-40 -100.79 -44.12 5.89 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 119.074 0.852 . . . . 0.0 109.923 164.378 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 54.7 tt0 -59.21 -45.26 91.56 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 123.967 0.907 . . . . 0.0 113.159 -172.354 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 2.6 t -84.71 -16.74 40.71 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-N 119.756 1.162 . . . . 0.0 113.381 -177.07 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 79.5 m -76.53 -41.67 45.93 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 123.966 0.906 . . . . 0.0 111.809 170.992 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 72.3 p -93.94 -36.31 12.24 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 125.147 1.379 . . . . 0.0 112.928 -175.001 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.9 t -121.08 -160.2 0.84 Allowed 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 126.268 1.827 . . . . 0.0 110.255 174.342 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 69.5 mt -103.3 144.39 14.0 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.746 0 C-N-CA 125.555 1.542 . . . . 0.0 110.163 -178.129 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 15.1 p -130.92 157.7 42.23 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 123.845 0.858 . . . . 0.0 112.749 164.472 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 59.6 p -95.33 162.91 13.48 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 124.784 1.234 . . . . 0.0 113.234 177.358 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 51.6 mt -61.47 -33.39 73.68 Favored 'General case' 0 N--CA 1.468 0.462 0 O-C-N 121.502 -0.749 . . . . 0.0 111.781 172.027 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 58.2 m-85 -65.15 -33.9 77.12 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 123.853 0.861 . . . . 0.0 112.654 173.824 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 90.0 mt-30 -75.76 -34.41 60.25 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 124.061 0.944 . . . . 0.0 111.567 174.166 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 83.3 mt -62.45 -41.11 98.5 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 119.767 1.167 . . . . 0.0 111.49 167.967 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 31.8 tt0 -62.92 -27.32 69.29 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 123.669 0.788 . . . . 0.0 112.89 -179.482 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 15.5 t-20 -59.79 -21.89 61.44 Favored 'General case' 0 CA--C 1.549 0.919 0 N-CA-C 113.485 0.92 . . . . 0.0 113.485 175.237 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 86.5 m-85 -97.39 -0.58 46.05 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 125.419 1.488 . . . . 0.0 114.266 178.255 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 55.5 m -66.66 149.87 49.88 Favored 'General case' 0 CA--C 1.543 0.676 0 O-C-N 121.071 -1.018 . . . . 0.0 111.356 167.424 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 33.3 m120 . . . . . 0 C--O 1.251 1.139 0 C-N-CA 124.896 1.278 . . . . 0.0 112.63 173.478 . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 30.6 p90 . . . . . 0 N--CA 1.484 1.243 0 CA-C-O 119.642 -0.218 . . . . 0.0 110.63 . . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . 0.277 26.9 m 45.65 66.87 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.173 0 C-N-CA 126.097 1.759 . . . . 0.0 113.012 -169.954 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 1.5 p-10 -148.54 142.62 25.96 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 124.894 1.278 . . . . 0.0 112.974 -172.787 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 28.6 mm-40 -152.57 167.94 27.21 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 125.302 1.441 . . . . 0.0 112.041 -169.041 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 98.2 m-70 -83.21 138.23 33.7 Favored 'General case' 0 CA--C 1.543 0.682 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 155.903 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 79.2 mt -151.86 133.95 15.07 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 124.907 1.283 . . . . 0.0 109.08 -175.156 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 2.0 t -151.59 152.05 32.37 Favored 'General case' 0 N--CA 1.465 0.318 0 N-CA-C 112.8 0.667 . . . . 0.0 112.8 -177.815 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 60.99 -130.68 47.95 Favored Glycine 0 CA--C 1.529 0.969 0 C-N-CA 124.886 1.231 . . . . 0.0 113.472 175.543 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 19.8 p -61.3 -33.69 73.99 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 124.016 0.927 . . . . 0.0 112.161 179.481 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 11.6 m80 -64.36 -40.95 96.86 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 124.461 1.104 . . . . 0.0 111.557 176.472 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 60.2 tp -68.33 -43.67 77.02 Favored 'General case' 0 N--CA 1.468 0.433 0 C-N-CA 124.119 0.968 . . . . 0.0 111.461 176.001 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 79.5 t -64.35 -37.77 80.81 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.958 0 C-N-CA 123.422 0.689 . . . . 0.0 111.858 176.172 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -67.19 -45.44 76.88 Favored 'General case' 0 N--CA 1.466 0.375 0 C-N-CA 124.196 0.999 . . . . 0.0 111.581 173.722 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.43 -45.29 91.98 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 123.173 0.589 . . . . 0.0 111.735 176.976 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 27.4 mt -53.63 -54.79 32.67 Favored 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 124.29 1.036 . . . . 0.0 111.526 171.371 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 90.0 t80 -54.86 -42.48 72.06 Favored 'General case' 0 CA--C 1.543 0.688 0 N-CA-C 112.763 0.653 . . . . 0.0 112.763 177.774 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 92.4 mt -74.65 -35.36 62.85 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 124.158 0.983 . . . . 0.0 113.274 -178.893 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 33.9 t -68.07 -43.89 84.98 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 C-N-CA 124.034 0.934 . . . . 0.0 110.664 173.661 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 84.6 m -77.43 -32.11 54.41 Favored 'General case' 0 CA--C 1.54 0.591 0 N-CA-C 112.782 0.66 . . . . 0.0 112.782 -176.409 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 69.14 -119.76 9.85 Favored Glycine 0 N--CA 1.467 0.746 0 C-N-CA 124.354 0.978 . . . . 0.0 111.438 174.927 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -64.25 -24.49 67.68 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 124.839 1.255 . . . . 0.0 112.658 174.203 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 83.9 mtm180 -75.56 146.22 40.62 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 124.625 1.17 . . . . 0.0 110.95 175.896 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . -75.72 178.62 47.98 Favored Glycine 0 N--CA 1.475 1.248 0 C-N-CA 123.4 0.524 . . . . 0.0 111.968 166.514 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 55.0 p90 -148.27 161.23 41.93 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 124.074 0.949 . . . . 0.0 113.231 174.343 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 83.3 t80 -146.22 99.37 3.23 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 124.896 1.278 . . . . 0.0 110.145 171.613 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -68.27 167.12 15.02 Favored 'General case' 0 CA--C 1.553 1.06 0 C-N-CA 125.183 1.393 . . . . 0.0 113.589 168.305 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 16.8 p -57.58 -36.39 45.08 Favored Pre-proline 0 N--CA 1.483 1.204 0 N-CA-C 116.699 2.111 . . . . 0.0 116.699 -159.22 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 17.0 Cg_endo -102.17 65.21 0.38 Allowed 'Cis proline' 0 CA--C 1.541 0.873 0 CA-C-N 122.992 2.104 . . . . 0.0 110.112 -24.182 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -151.48 6.18 0.47 Allowed 'General case' 0 N--CA 1.482 1.16 0 N-CA-C 114.714 1.375 . . . . 0.0 114.714 -174.737 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 30' ' ' THR . . . . . 0.4 ' C ' ' H ' ' A' ' 2' ' ' ILE . 20.0 p . . . . . 0 C--O 1.248 1.026 0 C-N-CA 128.317 2.647 . . . . 0.0 109.057 -178.638 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.658 0 N-CA-C 111.607 -0.597 . . . . 0.0 111.607 . . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 45.7 pt -93.91 4.49 8.0 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.441 0 N-CA-C 115.042 1.497 . . . . 0.0 115.042 -169.074 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 60.5 t -54.34 -44.07 64.76 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.273 0 C-N-CA 124.74 1.216 . . . . 0.0 112.553 -176.541 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -76.44 -44.0 37.68 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 122.858 0.463 . . . . 0.0 110.83 173.602 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -59.22 -49.17 78.87 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 124.827 1.251 . . . . 0.0 111.822 -173.063 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 8.1 t -74.91 -17.99 60.48 Favored 'General case' 0 N--CA 1.472 0.626 0 N-CA-C 113.542 0.941 . . . . 0.0 113.542 -176.696 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 42.3 t -90.06 -41.41 11.7 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 124.977 1.311 . . . . 0.0 112.46 177.286 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 50.1 m -82.35 -44.68 15.87 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 126.718 2.007 . . . . 0.0 110.572 -177.784 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 73.0 m -108.77 -132.4 0.32 Allowed 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 125.948 1.699 . . . . 0.0 108.512 165.851 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 29.8 pt -136.73 161.9 35.64 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.776 0 C-N-CA 125.843 1.657 . . . . 0.0 112.184 -174.363 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 13.8 p -150.81 162.96 39.74 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 123.664 0.786 . . . . 0.0 112.38 167.046 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 10.8 t -106.88 164.11 12.39 Favored 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 125.3 1.44 . . . . 0.0 112.752 -177.919 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 28.5 mt -60.36 -35.62 76.11 Favored 'General case' 0 N--CA 1.468 0.425 0 C-N-CA 124.724 1.209 . . . . 0.0 111.945 -178.526 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 80.3 t80 -62.93 -29.98 71.21 Favored 'General case' 0 CA--C 1.543 0.685 0 N-CA-C 113.665 0.987 . . . . 0.0 113.665 172.349 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 75.8 mt-30 -82.2 -30.95 30.59 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 123.724 0.809 . . . . 0.0 111.376 176.649 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 88.4 mt -60.81 -48.91 79.64 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-N 118.503 0.592 . . . . 0.0 110.667 164.862 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 28.7 tt0 -63.0 -24.48 67.94 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 123.873 0.869 . . . . 0.0 112.938 -176.524 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 26.4 t30 -57.68 -27.26 62.74 Favored 'General case' 0 CA--C 1.549 0.932 0 O-C-N 121.118 -0.989 . . . . 0.0 113.422 174.893 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 64.7 m-85 -89.25 -3.8 58.41 Favored 'General case' 0 CA--C 1.548 0.887 0 C-N-CA 125.215 1.406 . . . . 0.0 113.714 176.965 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 79.8 m -93.83 164.51 13.09 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 124.857 1.263 . . . . 0.0 113.203 176.141 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.247 0.962 0 C-N-CA 125.781 1.633 . . . . 0.0 110.521 170.154 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 53.6 m-85 . . . . . 0 N--CA 1.489 1.482 0 CA-C-O 118.978 -0.534 . . . . 0.0 110.445 . . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 7.5 p -165.92 131.42 0.47 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.039 0 C-N-CA 125.261 1.425 . . . . 0.0 110.356 -177.656 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 11.9 p30 -97.98 150.3 21.51 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 124.867 1.267 . . . . 0.0 113.209 -179.674 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 39.6 mt-30 -147.36 160.79 42.14 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 125.247 1.419 . . . . 0.0 110.657 -178.162 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 98.1 m-70 -81.36 127.11 32.4 Favored 'General case' 0 CA--C 1.54 0.576 0 N-CA-C 108.432 -0.951 . . . . 0.0 108.432 155.926 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 90.7 mt -143.28 130.0 20.33 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 124.679 1.192 . . . . 0.0 109.907 -177.204 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 83.8 m -128.72 141.23 51.39 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 124.805 1.242 . . . . 0.0 111.787 -174.926 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 49.0 -120.16 6.76 Favored Glycine 0 N--CA 1.473 1.153 0 C-N-CA 125.652 1.596 . . . . 0.0 114.525 164.556 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 25.3 m -58.2 -38.54 76.94 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 123.979 0.912 . . . . 0.0 112.481 -179.623 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 80.2 m-70 -75.37 -28.18 59.43 Favored 'General case' 0 CA--C 1.541 0.628 0 O-C-N 121.203 -0.936 . . . . 0.0 112.804 177.765 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 51.4 tp -67.23 -46.96 72.21 Favored 'General case' 0 N--CA 1.469 0.507 0 O-C-N 121.345 -0.847 . . . . 0.0 110.824 169.952 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 75.6 t -66.87 -33.88 66.3 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.019 0 C-N-CA 123.752 0.821 . . . . 0.0 111.651 176.591 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 43.2 tt0 -63.69 -49.82 71.65 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 124.987 1.315 . . . . 0.0 111.254 171.781 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -58.94 -45.61 90.01 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 123.159 0.584 . . . . 0.0 112.003 176.845 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 59.9 tp -55.37 -51.44 66.81 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 125.522 1.529 . . . . 0.0 111.745 174.633 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 80.9 t80 -58.61 -40.12 82.37 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 123.823 0.849 . . . . 0.0 112.849 175.062 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 85.8 mt -76.83 -34.35 57.89 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 124.075 0.95 . . . . 0.0 113.246 -177.913 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 27.3 t -63.22 -47.05 94.11 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.843 0 C-N-CA 124.267 1.027 . . . . 0.0 110.25 172.297 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 84.5 m -87.78 -23.78 23.98 Favored 'General case' 0 N--CA 1.471 0.579 0 N-CA-C 113.821 1.045 . . . . 0.0 113.821 -172.82 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 66.48 -115.06 7.0 Favored Glycine 0 CA--C 1.529 0.909 0 C-N-CA 124.625 1.107 . . . . 0.0 111.846 172.464 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -72.56 -19.88 61.42 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 123.844 0.858 . . . . 0.0 112.854 175.257 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 71.6 mtp180 -75.8 133.04 40.76 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 123.969 0.908 . . . . 0.0 109.72 172.932 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . -89.67 167.74 33.93 Favored Glycine 0 N--CA 1.469 0.842 0 C-N-CA 125.268 1.413 . . . . 0.0 113.094 -178.668 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 45.4 p90 -135.36 163.83 29.13 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 124.986 1.314 . . . . 0.0 113.595 -179.502 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 85.1 t80 -126.83 143.89 51.13 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 126.161 1.784 . . . . 0.0 108.484 162.478 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -146.89 144.86 29.58 Favored 'General case' 0 N--CA 1.476 0.833 0 N-CA-C 113.486 0.921 . . . . 0.0 113.486 -166.724 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 10.7 m -151.11 140.01 13.37 Favored Pre-proline 0 N--CA 1.476 0.843 0 C-N-CA 125.131 1.372 . . . . 0.0 109.57 -169.675 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 65.9 Cg_endo -77.38 -169.96 0.84 Allowed 'Trans proline' 0 CA--C 1.541 0.84 0 C-N-CA 123.676 2.917 . . . . 0.0 111.972 173.508 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 38.5 ttpt -63.41 -33.33 75.31 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 124.042 0.937 . . . . 0.0 113.483 179.961 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 22.4 p . . . . . 0 C--O 1.253 1.256 0 C-N-CA 126.05 1.74 . . . . 0.0 113.362 -176.854 . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.549 0 N-CA-C 111.772 -0.531 . . . . 0.0 111.772 . . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 47.8 pt -90.61 -28.46 4.91 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.207 0 N-CA-C 114.855 1.428 . . . . 0.0 114.855 -172.398 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 16.6 t -66.84 -41.81 88.25 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.296 0 CA-C-N 119.795 1.179 . . . . 0.0 110.254 -171.071 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 4.9 pm0 -71.41 -0.09 9.47 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 127.322 2.249 . . . . 0.0 113.905 174.007 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 33.4 tt0 -104.72 -60.06 1.65 Allowed 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 123.861 0.865 . . . . 0.0 109.638 161.982 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 92.7 m -58.16 -30.9 66.75 Favored 'General case' 0 N--CA 1.467 0.411 0 N-CA-C 115.308 1.595 . . . . 0.0 115.308 -171.175 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 16.6 t -84.71 -38.94 19.11 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 123.194 0.598 . . . . 0.0 112.604 -172.553 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 22.0 p -99.97 -31.8 11.29 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 125.609 1.563 . . . . 0.0 113.618 -177.727 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.8 t -117.78 -166.2 1.18 Allowed 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 126.112 1.765 . . . . 0.0 110.206 172.603 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 14.9 tt -96.56 149.84 4.65 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.66 0 C-N-CA 124.631 1.172 . . . . 0.0 110.782 176.654 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 15.6 p -141.93 157.11 45.35 Favored 'General case' 0 N--CA 1.471 0.594 0 O-C-N 121.267 -0.896 . . . . 0.0 113.135 174.266 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 35.6 m -103.12 152.57 21.26 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 124.022 0.929 . . . . 0.0 112.335 -171.805 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 42.6 mt -60.27 -32.7 71.42 Favored 'General case' 0 N--CA 1.473 0.719 0 O-C-N 121.101 -0.999 . . . . 0.0 111.7 176.019 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 56.4 m-85 -61.77 -31.94 72.17 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 124.392 1.077 . . . . 0.0 113.534 172.422 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 97.1 mt-30 -79.96 -35.55 37.44 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 124.705 1.202 . . . . 0.0 110.833 175.415 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 63.1 mt -61.74 -39.01 90.08 Favored 'General case' 0 N--CA 1.473 0.684 0 CA-C-N 118.499 0.59 . . . . 0.0 111.946 168.662 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 28.8 tt0 -63.56 -30.53 71.63 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 123.419 0.688 . . . . 0.0 112.769 179.295 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 45.4 t30 -62.3 -20.77 64.66 Favored 'General case' 0 CA--C 1.55 0.977 0 O-C-N 120.924 -1.11 . . . . 0.0 113.007 173.417 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 1.4 m-85 -97.16 5.13 50.71 Favored 'General case' 0 CA--C 1.549 0.909 0 C-N-CA 125.989 1.715 . . . . 0.0 114.089 175.81 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 79.5 m -68.28 159.3 31.58 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-N 119.355 0.98 . . . . 0.0 112.682 169.034 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.253 1.278 0 C-N-CA 126.939 2.096 . . . . 0.0 110.504 179.478 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 40.0 t80 . . . . . 0 N--CA 1.486 1.374 0 CA-C-O 118.733 -0.651 . . . . 0.0 110.877 . . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 13.7 t -138.4 46.37 0.36 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.582 0 C-N-CA 126.357 1.863 . . . . 0.0 108.273 177.508 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 25.0 p-10 -163.72 144.32 8.73 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 125.834 1.654 . . . . 0.0 113.125 -160.035 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 45.5 mm-40 -153.4 164.51 38.03 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 125.486 1.514 . . . . 0.0 111.979 -169.516 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 98.4 m-70 -83.74 133.08 34.8 Favored 'General case' 0 CA--C 1.542 0.637 0 O-C-N 121.653 -0.655 . . . . 0.0 109.259 158.359 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 84.0 mt -150.49 135.17 17.4 Favored 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 124.83 1.252 . . . . 0.0 109.97 -170.722 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 3.6 t -154.45 155.54 35.12 Favored 'General case' 0 N--CA 1.468 0.439 0 O-C-N 121.488 -0.757 . . . . 0.0 111.869 -179.925 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 52.84 -129.3 38.37 Favored Glycine 0 N--CA 1.47 0.944 0 C-N-CA 124.923 1.249 . . . . 0.0 113.536 176.393 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 28.3 p -56.78 -36.48 69.9 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 125.028 1.331 . . . . 0.0 113.065 178.662 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 75.3 m-70 -73.76 -29.62 62.32 Favored 'General case' 0 CA--C 1.541 0.631 0 O-C-N 120.883 -1.136 . . . . 0.0 113.07 177.181 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 35.9 tp -71.59 -42.1 68.16 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 119.172 0.896 . . . . 0.0 110.774 170.291 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 49.7 t -59.07 -41.48 83.59 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.074 0 C-N-CA 124.032 0.933 . . . . 0.0 111.526 172.24 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 43.3 tt0 -63.78 -47.29 81.52 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 125.631 1.572 . . . . 0.0 111.779 174.655 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.8 -43.86 97.69 Favored 'General case' 0 CA--C 1.537 0.447 0 O-C-N 121.749 -0.594 . . . . 0.0 111.61 179.168 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 40.1 mt -56.69 -52.45 64.89 Favored 'General case' 0 N--CA 1.465 0.318 0 C-N-CA 123.675 0.79 . . . . 0.0 111.307 172.181 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 77.2 t80 -53.16 -41.39 65.11 Favored 'General case' 0 CA--C 1.542 0.658 0 N-CA-C 112.803 0.668 . . . . 0.0 112.803 176.044 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 88.6 mt -75.24 -36.44 61.29 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 124.401 1.08 . . . . 0.0 113.525 179.962 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 36.9 t -71.25 -41.38 74.8 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.038 0 C-N-CA 124.249 1.02 . . . . 0.0 110.617 176.186 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 86.3 m -81.47 -38.77 25.85 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 123.825 0.85 . . . . 0.0 112.246 -175.175 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 62.26 -100.52 0.31 Allowed Glycine 0 N--CA 1.472 1.048 0 C-N-CA 124.483 1.039 . . . . 0.0 112.813 172.051 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -69.93 -31.29 68.98 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 124.824 1.249 . . . . 0.0 112.458 174.302 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 1.3 mpp_? -75.52 153.88 37.21 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.072 0.949 . . . . 0.0 110.426 170.243 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . -81.44 -164.9 33.74 Favored Glycine 0 CA--C 1.531 1.064 0 C-N-CA 124.027 0.822 . . . . 0.0 111.26 165.12 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 51.3 p90 -154.63 156.92 37.39 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 124.192 0.997 . . . . 0.0 113.503 177.847 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 60.3 t80 -91.24 -40.54 11.47 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 125.08 1.352 . . . . 0.0 113.704 -176.103 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 48.1 t80 64.6 -59.74 0.22 Allowed 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 128.494 2.718 . . . . 0.0 116.291 179.066 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 23.9 p -62.94 147.92 93.21 Favored Pre-proline 0 N--CA 1.478 0.954 0 C-N-CA 124.856 1.262 . . . . 0.0 114.19 -158.117 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 91.2 Cg_endo -73.26 178.78 6.16 Favored 'Trans proline' 0 C--N 1.354 0.836 0 C-N-CA 124.312 3.341 . . . . 0.0 111.981 179.217 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 63.3 pttt -64.23 -16.85 62.86 Favored 'General case' 0 CA--C 1.547 0.861 0 N-CA-C 115.6 1.704 . . . . 0.0 115.6 -176.023 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 12.9 t . . . . . 0 C--O 1.252 1.209 0 C-N-CA 126.549 1.94 . . . . 0.0 112.235 -176.447 . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 1.279 0 N-CA-C 111.178 -0.769 . . . . 0.0 111.178 . . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 15.2 pt -97.62 -23.85 4.52 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.25 0 N-CA-C 114.282 1.216 . . . . 0.0 114.282 -179.974 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 99.1 t -74.73 -46.53 41.33 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.083 0 CA-C-N 119.224 0.92 . . . . 0.0 110.809 -166.844 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 5.5 pm0 -67.5 -32.45 73.27 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 124.388 1.075 . . . . 0.0 111.265 171.904 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 8.5 tt0 -66.41 -38.19 86.92 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 124.24 1.016 . . . . 0.0 111.617 179.726 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 3.3 t -88.79 -16.76 31.3 Favored 'General case' 0 CA--C 1.544 0.719 0 N-CA-C 114.247 1.203 . . . . 0.0 114.247 176.01 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 52.5 t -97.92 -53.53 3.37 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 124.864 1.266 . . . . 0.0 113.633 -175.819 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 38.5 m -77.97 -47.36 18.72 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 125.396 1.478 . . . . 0.0 109.701 -179.245 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 74.7 m -90.47 -152.85 0.28 Allowed 'General case' 0 CA--C 1.551 1.01 0 C-N-CA 123.737 0.815 . . . . 0.0 109.888 158.224 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 28.8 pt -132.13 154.57 40.37 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.99 0 O-C-N 120.485 -1.384 . . . . 0.0 111.902 -176.821 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 1.1 p -149.94 164.89 34.24 Favored 'General case' 0 N--CA 1.468 0.468 0 N-CA-C 112.98 0.733 . . . . 0.0 112.98 168.89 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 2.8 t -111.9 166.41 11.24 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 124.674 1.19 . . . . 0.0 113.521 -177.414 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 71.1 mt -59.15 -34.42 72.05 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 124.359 1.064 . . . . 0.0 111.967 178.107 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 78.1 m-85 -63.97 -28.77 70.04 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 124.276 1.03 . . . . 0.0 113.476 173.671 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 55.8 mt-30 -81.17 -37.76 28.22 Favored 'General case' 0 N--CA 1.467 0.405 0 C-N-CA 123.778 0.831 . . . . 0.0 110.916 173.65 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 45.0 mt -56.02 -44.89 79.16 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 119.132 0.878 . . . . 0.0 111.086 170.524 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -60.84 -30.91 70.4 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 124.117 0.967 . . . . 0.0 112.959 177.448 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 27.2 t30 -80.64 -31.44 36.47 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 124.341 1.056 . . . . 0.0 112.832 174.608 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 19.6 m-30 -68.15 -37.17 80.76 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 123.975 0.91 . . . . 0.0 112.212 173.466 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 72.1 m -64.98 163.46 14.57 Favored 'General case' 0 N--CA 1.473 0.717 0 N-CA-C 113.602 0.964 . . . . 0.0 113.602 178.482 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.252 1.225 0 C-N-CA 125.382 1.473 . . . . 0.0 111.532 -179.357 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 70.1 m-85 . . . . . 0 N--CA 1.486 1.355 0 N-CA-C 110.374 -0.232 . . . . 0.0 110.374 . . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 19.0 m -73.56 145.22 11.81 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.123 0 C-N-CA 128.318 2.647 . . . . 0.0 113.469 3.214 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 11.0 m120 72.81 128.21 0.04 OUTLIER 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 129.306 3.043 . . . . 0.0 112.951 176.934 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 27.7 mm-40 -145.15 164.81 30.14 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 125.373 1.469 . . . . 0.0 110.511 178.499 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 90.4 m-70 -83.59 117.21 23.0 Favored 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 107.785 -1.191 . . . . 0.0 107.785 160.832 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 94.3 mt -129.22 131.74 47.12 Favored 'General case' 0 N--CA 1.462 0.164 0 C-N-CA 124.859 1.263 . . . . 0.0 108.532 178.704 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -142.97 153.76 43.34 Favored 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 124.267 1.027 . . . . 0.0 111.517 -173.867 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 48.23 -126.69 15.55 Favored Glycine 0 N--CA 1.471 0.98 0 C-N-CA 125.578 1.561 . . . . 0.0 114.338 170.047 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 16.0 p -59.88 -38.91 83.58 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 124.579 1.152 . . . . 0.0 112.618 179.46 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 26.7 m170 -65.23 -37.87 88.63 Favored 'General case' 0 CA--C 1.544 0.718 0 O-C-N 121.076 -1.015 . . . . 0.0 111.803 177.74 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 56.6 tp -67.9 -44.23 77.44 Favored 'General case' 0 N--CA 1.466 0.37 0 C-N-CA 123.405 0.682 . . . . 0.0 111.117 172.234 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 53.5 t -59.02 -38.8 76.09 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.973 0 CA-C-N 118.836 0.744 . . . . 0.0 111.978 174.92 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -66.3 -45.71 79.44 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 123.87 0.868 . . . . 0.0 111.579 173.815 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.07 -46.37 90.92 Favored 'General case' 0 CA--C 1.543 0.681 0 CA-C-N 119.296 0.953 . . . . 0.0 111.901 176.794 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 32.5 mt -54.76 -50.28 68.82 Favored 'General case' 0 N--CA 1.466 0.333 0 C-N-CA 124.574 1.149 . . . . 0.0 111.436 173.174 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 88.4 t80 -62.36 -36.55 82.59 Favored 'General case' 0 CA--C 1.543 0.706 0 O-C-N 121.2 -0.938 . . . . 0.0 113.331 177.04 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 76.3 mt -73.01 -33.12 65.56 Favored 'General case' 0 N--CA 1.469 0.495 0 O-C-N 121.155 -0.966 . . . . 0.0 113.296 177.677 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 84.5 t -81.21 -37.1 15.49 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.93 0 C-N-CA 123.945 0.898 . . . . 0.0 111.469 176.869 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 44.0 m -124.8 6.03 8.09 Favored 'General case' 0 N--CA 1.473 0.691 0 N-CA-C 115.587 1.699 . . . . 0.0 115.587 -163.05 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . -57.53 -27.16 58.14 Favored Glycine 0 N--CA 1.479 1.533 0 N-CA-C 116.302 1.281 . . . . 0.0 116.302 -166.523 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -81.39 -21.55 38.91 Favored 'General case' 0 CA--C 1.548 0.871 0 N-CA-C 114.13 1.159 . . . . 0.0 114.13 174.709 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 75.9 mtp180 -91.52 -42.36 10.29 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 126.199 1.8 . . . . 0.0 112.23 177.961 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 97.31 136.98 9.35 Favored Glycine 0 CA--C 1.531 1.049 0 C-N-CA 125.651 1.596 . . . . 0.0 110.558 -163.155 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 46.8 p90 -105.1 165.12 11.31 Favored 'General case' 0 CA--C 1.538 0.519 0 N-CA-C 114.198 1.184 . . . . 0.0 114.198 -172.625 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 69.9 t80 -108.81 148.98 29.74 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 126.391 1.876 . . . . 0.0 109.92 175.609 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 64.8 t80 -160.96 117.86 2.31 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 124.673 1.189 . . . . 0.0 111.1 -175.843 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 20.2 p -142.45 114.85 6.23 Favored Pre-proline 0 N--CA 1.475 0.809 0 C-N-CA 125.186 1.394 . . . . 0.0 112.128 -174.704 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_endo -82.36 178.1 6.53 Favored 'Trans proline' 0 C--N 1.35 0.634 0 C-N-CA 124.184 3.256 . . . . 0.0 112.407 173.667 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 14.7 ptmm? -73.85 169.39 17.5 Favored 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 124.385 1.074 . . . . 0.0 113.058 169.706 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 21.6 m . . . . . 0 C--O 1.254 1.324 0 C-N-CA 125.271 1.428 . . . . 0.0 111.514 169.249 . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.563 0 CA-C-O 121.44 0.467 . . . . 0.0 112.039 . . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 1.7 pp -70.58 -21.09 22.73 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.095 0 N-CA-C 114.006 1.113 . . . . 0.0 114.006 -164.994 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 45.3 t -58.83 -36.79 62.9 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.084 0 CA-C-N 118.947 0.794 . . . . 0.0 111.53 171.699 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 24.6 tt0 -78.8 -44.04 24.03 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-O 118.935 -0.555 . . . . 0.0 111.308 174.599 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -58.58 -49.79 76.18 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-N 118.572 0.624 . . . . 0.0 111.455 -177.558 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 16.5 m -60.89 -22.5 64.38 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 124.183 0.993 . . . . 0.0 113.392 176.935 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 49.7 t -96.93 -50.41 4.65 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 124.586 1.155 . . . . 0.0 112.824 -173.677 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 3.1 t -78.39 -35.46 47.16 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.398 1.079 . . . . 0.0 112.054 -179.221 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 30.9 m -107.74 -161.6 0.79 Allowed 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.235 1.414 . . . . 0.0 109.183 165.146 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 26.8 pt -109.49 157.55 9.83 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.734 0 C-N-CA 124.515 1.126 . . . . 0.0 110.878 174.787 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 18.1 p -140.62 160.39 40.13 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-O 121.615 0.721 . . . . 0.0 112.387 171.835 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 4.1 m -96.08 149.36 21.69 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 124.874 1.269 . . . . 0.0 111.896 -169.414 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 55.5 mt -57.27 -33.26 67.44 Favored 'General case' 0 N--CA 1.474 0.73 0 O-C-N 121.09 -1.006 . . . . 0.0 111.833 167.893 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 80.6 t80 -63.71 -30.81 71.86 Favored 'General case' 0 CA--C 1.543 0.682 0 N-CA-C 113.46 0.911 . . . . 0.0 113.46 172.491 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 45.9 mm-40 -80.99 -34.46 32.98 Favored 'General case' 0 CA--C 1.534 0.358 0 O-C-N 121.46 -0.775 . . . . 0.0 111.05 174.099 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 38.4 mt -58.18 -37.2 74.26 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 119.602 1.092 . . . . 0.0 111.296 167.095 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.401 ' HA ' ' SG ' ' A' ' 20' ' ' CYS . 24.7 tt0 -68.97 -35.3 76.58 Favored 'General case' 0 CA--C 1.545 0.768 0 N-CA-C 112.619 0.6 . . . . 0.0 112.619 173.74 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 62.3 t30 -64.74 -22.92 67.09 Favored 'General case' 0 CA--C 1.553 1.072 0 O-C-N 121.009 -1.057 . . . . 0.0 112.257 171.988 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 16.0 m-30 -91.65 -0.16 57.55 Favored 'General case' 0 CA--C 1.551 1.008 0 C-N-CA 125.802 1.641 . . . . 0.0 113.562 177.378 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . 0.401 ' SG ' ' HA ' ' A' ' 17' ' ' GLU . 81.6 m -66.73 160.42 25.75 Favored 'General case' 0 N--CA 1.474 0.752 0 O-C-N 121.063 -1.023 . . . . 0.0 113.639 172.572 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 7.7 t-20 . . . . . 0 C--O 1.251 1.18 0 C-N-CA 128.661 2.784 . . . . 0.0 113.686 177.29 . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 68.3 m-85 . . . . . 0 N--CA 1.487 1.413 0 CA-C-O 120.332 0.111 . . . . 0.0 111.055 . . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 11.0 p -154.46 150.18 12.06 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.988 0 C-N-CA 125.562 1.545 . . . . 0.0 110.335 178.991 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 61.6 m-20 -109.54 146.69 34.23 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 124.905 1.282 . . . . 0.0 111.601 179.301 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 38.3 mt-30 -143.26 158.7 43.4 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 124.445 1.098 . . . . 0.0 111.229 -179.257 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 95.8 m-70 -80.28 127.33 32.24 Favored 'General case' 0 CA--C 1.539 0.522 0 N-CA-C 108.639 -0.874 . . . . 0.0 108.639 156.623 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 98.5 mt -140.23 123.0 16.41 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 125.59 1.556 . . . . 0.0 109.242 -175.142 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 57.7 m -130.73 138.81 50.16 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 124.891 1.277 . . . . 0.0 110.727 -174.176 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 54.43 -123.67 28.78 Favored Glycine 0 N--CA 1.473 1.101 0 C-N-CA 124.86 1.219 . . . . 0.0 114.029 166.522 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 17.8 p -59.9 -35.47 74.93 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 124.35 1.06 . . . . 0.0 112.387 179.973 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 24.2 m80 -67.69 -38.27 83.44 Favored 'General case' 0 CA--C 1.541 0.607 0 O-C-N 121.25 -0.906 . . . . 0.0 111.714 177.817 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 60.1 tp -67.5 -44.92 77.32 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 123.639 0.776 . . . . 0.0 111.213 172.206 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 53.1 t -60.45 -38.54 78.25 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.131 0 C-N-CA 123.614 0.766 . . . . 0.0 111.761 177.023 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 33.2 mm-40 -68.62 -43.89 75.41 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 123.855 0.862 . . . . 0.0 111.91 173.258 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.36 -43.62 98.56 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-N 119.278 0.944 . . . . 0.0 112.253 176.746 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 44.5 mt -55.48 -54.57 42.26 Favored 'General case' 0 N--CA 1.467 0.412 0 C-N-CA 124.803 1.241 . . . . 0.0 110.84 171.771 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 81.9 t80 -55.19 -40.75 71.11 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 123.48 0.712 . . . . 0.0 112.884 177.471 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 83.0 mt -75.74 -34.38 60.3 Favored 'General case' 0 CA--C 1.534 0.358 0 N-CA-C 113.645 0.979 . . . . 0.0 113.645 -179.121 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 42.9 t -72.73 -42.35 61.98 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.922 0 CA-C-N 118.666 0.666 . . . . 0.0 110.642 174.29 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 75.5 m -83.43 -35.6 24.88 Favored 'General case' 0 N--CA 1.466 0.37 0 N-CA-C 113.539 0.941 . . . . 0.0 113.539 -173.21 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 62.54 -131.43 44.09 Favored Glycine 0 CA--C 1.532 1.094 0 C-N-CA 123.839 0.733 . . . . 0.0 111.66 -175.973 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -63.28 -18.85 64.02 Favored 'General case' 0 CA--C 1.55 0.96 0 C-N-CA 124.942 1.297 . . . . 0.0 113.512 179.452 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 85.4 mtm180 -66.17 -21.9 66.34 Favored 'General case' 0 N--CA 1.477 0.919 0 N-CA-C 113.924 1.083 . . . . 0.0 113.924 -177.567 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.73 -178.43 39.5 Favored Glycine 0 CA--C 1.534 1.236 0 C-N-CA 124.658 1.123 . . . . 0.0 112.154 -172.934 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 53.4 p90 -159.86 164.57 33.48 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 124.368 1.067 . . . . 0.0 113.421 -177.299 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 93.6 t80 -146.26 121.83 10.42 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 124.776 1.23 . . . . 0.0 110.635 171.744 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 44.4 p90 -101.87 155.21 18.29 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 125.975 1.71 . . . . 0.0 111.911 172.569 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 39.8 p -102.17 137.14 19.38 Favored Pre-proline 0 N--CA 1.472 0.673 0 C-N-CA 124.568 1.147 . . . . 0.0 110.078 167.279 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 68.8 Cg_endo -76.25 -168.87 0.6 Allowed 'Trans proline' 0 C--N 1.349 0.6 0 C-N-CA 124.657 3.571 . . . . 0.0 112.287 -169.705 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 27.7 mtpp -58.25 -30.0 66.2 Favored 'General case' 0 CA--C 1.549 0.92 0 O-C-N 121.106 -0.996 . . . . 0.0 113.561 173.222 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 24.5 m . . . . . 0 N--CA 1.486 1.332 0 C-N-CA 129.053 2.941 . . . . 0.0 111.779 173.599 . . . . . . . . 0 0 . 1 . 026 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.728 0 N-CA-C 112.003 -0.439 . . . . 0.0 112.003 . . . . . . . . . 0 0 . 1 . 026 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 14.0 tt -55.38 -42.08 65.43 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.259 0 C-N-CA 124.748 1.219 . . . . 0.0 113.966 -171.934 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 83.5 t -63.03 -45.94 97.53 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.1 0 CA-C-N 119.306 0.957 . . . . 0.0 111.028 -176.707 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 78.5 mm-40 -70.68 -40.8 72.73 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-N 118.465 0.575 . . . . 0.0 111.329 176.597 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 63.9 tp60 -64.77 -38.9 92.56 Favored 'General case' 0 N--CA 1.463 0.222 0 O-C-N 121.83 -0.544 . . . . 0.0 112.052 -179.252 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 88.3 m -83.03 -31.5 27.39 Favored 'General case' 0 CA--C 1.53 0.204 0 N-CA-C 114.268 1.211 . . . . 0.0 114.268 178.607 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 30.5 t -103.46 -48.47 3.97 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 113.153 0.798 . . . . 0.0 113.153 -169.369 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 34.6 m -79.33 -47.12 16.37 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 124.526 1.131 . . . . 0.0 109.536 178.699 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 71.0 m -94.74 -164.32 1.15 Allowed 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 124.625 1.17 . . . . 0.0 111.255 164.112 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 40.4 pt -109.5 149.35 12.66 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 C-N-CA 124.694 1.198 . . . . 0.0 110.885 169.254 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 17.5 p -128.33 158.42 38.27 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 123.567 0.747 . . . . 0.0 112.028 174.149 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 61.5 p -98.67 160.03 14.55 Favored 'General case' 0 N--CA 1.468 0.441 0 N-CA-C 114.003 1.112 . . . . 0.0 114.003 -179.857 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 59.7 mt -60.88 -35.46 76.7 Favored 'General case' 0 CA--C 1.54 0.573 0 O-C-N 121.646 -0.659 . . . . 0.0 111.452 172.107 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 91.6 t80 -62.57 -35.45 79.54 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 124.118 0.967 . . . . 0.0 112.896 172.641 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 84.3 mt-30 -74.16 -35.4 64.03 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 123.866 0.866 . . . . 0.0 111.884 173.349 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 56.8 mt -63.28 -39.02 93.4 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 119.599 1.091 . . . . 0.0 111.923 171.433 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -60.91 -26.73 67.67 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 124.621 1.168 . . . . 0.0 113.319 -178.989 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 26.3 t30 -57.4 -28.69 63.46 Favored 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 124.261 1.024 . . . . 0.0 113.307 175.521 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 98.2 m-85 -95.07 -2.28 50.47 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 125.146 1.378 . . . . 0.0 114.022 -174.174 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 86.3 m -70.67 151.61 44.75 Favored 'General case' 0 CA--C 1.541 0.629 0 N-CA-C 113.938 1.088 . . . . 0.0 113.938 178.701 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.25 1.11 0 C-N-CA 126.378 1.871 . . . . 0.0 110.223 170.522 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 1.8 p90 . . . . . 0 N--CA 1.485 1.307 0 N-CA-C 111.54 0.2 . . . . 0.0 111.54 . . . . . . . . . 0 0 . 1 . 026 nuclear orig full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 96.8 t -85.94 143.14 12.11 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.072 0 C-N-CA 124.554 1.142 . . . . 0.0 109.786 173.888 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 51.4 p30 -134.45 149.7 50.76 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 125.303 1.441 . . . . 0.0 112.864 173.103 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 40.9 mt-30 -151.29 162.53 40.74 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 124.922 1.289 . . . . 0.0 111.722 -164.754 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 84.0 m-70 -82.67 130.16 35.08 Favored 'General case' 0 CA--C 1.541 0.633 0 N-CA-C 109.522 -0.548 . . . . 0.0 109.522 154.589 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 78.5 mt -144.07 126.88 16.24 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 126.391 1.876 . . . . 0.0 108.996 -178.5 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 62.3 m -134.74 140.68 46.12 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 124.986 1.315 . . . . 0.0 110.455 -174.754 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 51.7 -118.88 7.6 Favored Glycine 0 N--CA 1.473 1.137 0 C-N-CA 124.88 1.229 . . . . 0.0 114.022 169.147 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 19.3 m -59.48 -33.92 71.92 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 124.475 1.11 . . . . 0.0 112.688 -179.804 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 93.2 m-70 -72.67 -38.83 67.48 Favored 'General case' 0 CA--C 1.539 0.55 0 O-C-N 121.409 -0.807 . . . . 0.0 111.163 178.196 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 55.7 tp -63.81 -45.87 87.7 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 124.053 0.941 . . . . 0.0 111.056 171.827 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 21.8 t -59.59 -43.28 90.67 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.952 0 C-N-CA 124.614 1.166 . . . . 0.0 111.751 176.171 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -65.57 -46.42 79.53 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 123.175 0.59 . . . . 0.0 111.65 175.683 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.07 -44.01 98.02 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 123.533 0.733 . . . . 0.0 112.058 179.961 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 21.4 mt -54.94 -55.51 29.82 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 124.301 1.041 . . . . 0.0 111.132 173.0 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 79.9 t80 -58.15 -34.51 70.36 Favored 'General case' 0 N--CA 1.472 0.666 0 N-CA-C 113.512 0.93 . . . . 0.0 113.512 179.417 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 86.1 mt -74.79 -40.94 60.85 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 124.661 1.184 . . . . 0.0 113.559 175.062 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 38.7 t -64.49 -42.77 96.19 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.021 0 C-N-CA 123.956 0.903 . . . . 0.0 111.052 174.24 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 61.6 m -73.58 -25.7 60.48 Favored 'General case' 0 CA--C 1.538 0.518 0 N-CA-C 112.611 0.597 . . . . 0.0 112.611 179.264 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 83.77 49.29 4.89 Favored Glycine 0 N--CA 1.471 1.008 0 C-N-CA 124.648 1.118 . . . . 0.0 112.184 171.944 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 36.4 mt-10 78.06 -7.93 1.74 Allowed 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 127.997 2.519 . . . . 0.0 113.362 -177.418 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 32.2 mtp180 -66.47 162.48 20.54 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 125.238 1.415 . . . . 0.0 111.927 168.278 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . -63.63 159.42 38.59 Favored Glycine 0 CA--C 1.532 1.145 0 C-N-CA 124.154 0.883 . . . . 0.0 112.939 174.668 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 56.1 p90 -153.8 175.44 13.3 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 125.518 1.527 . . . . 0.0 111.675 -172.288 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 61.0 t80 -138.88 118.46 12.99 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 124.416 1.086 . . . . 0.0 110.884 178.081 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 37.3 p90 -112.3 -13.0 13.5 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 125.67 1.588 . . . . 0.0 114.068 -178.273 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 8.6 m -69.23 137.63 89.23 Favored Pre-proline 0 N--CA 1.473 0.682 0 C-N-CA 125.803 1.641 . . . . 0.0 111.668 -161.812 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 81.2 Cg_endo -72.37 163.66 37.94 Favored 'Trans proline' 0 CA--C 1.537 0.672 0 C-N-CA 123.252 2.635 . . . . 0.0 111.928 175.584 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 11.4 mmpt? -73.63 152.55 40.48 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 123.39 0.676 . . . . 0.0 112.546 174.426 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 21.8 m . . . . . 0 C--O 1.254 1.296 0 C-N-CA 126.089 1.756 . . . . 0.0 112.396 -179.272 . . . . . . . . 0 0 . 1 . 027 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.755 0 N-CA-C 112.244 -0.342 . . . . 0.0 112.244 . . . . . . . . . 0 0 . 1 . 027 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 42.2 pt -89.87 -15.86 8.59 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.959 0 C-N-CA 128.592 2.757 . . . . 0.0 114.215 -4.828 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 25.0 t -51.34 -37.7 18.87 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.659 0 CA-C-N 120.858 1.663 . . . . 0.0 112.135 178.627 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -68.74 -16.52 63.83 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.536 1.134 . . . . 0.0 113.391 -179.867 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 36.7 tt0 -91.82 -57.11 2.85 Favored 'General case' 0 C--O 1.225 -0.207 0 C-N-CA 123.633 0.773 . . . . 0.0 109.474 162.73 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 64.0 m -63.28 -29.89 71.13 Favored 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 114.779 1.4 . . . . 0.0 114.779 -165.412 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 26.7 t -96.18 -38.87 9.96 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 123.872 0.869 . . . . 0.0 112.458 -175.513 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 27.3 m -83.08 -39.21 21.45 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 125.536 1.534 . . . . 0.0 111.766 -179.425 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 22.6 t -114.29 -135.7 0.36 Allowed 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 126.953 2.101 . . . . 0.0 108.768 168.291 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 16.0 pt -133.2 151.18 33.45 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.727 0 C-N-CA 125.901 1.681 . . . . 0.0 111.964 -178.507 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 66.9 m -125.41 158.32 34.64 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 125.392 1.477 . . . . 0.0 111.096 170.38 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 10.5 t -109.52 158.36 18.07 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 124.248 1.019 . . . . 0.0 112.49 175.566 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 45.0 mt -58.87 -35.26 72.69 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 125.297 1.439 . . . . 0.0 111.735 178.942 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 76.2 t80 -62.46 -29.9 70.86 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 124.33 1.052 . . . . 0.0 113.188 173.34 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 94.9 mt-30 -81.63 -33.68 31.3 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 124.313 1.045 . . . . 0.0 110.529 176.586 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 44.1 mt -65.56 -37.98 88.24 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 123.546 0.738 . . . . 0.0 112.129 171.76 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 29.1 tt0 -60.04 -24.32 64.43 Favored 'General case' 0 CA--C 1.544 0.73 0 N-CA-C 113.62 0.971 . . . . 0.0 113.62 -178.901 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 17.3 t-20 -58.47 -23.35 57.57 Favored 'General case' 0 CA--C 1.549 0.939 0 N-CA-C 113.637 0.977 . . . . 0.0 113.637 174.774 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 96.5 m-85 -97.92 0.98 47.52 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.479 1.511 . . . . 0.0 114.195 -177.601 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 60.3 m -68.84 161.26 28.97 Favored 'General case' 0 N--CA 1.473 0.722 0 N-CA-C 113.226 0.824 . . . . 0.0 113.226 173.29 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 20.9 t-20 . . . . . 0 C--O 1.251 1.15 0 C-N-CA 126.027 1.731 . . . . 0.0 112.526 -178.881 . . . . . . . . 0 0 . 1 . 027 nuclear orig full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 60.0 m-85 . . . . . 0 N--CA 1.488 1.436 0 CA-C-O 119.189 -0.434 . . . . 0.0 110.781 . . . . . . . . . 0 0 . 1 . 027 nuclear orig full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 11.9 p -166.8 136.59 0.65 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.074 0 C-N-CA 125.306 1.442 . . . . 0.0 110.902 -175.35 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 10.6 m120 -89.76 142.12 27.98 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 124.429 1.092 . . . . 0.0 112.063 176.674 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 38.1 mt-30 -144.87 157.34 44.19 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.16 1.384 . . . . 0.0 110.985 -177.985 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 99.2 m-70 -79.57 127.1 31.74 Favored 'General case' 0 CA--C 1.538 0.508 0 N-CA-C 108.61 -0.885 . . . . 0.0 108.61 160.774 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 98.8 mt -143.21 120.76 11.75 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 125.489 1.516 . . . . 0.0 109.914 -173.165 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 58.1 m -127.54 136.94 52.41 Favored 'General case' 0 N--CA 1.467 0.41 0 C-N-CA 125.066 1.346 . . . . 0.0 110.703 -176.878 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 48.43 -116.57 3.21 Favored Glycine 0 CA--C 1.531 1.046 0 C-N-CA 125.208 1.385 . . . . 0.0 114.275 167.556 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 21.1 m -59.31 -34.6 72.52 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 124.39 1.076 . . . . 0.0 112.651 -178.986 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 94.8 m-70 -72.22 -36.74 69.23 Favored 'General case' 0 CA--C 1.542 0.67 0 O-C-N 121.268 -0.895 . . . . 0.0 111.404 177.891 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 58.8 tp -65.77 -45.51 82.24 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 123.69 0.796 . . . . 0.0 110.99 171.963 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 53.6 t -62.65 -37.15 78.25 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.042 0 C-N-CA 124.381 1.073 . . . . 0.0 111.76 176.916 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -66.19 -47.08 75.1 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 123.627 0.771 . . . . 0.0 111.336 172.593 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.57 -43.53 97.18 Favored 'General case' 0 CA--C 1.539 0.539 0 O-C-N 121.521 -0.737 . . . . 0.0 111.996 177.792 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 18.3 mt -53.16 -56.16 18.57 Favored 'General case' 0 N--CA 1.468 0.448 0 C-N-CA 124.673 1.189 . . . . 0.0 111.175 172.037 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 71.5 t80 -55.82 -41.99 75.03 Favored 'General case' 0 CA--C 1.542 0.646 0 N-CA-C 113.151 0.797 . . . . 0.0 113.151 177.41 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 87.6 mt -72.36 -34.72 68.18 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 124.281 1.032 . . . . 0.0 113.134 -179.461 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 28.6 t -66.79 -43.92 89.54 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.909 0 C-N-CA 123.804 0.842 . . . . 0.0 110.624 172.464 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 82.6 m -72.43 -35.98 68.46 Favored 'General case' 0 CA--C 1.539 0.557 0 N-CA-C 112.206 0.447 . . . . 0.0 112.206 -177.85 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 68.51 -109.51 2.94 Favored Glycine 0 CA--C 1.528 0.885 0 C-N-CA 125.136 1.35 . . . . 0.0 112.112 170.512 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -68.85 -27.75 66.1 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 124.362 1.065 . . . . 0.0 112.199 173.575 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 82.6 mtm180 -74.16 154.59 39.03 Favored 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 124.968 1.307 . . . . 0.0 111.019 175.323 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . -80.62 -173.1 46.39 Favored Glycine 0 CA--C 1.527 0.801 0 C-N-CA 123.985 0.802 . . . . 0.0 111.316 168.721 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 15.3 p90 -162.0 165.43 27.39 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 124.7 1.2 . . . . 0.0 112.213 176.161 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 88.2 t80 -152.18 126.34 9.21 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 123.544 0.738 . . . . 0.0 111.696 167.074 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 60.0 t80 -164.29 151.49 11.75 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 126.828 2.051 . . . . 0.0 111.511 172.204 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 9.8 t -164.47 142.84 5.65 Favored Pre-proline 0 N--CA 1.475 0.792 0 C-N-CA 127.134 2.174 . . . . 0.0 109.523 172.381 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 48.4 Cg_endo -64.06 155.48 64.49 Favored 'Trans proline' 0 C--N 1.353 0.812 0 C-N-CA 123.272 2.648 . . . . 0.0 111.665 176.038 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 24.4 pttm -75.03 -3.0 29.87 Favored 'General case' 0 N--CA 1.477 0.88 0 N-CA-C 115.261 1.578 . . . . 0.0 115.261 -174.91 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 21.0 p . . . . . 0 C--O 1.253 1.255 0 C-N-CA 126.775 2.03 . . . . 0.0 113.884 -178.35 . . . . . . . . 0 0 . 1 . 028 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.388 0 N-CA-C 111.728 -0.549 . . . . 0.0 111.728 . . . . . . . . . 0 0 . 1 . 028 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 9.5 tp -104.2 -25.3 3.74 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.306 0 C-N-CA 127.823 2.449 . . . . 0.0 115.407 12.436 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 76.2 t -66.79 -46.07 86.37 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.031 0 N-CA-C 113.406 0.891 . . . . 0.0 113.406 -152.705 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 67.3 mm-40 -69.21 -42.58 75.56 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 118.693 0.679 . . . . 0.0 111.389 177.517 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 17.0 tm0? -61.72 -48.45 80.67 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 123.895 0.878 . . . . 0.0 111.346 -174.49 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 5.0 t -75.66 -12.45 60.2 Favored 'General case' 0 N--CA 1.472 0.646 0 N-CA-C 113.642 0.979 . . . . 0.0 113.642 -179.866 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 25.2 t -87.25 -43.47 12.17 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 124.88 1.272 . . . . 0.0 112.519 177.119 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 74.2 p -86.37 -43.26 13.0 Favored 'General case' 0 N--CA 1.478 0.966 0 C-N-CA 124.408 1.083 . . . . 0.0 112.268 177.952 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 17.5 t -104.52 -149.6 0.41 Allowed 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 125.807 1.643 . . . . 0.0 109.75 169.589 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 27.6 pt -125.94 157.03 36.08 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.728 0 C-N-CA 125.577 1.551 . . . . 0.0 112.286 -178.081 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 17.3 p -143.1 159.66 41.86 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 124.307 1.043 . . . . 0.0 112.157 170.779 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 8.5 t -105.76 162.81 13.22 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 124.885 1.274 . . . . 0.0 112.799 -177.646 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 53.0 mt -58.64 -35.59 72.75 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 124.773 1.229 . . . . 0.0 111.882 179.646 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 69.7 t80 -64.17 -28.58 69.85 Favored 'General case' 0 CA--C 1.547 0.829 0 N-CA-C 113.722 1.008 . . . . 0.0 113.722 173.598 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 75.2 mt-30 -83.32 -33.26 25.96 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 124.269 1.028 . . . . 0.0 110.997 175.495 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 83.2 mt -63.32 -38.14 90.01 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-N 118.576 0.626 . . . . 0.0 111.907 168.858 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 28.8 tt0 -62.23 -23.77 66.85 Favored 'General case' 0 CA--C 1.542 0.651 0 N-CA-C 113.566 0.951 . . . . 0.0 113.566 -179.691 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 29.7 t30 -57.25 -25.92 59.92 Favored 'General case' 0 CA--C 1.549 0.918 0 O-C-N 120.969 -1.082 . . . . 0.0 113.309 173.425 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 97.4 m-85 -96.73 0.84 50.18 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 125.411 1.484 . . . . 0.0 113.735 -175.744 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 61.2 m -67.54 156.49 36.58 Favored 'General case' 0 N--CA 1.474 0.727 0 CA-C-N 119.252 0.933 . . . . 0.0 113.143 175.69 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 22.1 t-20 . . . . . 0 C--O 1.254 1.321 0 C-N-CA 125.877 1.671 . . . . 0.0 112.79 -175.786 . . . . . . . . 0 0 . 1 . 028 nuclear orig full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 57.2 m-85 . . . . . 0 N--CA 1.488 1.457 0 CA-C-O 119.07 -0.49 . . . . 0.0 110.76 . . . . . . . . . 0 0 . 1 . 028 nuclear orig full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 7.5 p -168.99 134.19 0.4 Allowed 'Isoleucine or valine' 0 N--CA 1.479 0.993 0 C-N-CA 125.539 1.536 . . . . 0.0 110.194 -176.865 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 39.4 p30 -99.6 143.59 29.66 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 124.614 1.166 . . . . 0.0 113.401 179.778 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 39.0 mt-30 -147.48 160.35 42.69 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 125.234 1.413 . . . . 0.0 110.947 -170.22 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 99.3 m-70 -82.18 129.11 34.75 Favored 'General case' 0 CA--C 1.539 0.537 0 N-CA-C 108.156 -1.053 . . . . 0.0 108.156 159.51 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 87.0 mt -145.17 134.18 22.59 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 125.025 1.33 . . . . 0.0 109.211 -176.972 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 4.1 t -151.97 153.82 34.83 Favored 'General case' 0 C--O 1.235 0.342 0 C-N-CA 123.02 0.528 . . . . 0.0 111.786 -174.867 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 49.62 -128.66 24.75 Favored Glycine 0 CA--C 1.53 0.97 0 C-N-CA 125.465 1.507 . . . . 0.0 113.799 175.743 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 18.6 m -58.78 -33.45 70.32 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 124.53 1.132 . . . . 0.0 112.824 -179.136 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 80.8 m-70 -76.78 -26.74 54.81 Favored 'General case' 0 CA--C 1.54 0.578 0 O-C-N 121.073 -1.017 . . . . 0.0 112.875 177.857 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 42.6 tp -72.58 -42.26 64.79 Favored 'General case' 0 N--CA 1.468 0.457 0 O-C-N 121.225 -0.922 . . . . 0.0 111.07 168.28 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 55.8 t -59.28 -41.7 84.88 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.003 0 C-N-CA 123.794 0.838 . . . . 0.0 111.378 172.714 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 43.7 tt0 -62.47 -47.35 84.39 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 125.633 1.573 . . . . 0.0 111.823 173.44 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.25 -44.95 95.38 Favored 'General case' 0 CA--C 1.539 0.541 0 O-C-N 121.927 -0.483 . . . . 0.0 112.245 178.276 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 39.6 mt -55.92 -51.48 67.47 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 124.204 1.002 . . . . 0.0 111.092 173.265 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 68.1 t80 -55.32 -43.66 75.1 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 123.619 0.768 . . . . 0.0 113.058 175.262 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 89.8 mt -74.75 -32.86 62.21 Favored 'General case' 0 N--CA 1.471 0.619 0 N-CA-C 113.595 0.961 . . . . 0.0 113.595 -178.478 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 30.4 t -70.91 -43.58 76.67 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 C-N-CA 123.998 0.919 . . . . 0.0 110.466 173.655 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 76.1 m -81.62 -36.55 28.79 Favored 'General case' 0 CA--C 1.533 0.302 0 N-CA-C 113.533 0.938 . . . . 0.0 113.533 -173.855 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . -50.84 131.89 32.04 Favored Glycine 0 CA--C 1.538 1.521 0 C-N-CA 124.324 0.964 . . . . 0.0 113.37 -168.415 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -80.14 -3.59 49.46 Favored 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 128.468 2.707 . . . . 0.0 115.496 10.908 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 75.3 mtm180 -64.2 155.32 32.17 Favored 'General case' 0 N--CA 1.475 0.798 0 CA-C-N 119.567 1.076 . . . . 0.0 110.708 174.628 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . -78.69 -174.08 43.96 Favored Glycine 0 N--CA 1.471 0.972 0 C-N-CA 124.147 0.88 . . . . 0.0 111.519 169.825 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 45.6 p90 -157.02 155.69 31.64 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 123.882 0.873 . . . . 0.0 112.927 -179.075 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 68.3 t80 -100.33 148.68 24.43 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 125.628 1.571 . . . . 0.0 111.205 173.068 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 66.1 t80 -159.12 138.09 11.15 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 125.524 1.53 . . . . 0.0 111.14 179.797 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 11.5 t -168.22 132.46 1.41 Allowed Pre-proline 0 N--CA 1.476 0.854 0 C-N-CA 126.181 1.792 . . . . 0.0 109.877 173.938 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 91.0 Cg_endo -80.65 155.72 21.08 Favored 'Trans proline' 0 C--N 1.349 0.565 0 C-N-CA 122.735 2.29 . . . . 0.0 112.494 -172.334 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 67.4 mttm 66.18 1.66 2.05 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 126.62 1.968 . . . . 0.0 115.534 172.463 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 88.8 m . . . . . 0 C--O 1.252 1.194 0 C-N-CA 125.992 1.717 . . . . 0.0 110.528 164.016 . . . . . . . . 0 0 . 1 . 029 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.806 0 N-CA-C 111.097 -0.801 . . . . 0.0 111.097 . . . . . . . . . 0 0 . 1 . 029 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 17.6 tt -62.06 -38.62 81.27 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.267 0 CA-C-N 118.722 1.261 . . . . 0.0 114.005 -168.544 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 47.2 t -66.07 -34.19 68.57 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.12 0 C-N-CA 123.467 0.707 . . . . 0.0 111.343 -179.021 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -70.75 -54.94 9.82 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 124.114 0.965 . . . . 0.0 110.099 169.956 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 6.7 tt0 -56.91 -49.08 76.68 Favored 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 123.999 0.919 . . . . 0.0 112.117 -174.121 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 63.7 m -62.33 -28.24 69.61 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 114.006 1.113 . . . . 0.0 114.006 -179.094 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 18.6 t -102.1 -36.39 8.57 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 123.806 0.842 . . . . 0.0 112.763 -171.736 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 92.4 m -82.78 -29.51 29.57 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 126.228 1.811 . . . . 0.0 111.713 175.524 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 9.9 t -135.98 -156.26 0.7 Allowed 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 125.616 1.566 . . . . 0.0 110.697 177.124 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 28.1 mm -93.5 147.35 5.55 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.74 0 C-N-CA 125.408 1.483 . . . . 0.0 109.814 172.047 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 19.1 p -132.73 159.01 40.92 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 123.514 0.726 . . . . 0.0 112.486 163.665 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 53.3 p -100.08 162.72 12.8 Favored 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 113.788 1.033 . . . . 0.0 113.788 -175.22 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 78.4 mt -64.22 -33.54 76.03 Favored 'General case' 0 CA--C 1.536 0.421 0 O-C-N 121.344 -0.848 . . . . 0.0 111.5 172.126 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 87.2 t80 -66.78 -34.01 76.89 Favored 'General case' 0 CA--C 1.544 0.713 0 O-C-N 121.459 -0.776 . . . . 0.0 112.845 173.058 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 78.3 mt-30 -71.38 -37.04 71.61 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 123.556 0.742 . . . . 0.0 111.312 173.36 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 95.6 mt -60.98 -42.68 98.82 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-N 119.144 0.884 . . . . 0.0 111.245 167.346 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 56.6 tt0 -64.75 -31.13 72.22 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 123.353 0.661 . . . . 0.0 112.722 178.495 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 18.6 t-20 -64.2 -22.49 66.96 Favored 'General case' 0 CA--C 1.551 0.987 0 O-C-N 121.044 -1.035 . . . . 0.0 112.846 173.129 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 23.5 m-85 -95.73 0.47 52.52 Favored 'General case' 0 CA--C 1.55 0.958 0 C-N-CA 125.686 1.595 . . . . 0.0 113.338 171.661 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 76.4 m -83.82 161.83 20.79 Favored 'General case' 0 CA--C 1.542 0.639 0 O-C-N 120.649 -1.282 . . . . 0.0 112.133 165.772 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 44.0 t30 . . . . . 0 C--O 1.252 1.195 0 C-N-CA 125.074 1.35 . . . . 0.0 111.661 170.946 . . . . . . . . 0 0 . 1 . 029 nuclear orig full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 71.0 t80 . . . . . 0 N--CA 1.488 1.469 0 CA-C-O 119.63 -0.224 . . . . 0.0 110.783 . . . . . . . . . 0 0 . 1 . 029 nuclear orig full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 63.8 t -83.07 130.71 35.26 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.935 0 C-N-CA 124.125 0.97 . . . . 0.0 109.943 -178.217 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . 0.316 6.2 p30 69.3 131.09 0.03 OUTLIER 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 129.231 3.012 . . . . 0.0 114.162 -174.953 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 78.1 mt-30 -156.09 168.42 27.33 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 123.734 0.814 . . . . 0.0 113.149 -162.939 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 93.5 m-70 -84.52 134.21 34.43 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 123.628 0.771 . . . . 0.0 109.53 158.173 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 75.4 mt -148.34 131.91 16.78 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 126.277 1.831 . . . . 0.0 109.895 -176.861 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 85.5 m -135.97 144.52 45.44 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 124.992 1.317 . . . . 0.0 110.911 -177.596 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 52.46 -125.21 28.35 Favored Glycine 0 N--CA 1.474 1.199 0 C-N-CA 125.464 1.507 . . . . 0.0 114.248 165.414 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 27.5 m -58.21 -38.46 76.82 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 123.671 0.788 . . . . 0.0 112.296 -179.196 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 17.5 m-70 -72.33 -32.17 66.29 Favored 'General case' 0 CA--C 1.54 0.565 0 O-C-N 121.142 -0.974 . . . . 0.0 112.237 179.253 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 59.2 tp -65.43 -43.6 89.96 Favored 'General case' 0 CA--C 1.534 0.346 0 O-C-N 121.629 -0.669 . . . . 0.0 111.112 168.708 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 55.4 t -62.3 -40.49 88.03 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.942 0 C-N-CA 123.696 0.798 . . . . 0.0 111.661 175.684 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -62.93 -48.14 80.2 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 124.218 1.007 . . . . 0.0 111.613 173.368 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.63 -44.72 96.02 Favored 'General case' 0 CA--C 1.538 0.497 0 O-C-N 121.759 -0.588 . . . . 0.0 112.224 178.709 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 60.7 tp -57.07 -53.37 58.89 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 123.995 0.918 . . . . 0.0 110.571 174.494 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 9.9 m-30 -55.72 -38.62 69.98 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 123.328 0.651 . . . . 0.0 112.514 178.038 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 76.5 mt -71.65 -35.44 70.36 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 124.42 1.088 . . . . 0.0 113.137 177.758 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 55.3 t -70.44 -40.58 77.71 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.055 0 C-N-CA 123.754 0.822 . . . . 0.0 110.972 173.324 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 57.7 m -75.64 -35.52 60.42 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 113.075 0.769 . . . . 0.0 113.075 -178.747 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 59.02 -129.63 49.89 Favored Glycine 0 CA--C 1.532 1.107 0 N-CA-C 111.544 -0.622 . . . . 0.0 111.544 -174.942 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -75.66 -9.92 59.0 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 124.528 1.131 . . . . 0.0 114.035 179.566 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 60.1 mtp180 -65.95 -35.51 80.79 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 123.957 0.903 . . . . 0.0 113.251 -176.009 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 95.46 158.79 32.72 Favored Glycine 0 CA--C 1.532 1.152 0 C-N-CA 125.366 1.46 . . . . 0.0 113.069 -169.714 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 33.0 p90 -122.77 168.12 12.63 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 125.848 1.659 . . . . 0.0 113.117 -173.192 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 80.9 t80 -131.88 138.07 48.29 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 125.823 1.649 . . . . 0.0 109.239 161.057 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 69.6 t80 -154.07 139.1 17.3 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 123.84 0.856 . . . . 0.0 112.493 -175.084 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 10.2 t -173.6 138.77 0.77 Allowed Pre-proline 0 N--CA 1.476 0.871 0 C-N-CA 127.002 2.121 . . . . 0.0 109.639 174.983 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -74.19 136.8 22.74 Favored 'Trans proline' 0 C--N 1.351 0.668 0 C-N-CA 122.942 2.428 . . . . 0.0 110.812 174.669 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 22.4 ptmt -163.88 148.43 10.38 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 124.497 1.119 . . . . 0.0 113.255 -175.236 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 22.6 p . . . . . 0 C--O 1.253 1.274 0 C-N-CA 125.962 1.705 . . . . 0.0 111.048 174.125 . . . . . . . . 0 0 . 1 . 030 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.805 0 N-CA-C 111.419 -0.672 . . . . 0.0 111.419 . . . . . . . . . 0 0 . 1 . 030 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 43.8 pt -58.92 -31.9 46.25 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.131 0 N-CA-C 114.748 1.388 . . . . 0.0 114.748 -164.552 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 11.0 t -61.85 -34.95 65.12 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.996 0 C-N-CA 123.619 0.768 . . . . 0.0 111.08 178.461 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 29.7 mm-40 -79.15 8.88 5.11 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.963 1.305 . . . . 0.0 112.535 178.402 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -115.71 -53.63 2.57 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 124.729 1.212 . . . . 0.0 109.993 162.314 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 11.7 m -65.85 -28.48 69.0 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 115.392 1.627 . . . . 0.0 115.392 -173.954 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 42.6 t -92.86 -45.41 8.0 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-N 118.667 0.667 . . . . 0.0 111.927 -178.12 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 23.1 p -68.76 -35.98 77.75 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 126.806 2.042 . . . . 0.0 112.601 -179.308 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 65.0 m -132.76 -171.43 2.66 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 126.42 1.888 . . . . 0.0 110.775 179.064 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 30.3 mm -75.88 142.27 14.68 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.793 0 O-C-N 120.565 -1.335 . . . . 0.0 110.767 172.341 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 14.1 p -134.15 160.58 37.39 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 123.547 0.739 . . . . 0.0 112.461 158.758 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 37.4 t -101.99 159.79 15.06 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 124.889 1.276 . . . . 0.0 112.523 -178.225 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 40.2 mt -63.35 -30.41 71.55 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 123.594 0.758 . . . . 0.0 111.518 170.685 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 26.6 m-85 -65.6 -28.74 69.35 Favored 'General case' 0 CA--C 1.544 0.714 0 N-CA-C 113.304 0.853 . . . . 0.0 113.304 171.881 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 79.0 mt-30 -78.78 -38.36 38.67 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-O 118.558 -0.734 . . . . 0.0 110.593 172.598 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 42.6 mt -58.01 -37.96 75.27 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 119.099 0.863 . . . . 0.0 111.549 168.708 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 25.4 tt0 -66.37 -31.99 73.1 Favored 'General case' 0 CA--C 1.546 0.818 0 CA-C-N 118.688 0.676 . . . . 0.0 112.65 175.891 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 32.8 t30 -68.2 -23.97 64.89 Favored 'General case' 0 CA--C 1.548 0.892 0 O-C-N 121.043 -1.035 . . . . 0.0 112.685 171.947 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 10.5 m-30 -86.7 -5.7 59.05 Favored 'General case' 0 CA--C 1.549 0.917 0 C-N-CA 125.326 1.45 . . . . 0.0 113.545 177.455 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 58.2 m -65.46 155.47 35.45 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 123.562 0.745 . . . . 0.0 112.342 169.614 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 93.3 m-20 . . . . . 0 C--O 1.256 1.413 0 C-N-CA 124.414 1.086 . . . . 0.0 113.072 178.475 . . . . . . . . 0 0 . 1 . 030 nuclear orig full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 42.8 p90 . . . . . 0 N--CA 1.487 1.422 0 N-CA-C 110.678 -0.119 . . . . 0.0 110.678 . . . . . . . . . 0 0 . 1 . 030 nuclear orig full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 93.0 t -72.81 130.05 35.75 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.914 0 O-C-N 121.426 -0.797 . . . . 0.0 110.008 -178.811 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 4.1 p30 -151.94 132.25 13.68 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 125.504 1.522 . . . . 0.0 110.406 177.456 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 36.2 mt-30 -153.37 166.17 33.48 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 123.821 0.849 . . . . 0.0 112.36 -159.264 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 51.3 m-70 -81.8 132.3 35.28 Favored 'General case' 0 CA--C 1.542 0.664 0 N-CA-C 108.519 -0.919 . . . . 0.0 108.519 156.298 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 72.5 mt -140.73 126.83 19.56 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 125.698 1.599 . . . . 0.0 109.062 -178.263 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 68.7 m -131.14 143.95 51.02 Favored 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 125.053 1.341 . . . . 0.0 110.986 -173.77 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 56.47 -128.42 46.32 Favored Glycine 0 CA--C 1.528 0.866 0 C-N-CA 124.807 1.194 . . . . 0.0 113.927 166.433 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 23.5 p -61.5 -31.79 71.8 Favored 'General case' 0 N--CA 1.467 0.401 0 C-N-CA 124.482 1.113 . . . . 0.0 112.864 179.742 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 26.5 m80 -69.27 -39.99 78.05 Favored 'General case' 0 CA--C 1.54 0.565 0 O-C-N 121.042 -1.037 . . . . 0.0 111.395 175.792 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 50.5 tp -65.13 -45.28 85.71 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 123.379 0.671 . . . . 0.0 111.226 171.917 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 65.8 t -59.55 -43.02 89.93 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.008 0 C-N-CA 123.265 0.626 . . . . 0.0 111.656 176.381 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -65.01 -47.78 76.24 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 123.776 0.83 . . . . 0.0 111.529 177.214 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.92 -46.78 89.32 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 123.022 0.529 . . . . 0.0 111.653 178.632 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 43.8 tp -59.39 -49.99 75.67 Favored 'General case' 0 CA--C 1.533 0.327 0 C-N-CA 124.783 1.233 . . . . 0.0 111.229 176.981 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 63.2 t80 -55.43 -42.56 74.35 Favored 'General case' 0 CA--C 1.54 0.569 0 N-CA-C 113.122 0.786 . . . . 0.0 113.122 174.158 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 88.0 mt -73.88 -31.52 63.18 Favored 'General case' 0 N--CA 1.469 0.517 0 N-CA-C 113.104 0.779 . . . . 0.0 113.104 -179.324 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 41.1 t -68.65 -45.8 80.86 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.763 0 C-N-CA 123.538 0.735 . . . . 0.0 110.618 171.126 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 76.0 m -76.83 -35.15 57.75 Favored 'General case' 0 N--CA 1.469 0.498 0 N-CA-C 113.232 0.827 . . . . 0.0 113.232 -175.207 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 62.62 -130.82 43.53 Favored Glycine 0 CA--C 1.53 1.019 0 C-N-CA 124.284 0.945 . . . . 0.0 111.182 -175.762 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -64.38 -19.75 65.69 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 124.913 1.285 . . . . 0.0 113.57 179.182 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 83.7 mtm180 -64.2 -31.77 73.1 Favored 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 113.661 0.986 . . . . 0.0 113.661 -176.073 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 75.19 178.87 42.9 Favored Glycine 0 CA--C 1.535 1.284 0 C-N-CA 124.412 1.006 . . . . 0.0 112.852 -172.06 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 51.4 p90 -154.78 166.51 33.24 Favored 'General case' 0 CA--C 1.539 0.554 0 N-CA-C 114.179 1.177 . . . . 0.0 114.179 -170.626 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 83.3 t80 -109.16 144.69 36.9 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 125.826 1.65 . . . . 0.0 110.149 167.06 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 39.5 t80 -154.29 136.18 14.56 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 124.832 1.253 . . . . 0.0 111.765 -174.269 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 9.0 t -177.44 145.7 0.6 Allowed Pre-proline 0 N--CA 1.482 1.141 0 C-N-CA 127.036 2.134 . . . . 0.0 110.699 176.115 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 90.9 Cg_endo -76.33 -33.09 3.54 Favored 'Trans proline' 0 CA--C 1.537 0.665 0 C-N-CA 122.863 2.375 . . . . 0.0 112.251 166.173 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 1.3 tmmt? -163.84 135.58 4.8 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 124.734 1.214 . . . . 0.0 111.925 -168.454 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 8.9 t . . . . . 0 C--O 1.254 1.294 0 C-N-CA 126.829 2.051 . . . . 0.0 111.556 178.618 . . . . . . . . 0 0 . 1 . 031 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 1.272 0 N-CA-C 112.211 -0.356 . . . . 0.0 112.211 . . . . . . . . . 0 0 . 1 . 031 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 22.4 pt -101.72 -36.02 4.45 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.32 0 C-N-CA 127.545 2.338 . . . . 0.0 114.346 -4.868 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 21.5 t -63.43 -32.22 55.8 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.239 0 CA-C-N 119.391 0.996 . . . . 0.0 112.94 -165.834 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -85.65 -48.26 9.04 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 125.157 1.383 . . . . 0.0 111.405 176.529 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 62.9 tt0 -69.7 -43.68 71.95 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 124.582 1.153 . . . . 0.0 112.193 -172.436 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 74.0 m -74.15 -15.68 61.02 Favored 'General case' 0 N--CA 1.464 0.256 0 N-CA-C 113.595 0.961 . . . . 0.0 113.595 -179.763 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 44.6 t -85.22 -52.62 5.79 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 125.519 1.528 . . . . 0.0 111.783 172.283 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 37.4 p -74.14 -44.32 54.12 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 124.693 1.197 . . . . 0.0 112.476 -176.525 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 50.9 m -101.54 -161.25 0.84 Allowed 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 125.415 1.486 . . . . 0.0 109.737 164.596 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 27.3 pt -112.31 151.38 14.3 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.708 0 O-C-N 120.801 -1.187 . . . . 0.0 111.311 175.309 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 69.6 m -131.1 161.25 32.48 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 124.741 1.216 . . . . 0.0 111.83 172.841 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 47.1 p -97.77 165.19 12.07 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 124.548 1.139 . . . . 0.0 113.385 176.555 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 58.0 mt -63.81 -33.13 74.98 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 123.571 0.748 . . . . 0.0 111.988 171.492 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 88.5 t80 -67.35 -33.66 75.69 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 123.663 0.785 . . . . 0.0 112.891 173.644 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 92.2 mt-30 -73.09 -33.81 65.82 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 123.464 0.705 . . . . 0.0 111.751 173.553 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 90.9 mt -64.94 -39.59 93.73 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 118.766 0.712 . . . . 0.0 111.701 166.555 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 29.8 tt0 -64.2 -30.64 71.69 Favored 'General case' 0 CA--C 1.543 0.698 0 N-CA-C 112.822 0.675 . . . . 0.0 112.822 179.748 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 18.4 t-20 -60.35 -21.62 62.3 Favored 'General case' 0 CA--C 1.551 1.014 0 O-C-N 121.177 -0.952 . . . . 0.0 113.362 172.794 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 27.6 m-85 -99.89 4.97 45.37 Favored 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 126.301 1.84 . . . . 0.0 113.89 177.128 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 74.7 m -65.57 150.37 48.53 Favored 'General case' 0 N--CA 1.473 0.682 0 O-C-N 120.65 -1.281 . . . . 0.0 111.877 167.303 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 4.8 t30 . . . . . 0 C--O 1.251 1.158 0 C-N-CA 125.646 1.578 . . . . 0.0 112.028 177.176 . . . . . . . . 0 0 . 1 . 031 nuclear orig full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 95.0 m-85 . . . . . 0 N--CA 1.485 1.305 0 CA-C-O 119.657 -0.211 . . . . 0.0 110.846 . . . . . . . . . 0 0 . 1 . 031 nuclear orig full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 10.8 p -68.52 140.98 18.1 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.051 0 CA-C-N 118.47 0.577 . . . . 0.0 110.902 173.882 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 4.6 m-80 -116.82 145.01 43.82 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 125.308 1.443 . . . . 0.0 111.312 175.998 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 41.9 mt-30 -146.42 157.49 43.77 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 124.549 1.14 . . . . 0.0 111.423 -174.74 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 81.8 m-70 -79.3 125.76 29.91 Favored 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 108.173 -1.047 . . . . 0.0 108.173 157.513 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 93.2 mt -137.93 121.51 17.33 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 125.187 1.395 . . . . 0.0 109.612 -176.086 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 59.0 m -128.48 138.58 52.35 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 125.136 1.375 . . . . 0.0 110.633 -174.402 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 52.64 -121.59 15.69 Favored Glycine 0 N--CA 1.473 1.13 0 C-N-CA 124.773 1.178 . . . . 0.0 113.484 167.369 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 31.7 p -61.96 -31.73 72.1 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 124.799 1.24 . . . . 0.0 113.293 -179.789 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 93.0 m-70 -69.75 -37.53 76.46 Favored 'General case' 0 CA--C 1.54 0.591 0 O-C-N 120.896 -1.128 . . . . 0.0 111.436 174.748 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 6.9 tt -68.0 -43.44 78.88 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-O 118.581 -0.724 . . . . 0.0 110.98 172.035 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 53.2 t -55.86 -45.56 79.8 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.004 0 CA-C-N 118.985 0.811 . . . . 0.0 111.253 173.647 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 7.1 tp10 -63.21 -46.96 84.56 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 123.573 0.749 . . . . 0.0 111.281 178.002 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.64 -48.14 80.67 Favored 'General case' 0 CA--C 1.537 0.481 0 O-C-N 121.609 -0.682 . . . . 0.0 111.808 178.881 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 44.1 tp -60.2 -46.62 89.09 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 125.356 1.462 . . . . 0.0 111.124 178.726 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 67.5 t80 -57.69 -42.67 84.14 Favored 'General case' 0 CA--C 1.539 0.522 0 N-CA-C 113.012 0.745 . . . . 0.0 113.012 173.481 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 83.6 mt -74.45 -32.43 62.6 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 123.771 0.828 . . . . 0.0 112.784 -179.741 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 25.8 t -66.29 -46.91 85.96 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.884 0 C-N-CA 124.268 1.027 . . . . 0.0 110.456 171.471 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 75.8 m -80.44 -32.55 37.26 Favored 'General case' 0 N--CA 1.467 0.398 0 N-CA-C 113.628 0.973 . . . . 0.0 113.628 -174.345 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 64.3 -134.13 39.29 Favored Glycine 0 CA--C 1.529 0.914 0 C-N-CA 124.167 0.889 . . . . 0.0 111.454 -176.397 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -68.84 -12.08 61.16 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 124.497 1.119 . . . . 0.0 113.956 179.448 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 86.5 mtm180 -65.25 -32.27 73.86 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 124.162 0.985 . . . . 0.0 113.058 179.802 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 79.26 -179.98 52.51 Favored Glycine 0 CA--C 1.533 1.16 0 C-N-CA 124.517 1.056 . . . . 0.0 112.626 -171.329 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 48.3 p90 -151.73 161.45 42.65 Favored 'General case' 0 N--CA 1.468 0.449 0 N-CA-C 114.057 1.132 . . . . 0.0 114.057 -174.645 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 82.7 t80 -105.13 125.74 51.31 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 125.807 1.643 . . . . 0.0 109.216 167.627 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 62.2 t80 -99.15 -32.26 11.33 Favored 'General case' 0 N--CA 1.475 0.814 0 N-CA-C 114.945 1.461 . . . . 0.0 114.945 -170.265 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 24.2 m -60.83 123.7 76.1 Favored Pre-proline 0 N--CA 1.477 0.877 0 C-N-CA 124.557 1.143 . . . . 0.0 111.615 -162.567 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 68.6 Cg_endo -82.31 171.3 12.61 Favored 'Trans proline' 0 C--N 1.351 0.696 0 C-N-CA 123.322 2.681 . . . . 0.0 111.857 -179.457 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 63.5 tttp -59.07 134.27 56.84 Favored 'General case' 0 CA--C 1.551 1.009 0 C-N-CA 124.058 0.943 . . . . 0.0 112.211 167.764 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 29.9 m . . . . . 0 N--CA 1.489 1.503 0 C-N-CA 129.02 2.928 . . . . 0.0 111.739 176.924 . . . . . . . . 0 0 . 1 . 032 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.74 0 N-CA-C 111.218 -0.753 . . . . 0.0 111.218 . . . . . . . . . 0 0 . 1 . 032 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 25.0 pt -61.72 -28.03 43.36 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.158 0 O-C-N 121.335 -1.097 . . . . 0.0 113.673 -167.677 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 37.9 t -65.83 -23.49 32.45 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.898 0 CA-C-N 118.916 0.78 . . . . 0.0 111.819 -177.925 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -77.68 -57.82 3.6 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-N 118.722 0.692 . . . . 0.0 110.201 168.318 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 62.5 tp60 -55.72 -49.83 71.98 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 124.786 1.235 . . . . 0.0 112.76 -174.662 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 89.3 m -62.21 -26.01 68.12 Favored 'General case' 0 N--CA 1.466 0.348 0 C-N-CA 124.644 1.178 . . . . 0.0 113.711 179.295 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 14.0 t -98.4 -39.73 8.64 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 124.278 1.031 . . . . 0.0 112.257 -171.902 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 1.7 t -83.36 -27.61 29.57 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 125.052 1.341 . . . . 0.0 112.828 178.315 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 21.1 t -140.82 -153.23 0.45 Allowed 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 126.277 1.831 . . . . 0.0 108.828 176.583 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 43.6 pt -101.09 156.24 4.4 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.401 0 C-N-CA 123.889 0.876 . . . . 0.0 111.608 175.329 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 18.1 p -140.17 165.95 26.0 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 124.252 1.021 . . . . 0.0 111.898 173.567 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 88.3 p -104.17 155.72 18.48 Favored 'General case' 0 C--O 1.236 0.383 0 C-N-CA 124.291 1.036 . . . . 0.0 112.481 -175.112 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 57.2 mt -59.02 -29.02 66.95 Favored 'General case' 0 CA--C 1.533 0.293 0 O-C-N 121.294 -0.878 . . . . 0.0 112.058 170.557 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 84.4 t80 -67.2 -29.77 69.53 Favored 'General case' 0 CA--C 1.542 0.653 0 N-CA-C 113.648 0.981 . . . . 0.0 113.648 171.648 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 -78.98 -33.0 45.52 Favored 'General case' 0 N--CA 1.468 0.464 0 O-C-N 121.43 -0.794 . . . . 0.0 110.637 174.333 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 10.8 mp -60.89 -44.46 97.08 Favored 'General case' 0 CA--C 1.542 0.658 0 CA-C-N 118.124 0.42 . . . . 0.0 111.076 164.891 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 31.9 tt0 -63.64 -37.17 86.31 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 123.969 0.908 . . . . 0.0 112.492 179.266 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 21.3 t-20 -61.27 -22.85 65.23 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 123.933 0.893 . . . . 0.0 112.955 173.904 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -94.82 -0.94 53.69 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 125.562 1.545 . . . . 0.0 114.01 176.823 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 38.3 m -65.95 140.66 58.33 Favored 'General case' 0 N--CA 1.471 0.597 0 O-C-N 120.657 -1.277 . . . . 0.0 110.731 163.447 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.254 1.303 0 N-CA-C 112.96 0.726 . . . . 0.0 112.96 177.93 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 73.1 m-85 . . . . . 0 N--CA 1.488 1.435 0 N-CA-C 111.222 0.082 . . . . 0.0 111.222 . . . . . . . . . 0 0 . 1 . 032 nuclear orig full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 25.1 m -142.72 155.18 17.82 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.113 0 C-N-CA 125.19 1.396 . . . . 0.0 111.52 177.346 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 39.9 m-20 -69.9 151.94 45.07 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 124.759 1.223 . . . . 0.0 111.003 168.047 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 45.0 mt-30 -143.89 159.81 41.9 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 123.723 0.809 . . . . 0.0 112.049 -172.254 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 96.4 m-70 -78.3 133.4 37.64 Favored 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 108.936 -0.765 . . . . 0.0 108.936 155.02 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 93.6 mt -150.53 129.91 12.92 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 125.413 1.485 . . . . 0.0 108.259 -174.6 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 4.1 t -156.82 151.82 26.1 Favored 'General case' 0 N--CA 1.469 0.52 0 O-C-N 121.155 -0.966 . . . . 0.0 112.246 -178.677 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 56.94 -132.16 52.3 Favored Glycine 0 CA--C 1.531 1.033 0 C-N-CA 124.708 1.147 . . . . 0.0 112.698 -179.241 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 25.4 m -61.58 -29.32 69.95 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 124.27 1.028 . . . . 0.0 112.146 -177.615 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 14.9 m80 -68.71 -42.4 77.75 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 124.311 1.044 . . . . 0.0 111.008 178.398 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 51.2 tp -68.7 -44.15 74.56 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-O 118.458 -0.782 . . . . 0.0 110.663 172.806 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 53.7 t -58.57 -40.74 79.94 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.895 0 CA-C-N 119.042 0.837 . . . . 0.0 111.72 177.176 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -66.57 -48.58 69.17 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 123.614 0.766 . . . . 0.0 111.459 175.536 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.51 -44.21 97.47 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-O 121.318 0.58 . . . . 0.0 111.809 179.564 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 40.6 tp -60.95 -46.34 91.11 Favored 'General case' 0 C--N 1.333 -0.124 0 C-N-CA 124.905 1.282 . . . . 0.0 111.058 175.9 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 50.7 t80 -64.59 -26.17 68.29 Favored 'General case' 0 CA--C 1.543 0.691 0 N-CA-C 113.69 0.996 . . . . 0.0 113.69 173.814 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 73.7 mt -75.6 -32.44 60.31 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-N 119.71 1.141 . . . . 0.0 113.087 172.341 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 92.6 t -76.85 -38.9 29.91 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.252 0 C-N-CA 124.163 0.985 . . . . 0.0 111.311 173.237 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 63.5 m -105.58 14.68 28.15 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 126.044 1.738 . . . . 0.0 114.158 -172.566 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . -56.98 -36.71 75.0 Favored Glycine 0 N--CA 1.477 1.413 0 CA-C-N 119.275 0.943 . . . . 0.0 114.958 -168.686 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 4.4 mp0 -77.54 -11.75 59.89 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 124.917 1.287 . . . . 0.0 113.494 175.816 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 24.2 mmm180 -111.45 -53.03 2.74 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 126.225 1.81 . . . . 0.0 113.415 -169.467 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 92.18 162.61 37.44 Favored Glycine 0 CA--C 1.536 1.358 0 C-N-CA 124.706 1.146 . . . . 0.0 111.317 -153.641 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 49.5 p90 -142.02 156.58 45.43 Favored 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 114.403 1.26 . . . . 0.0 114.403 -170.94 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 57.3 t80 -94.27 158.57 15.52 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 127.393 2.277 . . . . 0.0 110.008 165.098 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 53.2 t80 -156.32 125.07 5.92 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 124.223 1.009 . . . . 0.0 111.96 -173.404 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 13.9 t -171.69 146.25 1.83 Allowed Pre-proline 0 N--CA 1.483 1.175 0 C-N-CA 125.794 1.638 . . . . 0.0 112.281 177.612 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 92.9 Cg_endo -81.13 -26.83 3.23 Favored 'Trans proline' 0 C--N 1.35 0.628 0 C-N-CA 123.145 2.563 . . . . 0.0 112.512 166.692 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 10.8 ptmt 174.59 -26.79 0.0 OUTLIER 'General case' 0 N--CA 1.481 1.115 0 C-N-CA 127.563 2.345 . . . . 0.0 113.995 -170.135 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 15.3 m . . . . . 0 C--O 1.254 1.298 0 C-N-CA 126.886 2.074 . . . . 0.0 112.846 178.08 . . . . . . . . 0 0 . 1 . 033 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.738 0 N-CA-C 112.589 -0.204 . . . . 0.0 112.589 . . . . . . . . . 0 0 . 1 . 033 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 25.3 pt -59.53 -42.96 89.72 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.167 0 N-CA-C 114.559 1.318 . . . . 0.0 114.559 -167.817 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 70.6 t -60.44 -27.96 41.17 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.281 0 CA-C-N 119.564 1.074 . . . . 0.0 112.166 -179.913 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 -79.64 -64.52 1.17 Allowed 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 123.594 0.758 . . . . 0.0 109.352 170.347 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 11.1 tt0 -58.69 -47.28 85.06 Favored 'General case' 0 N--CA 1.465 0.29 0 C-N-CA 125.063 1.345 . . . . 0.0 112.442 -168.048 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 87.3 m -64.86 -23.08 67.12 Favored 'General case' 0 C--O 1.234 0.255 0 N-CA-C 113.645 0.98 . . . . 0.0 113.645 -178.526 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 8.4 t -101.98 -31.41 10.68 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 123.49 0.716 . . . . 0.0 112.597 -172.377 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 80.7 p -88.6 -28.16 20.88 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 124.532 1.133 . . . . 0.0 112.9 172.399 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 11.8 t -139.13 -160.05 1.02 Allowed 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 126.492 1.917 . . . . 0.0 109.622 178.495 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 42.6 pt -96.51 156.98 3.3 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.476 0 C-N-CA 124.416 1.086 . . . . 0.0 111.731 176.061 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 18.2 p -147.35 160.55 42.41 Favored 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 124.219 1.008 . . . . 0.0 112.695 175.409 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 50.8 m -109.6 155.41 21.47 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 124.568 1.147 . . . . 0.0 111.774 -174.979 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 33.1 mt -60.41 -31.13 70.09 Favored 'General case' 0 N--CA 1.469 0.48 0 O-C-N 120.949 -1.094 . . . . 0.0 112.078 177.762 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 33.4 m-85 -61.09 -30.16 70.18 Favored 'General case' 0 CA--C 1.542 0.66 0 N-CA-C 113.558 0.947 . . . . 0.0 113.558 171.22 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 96.2 mt-30 -81.78 -34.55 30.28 Favored 'General case' 0 N--CA 1.465 0.294 0 C-N-CA 123.94 0.896 . . . . 0.0 110.298 177.355 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 8.3 mp -62.12 -40.39 95.73 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 118.775 0.716 . . . . 0.0 111.785 166.653 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -59.16 -28.35 66.51 Favored 'General case' 0 CA--C 1.541 0.596 0 C-N-CA 124.587 1.155 . . . . 0.0 113.105 -178.146 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 5.4 m-80 -66.29 -16.33 63.95 Favored 'General case' 0 CA--C 1.546 0.816 0 N-CA-C 113.795 1.035 . . . . 0.0 113.795 175.559 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 72.5 m-85 -102.21 5.2 40.04 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 125.908 1.683 . . . . 0.0 113.458 177.609 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 86.0 m -66.42 153.84 41.74 Favored 'General case' 0 N--CA 1.473 0.701 0 O-C-N 121.018 -1.052 . . . . 0.0 112.422 167.735 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 28.1 t30 . . . . . 0 C--O 1.252 1.203 0 C-N-CA 125.577 1.551 . . . . 0.0 112.185 175.763 . . . . . . . . 0 0 . 1 . 033 nuclear orig full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 50.9 p90 . . . . . 0 N--CA 1.488 1.431 0 N-CA-C 110.807 -0.072 . . . . 0.0 110.807 . . . . . . . . . 0 0 . 1 . 033 nuclear orig full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 9.0 p -156.64 154.57 6.01 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.052 0 C-N-CA 124.736 1.214 . . . . 0.0 111.473 -177.219 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 10.4 p30 -127.02 148.01 50.12 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 125.617 1.567 . . . . 0.0 111.569 171.973 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 38.7 mt-30 -150.43 167.42 27.17 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 124.444 1.098 . . . . 0.0 111.479 -166.673 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 92.4 m-70 -86.72 136.74 32.9 Favored 'General case' 0 CA--C 1.542 0.671 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 152.675 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 93.3 mt -148.93 136.03 19.99 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 125.582 1.553 . . . . 0.0 109.412 -176.875 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 73.0 m -140.74 145.29 36.23 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 124.742 1.217 . . . . 0.0 110.526 -179.11 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 52.53 -125.71 29.81 Favored Glycine 0 N--CA 1.473 1.135 0 C-N-CA 124.772 1.177 . . . . 0.0 114.503 165.381 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 23.6 m -60.39 -36.92 79.21 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 124.061 0.944 . . . . 0.0 111.941 -177.656 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 27.5 m170 -68.62 -37.93 80.13 Favored 'General case' 0 CA--C 1.54 0.559 0 O-C-N 121.325 -0.86 . . . . 0.0 111.809 178.25 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 9.6 tt -64.14 -45.94 86.29 Favored 'General case' 0 C--O 1.223 -0.305 0 C-N-CA 123.993 0.917 . . . . 0.0 110.796 170.074 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 41.7 t -61.65 -37.18 77.34 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.963 0 C-N-CA 123.602 0.761 . . . . 0.0 111.836 178.4 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -68.31 -45.43 72.99 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 124.022 0.929 . . . . 0.0 111.804 173.364 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.76 -43.67 97.72 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 119.352 0.978 . . . . 0.0 111.756 175.248 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 51.4 tp -61.15 -48.76 80.12 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 125.222 1.409 . . . . 0.0 111.022 177.109 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 46.9 t80 -54.35 -40.02 67.66 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 123.49 0.716 . . . . 0.0 112.659 172.436 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 82.2 mt -74.9 -33.9 62.1 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 123.961 0.904 . . . . 0.0 113.248 178.703 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 40.0 t -65.85 -44.7 92.7 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.924 0 C-N-CA 124.413 1.085 . . . . 0.0 110.98 172.15 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 58.5 m -83.41 -29.81 27.82 Favored 'General case' 0 N--CA 1.469 0.504 0 N-CA-C 113.676 0.991 . . . . 0.0 113.676 -175.087 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 67.61 -144.89 44.63 Favored Glycine 0 CA--C 1.532 1.129 0 C-N-CA 124.224 0.916 . . . . 0.0 112.012 -174.499 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -68.96 -7.42 35.05 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 124.65 1.18 . . . . 0.0 114.139 -178.953 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 80.0 mtt85 -61.31 -31.88 71.74 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 124.733 1.213 . . . . 0.0 113.389 177.049 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 86.34 179.35 49.55 Favored Glycine 0 CA--C 1.533 1.164 0 C-N-CA 125.112 1.339 . . . . 0.0 112.441 -170.654 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 52.6 p90 -159.65 167.32 28.69 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 124.729 1.212 . . . . 0.0 112.833 -173.274 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 81.7 t80 -132.97 96.27 3.74 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 125.999 1.72 . . . . 0.0 108.314 172.209 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 21.6 p90 -73.49 -19.16 61.0 Favored 'General case' 0 CA--C 1.541 0.605 0 N-CA-C 115.029 1.492 . . . . 0.0 115.029 -167.883 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 26.8 m -57.33 126.68 75.18 Favored Pre-proline 0 N--CA 1.473 0.711 0 C-N-CA 125.769 1.627 . . . . 0.0 110.196 -175.408 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 68.4 Cg_endo -74.2 -24.32 14.76 Favored 'Trans proline' 0 C--N 1.349 0.563 0 C-N-CA 123.173 2.582 . . . . 0.0 114.346 -166.649 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 25.4 ttmt -137.01 -2.61 2.07 Favored 'General case' 0 CA--C 1.551 0.982 0 N-CA-C 114.377 1.251 . . . . 0.0 114.377 -165.131 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 23.7 m . . . . . 0 N--CA 1.487 1.414 0 C-N-CA 128.976 2.91 . . . . 0.0 112.67 177.974 . . . . . . . . 0 0 . 1 . 034 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.729 0 CA-C-O 119.293 -0.726 . . . . 0.0 111.467 . . . . . . . . . 0 0 . 1 . 034 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 17.8 tt -60.16 -25.23 32.78 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.274 0 N-CA-C 115.142 1.534 . . . . 0.0 115.142 -167.367 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 74.7 t -52.87 -39.42 31.69 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.041 0 CA-C-N 119.447 1.021 . . . . 0.0 111.396 170.884 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 18.8 tt0 -79.17 0.89 26.49 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 123.642 0.777 . . . . 0.0 113.027 -179.519 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 6.7 tp60 -104.54 -63.05 1.25 Allowed 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 124.458 1.103 . . . . 0.0 109.643 166.032 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 64.5 m -66.19 -26.18 67.28 Favored 'General case' 0 N--CA 1.467 0.424 0 N-CA-C 115.151 1.537 . . . . 0.0 115.151 -170.152 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 12.1 t -87.61 -33.36 18.88 Favored 'General case' 0 N--CA 1.471 0.585 0 O-C-N 121.708 -0.62 . . . . 0.0 112.594 -172.117 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 20.7 p -105.69 -35.29 7.44 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 126.29 1.836 . . . . 0.0 112.826 -175.806 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.1 t -112.18 -171.79 1.92 Allowed 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 125.48 1.512 . . . . 0.0 110.31 169.579 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 11.1 tt -92.83 146.72 6.03 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.686 0 C-N-CA 124.807 1.243 . . . . 0.0 110.329 173.624 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 27.2 p -133.56 158.21 43.73 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-O 121.805 0.812 . . . . 0.0 112.448 175.285 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 83.8 p -104.78 158.29 16.62 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 125.006 1.322 . . . . 0.0 111.939 -179.802 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 55.8 mt -60.16 -30.29 69.22 Favored 'General case' 0 N--CA 1.466 0.34 0 O-C-N 121.083 -1.011 . . . . 0.0 111.927 173.87 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 76.9 t80 -65.7 -31.98 73.29 Favored 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 113.398 0.888 . . . . 0.0 113.398 171.249 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 40.5 mt-30 -73.73 -36.84 65.22 Favored 'General case' 0 N--CA 1.468 0.458 0 O-C-N 121.5 -0.75 . . . . 0.0 110.483 173.144 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 7.0 mp -61.59 -40.12 93.64 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-N 118.608 0.64 . . . . 0.0 111.603 168.992 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 27.5 tt0 -68.51 -32.41 72.35 Favored 'General case' 0 CA--C 1.544 0.737 0 N-CA-C 112.786 0.661 . . . . 0.0 112.786 178.83 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 6.3 m-80 -66.21 -15.11 62.89 Favored 'General case' 0 CA--C 1.549 0.936 0 O-C-N 120.914 -1.116 . . . . 0.0 112.976 171.05 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 14.0 m-85 -97.75 1.33 48.32 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 125.889 1.676 . . . . 0.0 113.639 172.381 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 39.4 m -65.41 146.68 54.59 Favored 'General case' 0 CA--C 1.546 0.789 0 CA-C-N 119.93 1.241 . . . . 0.0 110.794 162.144 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.252 1.196 0 C-N-CA 123.713 0.805 . . . . 0.0 112.974 174.949 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 63.7 m-85 . . . . . 0 N--CA 1.487 1.384 0 CA-C-O 119.64 -0.219 . . . . 0.0 111.167 . . . . . . . . . 0 0 . 1 . 034 nuclear orig full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 22.0 m -141.79 152.07 18.98 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.104 0 C-N-CA 125.096 1.358 . . . . 0.0 111.842 177.292 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 65.4 m-20 -80.52 150.23 29.71 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 125.071 1.348 . . . . 0.0 110.426 169.836 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 41.9 mt-30 -146.03 159.29 43.47 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 123.575 0.75 . . . . 0.0 112.02 -166.908 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 99.0 m-70 -86.13 133.24 33.88 Favored 'General case' 0 CA--C 1.54 0.576 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 154.772 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 96.3 mt -146.66 135.52 22.33 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 125.375 1.47 . . . . 0.0 108.668 -172.007 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 4.2 t -160.45 154.8 23.46 Favored 'General case' 0 N--CA 1.466 0.348 0 O-C-N 121.538 -0.726 . . . . 0.0 111.99 -175.584 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 62.97 -139.61 44.92 Favored Glycine 0 N--CA 1.47 0.943 0 C-N-CA 123.969 0.795 . . . . 0.0 112.691 -178.845 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 23.9 p -61.83 -29.09 69.94 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 124.675 1.19 . . . . 0.0 112.411 179.64 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 15.7 m80 -62.6 -42.09 99.36 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 124.311 1.044 . . . . 0.0 111.939 176.668 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 40.4 tp -71.72 -40.0 69.75 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 123.628 0.771 . . . . 0.0 111.432 175.299 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 88.1 t -58.5 -43.19 86.37 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.202 0 C-N-CA 123.094 0.558 . . . . 0.0 111.406 173.31 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -67.31 -43.41 81.75 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 124.291 1.037 . . . . 0.0 111.752 176.443 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.36 -44.49 97.08 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 122.942 0.497 . . . . 0.0 111.671 177.14 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 34.9 mt -60.43 -46.59 89.48 Favored 'General case' 0 N--CA 1.467 0.407 0 C-N-CA 124.046 0.938 . . . . 0.0 111.084 174.408 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 84.2 t80 -56.56 -39.57 73.68 Favored 'General case' 0 CA--C 1.543 0.705 0 CA-C-N 118.725 0.693 . . . . 0.0 112.75 174.263 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 89.8 mt -77.62 -36.01 52.12 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 124.074 0.949 . . . . 0.0 113.47 179.805 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 41.1 t -69.14 -44.46 80.86 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.921 0 C-N-CA 124.036 0.934 . . . . 0.0 110.741 174.571 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 75.0 m -85.72 -30.75 22.88 Favored 'General case' 0 N--CA 1.47 0.531 0 N-CA-C 113.374 0.879 . . . . 0.0 113.374 -173.205 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 63.49 -132.08 41.42 Favored Glycine 0 CA--C 1.531 1.046 0 C-N-CA 123.975 0.797 . . . . 0.0 111.377 -177.508 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -69.74 -11.72 61.07 Favored 'General case' 0 CA--C 1.547 0.849 0 N-CA-C 113.8 1.037 . . . . 0.0 113.8 179.797 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 83.8 mtm180 -64.73 -37.45 87.65 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-N 119.13 0.877 . . . . 0.0 112.898 -179.459 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 83.07 169.68 45.02 Favored Glycine 0 CA--C 1.534 1.269 0 C-N-CA 124.513 1.054 . . . . 0.0 112.822 -170.356 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 53.5 p90 -153.34 160.61 42.72 Favored 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 114.198 1.184 . . . . 0.0 114.198 -170.398 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 46.0 t80 -101.42 154.51 18.75 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 126.317 1.847 . . . . 0.0 110.219 164.59 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 47.9 t80 -143.11 -35.14 0.41 Allowed 'General case' 0 CA--C 1.543 0.707 0 N-CA-C 114.604 1.335 . . . . 0.0 114.604 -172.029 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 11.6 m -51.89 138.49 33.85 Favored Pre-proline 0 N--CA 1.478 0.944 0 C-N-CA 126.338 1.855 . . . . 0.0 112.912 -163.742 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_exo -57.82 166.43 5.24 Favored 'Trans proline' 0 C--N 1.351 0.684 0 C-N-CA 124.07 3.18 . . . . 0.0 113.861 173.566 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -64.75 -39.56 93.83 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 123.693 0.797 . . . . 0.0 111.994 171.928 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 34.0 m . . . . . 0 N--CA 1.488 1.462 0 C-N-CA 129.669 3.188 . . . . 0.0 111.79 178.172 . . . . . . . . 0 0 . 1 . 035 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.663 0 N-CA-C 112.57 -0.212 . . . . 0.0 112.57 . . . . . . . . . 0 0 . 1 . 035 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 10.5 tp -126.3 -32.98 0.91 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.233 0 C-N-CA 127.615 2.366 . . . . 0.0 114.185 1.938 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 54.7 t -60.74 -59.85 3.56 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.27 0 CA-C-N 120.178 1.353 . . . . 0.0 112.553 -170.611 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -71.42 -33.68 69.63 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 118.187 0.449 . . . . 0.0 111.354 -178.873 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 18.1 tt0 -59.66 -56.89 16.26 Favored 'General case' 0 N--CA 1.466 0.334 0 C-N-CA 123.411 0.684 . . . . 0.0 110.987 177.948 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 2.1 t -73.45 -15.9 61.32 Favored 'General case' 0 N--CA 1.469 0.515 0 N-CA-C 113.547 0.943 . . . . 0.0 113.547 -174.276 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 26.2 t -90.29 -35.41 15.29 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 123.853 0.861 . . . . 0.0 112.999 178.634 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 76.8 p -95.58 -37.03 11.03 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 124.417 1.087 . . . . 0.0 113.097 177.833 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 17.7 t -113.46 -147.54 0.42 Allowed 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 126.923 2.089 . . . . 0.0 108.74 168.075 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 44.5 pt -118.01 168.49 9.86 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 C-N-CA 125.113 1.365 . . . . 0.0 112.616 -179.767 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 20.1 p -147.44 159.09 44.11 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 124.501 1.121 . . . . 0.0 111.661 166.663 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 88.6 p -96.17 162.12 13.67 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 125.142 1.377 . . . . 0.0 112.43 174.822 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 57.5 mt -60.42 -34.2 73.61 Favored 'General case' 0 N--CA 1.468 0.464 0 O-C-N 121.391 -0.818 . . . . 0.0 111.535 173.292 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 79.9 m-85 -65.6 -34.04 77.3 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 123.81 0.844 . . . . 0.0 113.014 173.028 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 45.2 mt-30 -72.28 -35.88 68.82 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-O 118.468 -0.777 . . . . 0.0 111.98 171.718 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 68.5 mt -58.57 -46.4 86.99 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 119.143 0.883 . . . . 0.0 110.949 169.276 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 22.5 tt0 -69.53 -27.34 65.08 Favored 'General case' 0 CA--C 1.541 0.597 0 N-CA-C 113.307 0.855 . . . . 0.0 113.307 -178.251 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.7 m-80 -62.65 -22.42 66.43 Favored 'General case' 0 CA--C 1.546 0.791 0 O-C-N 120.954 -1.091 . . . . 0.0 113.504 176.579 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 62.6 m-85 -99.91 0.81 41.99 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 125.169 1.388 . . . . 0.0 113.709 174.231 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 89.7 m -83.79 166.56 17.88 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 124.197 0.999 . . . . 0.0 113.188 171.838 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 32.3 m120 . . . . . 0 C--O 1.254 1.316 0 C-N-CA 124.771 1.228 . . . . 0.0 112.287 174.113 . . . . . . . . 0 0 . 1 . 035 nuclear orig full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 77.6 m-85 . . . . . 0 N--CA 1.486 1.363 0 N-CA-C 111.286 0.106 . . . . 0.0 111.286 . . . . . . . . . 0 0 . 1 . 035 nuclear orig full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 15.9 m -139.61 36.99 0.43 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.367 0 C-N-CA 126.052 1.741 . . . . 0.0 111.134 177.329 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 8.1 p-10 -165.8 147.1 7.0 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 125.723 1.609 . . . . 0.0 112.745 -157.381 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 41.7 mt-30 -152.14 169.16 23.11 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 125.11 1.364 . . . . 0.0 111.885 -169.29 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 98.4 m-70 -88.17 135.35 33.48 Favored 'General case' 0 CA--C 1.542 0.673 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 150.276 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 86.6 mt -145.09 132.28 20.49 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 125.063 1.345 . . . . 0.0 110.53 -179.055 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 63.6 m -131.51 141.87 49.83 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 125.568 1.547 . . . . 0.0 110.295 178.097 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 51.57 -120.26 9.83 Favored Glycine 0 N--CA 1.475 1.28 0 C-N-CA 124.843 1.211 . . . . 0.0 114.372 165.543 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 29.3 m -60.13 -33.8 72.64 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 124.234 1.014 . . . . 0.0 112.627 -177.742 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 97.1 m-70 -72.16 -38.21 69.21 Favored 'General case' 0 CA--C 1.54 0.574 0 O-C-N 121.324 -0.86 . . . . 0.0 111.324 177.554 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 62.6 tp -65.13 -45.34 85.45 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 123.718 0.807 . . . . 0.0 111.126 172.392 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 27.5 t -60.38 -41.69 88.21 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.898 0 C-N-CA 124.246 1.018 . . . . 0.0 111.771 175.61 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -63.77 -47.41 81.07 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 123.631 0.772 . . . . 0.0 111.423 174.498 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.49 -43.87 97.75 Favored 'General case' 0 CA--C 1.541 0.62 0 O-C-N 121.691 -0.631 . . . . 0.0 112.477 179.549 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 25.5 mt -54.27 -50.93 66.1 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 124.45 1.1 . . . . 0.0 110.913 172.354 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 57.7 t80 -63.75 -33.06 74.82 Favored 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 113.463 0.912 . . . . 0.0 113.463 176.9 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 74.5 mt -74.69 -36.28 62.75 Favored 'General case' 0 N--CA 1.472 0.631 0 O-C-N 121.044 -1.035 . . . . 0.0 113.175 177.394 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 53.2 t -71.72 -43.44 70.18 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.875 0 C-N-CA 123.762 0.825 . . . . 0.0 111.066 175.709 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 65.1 m -104.72 -17.77 14.52 Favored 'General case' 0 N--CA 1.475 0.783 0 N-CA-C 114.467 1.284 . . . . 0.0 114.467 -166.593 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 67.72 -155.57 52.87 Favored Glycine 0 CA--C 1.531 1.081 0 C-N-CA 124.927 1.251 . . . . 0.0 113.18 179.642 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -71.83 -1.75 15.28 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 124.526 1.13 . . . . 0.0 113.297 175.606 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 29.1 ttp180 -60.83 -26.21 67.16 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 125.45 1.5 . . . . 0.0 112.886 176.531 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 111.5 139.52 7.9 Favored Glycine 0 CA--C 1.53 1.001 0 C-N-CA 126.392 1.949 . . . . 0.0 112.863 177.093 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 40.9 p90 -144.07 166.92 23.63 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 125.671 1.589 . . . . 0.0 112.167 -176.647 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 44.5 t80 -153.38 141.67 20.56 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-O 121.74 0.781 . . . . 0.0 112.564 169.588 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 19.4 p90 -88.58 80.69 7.27 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 126.626 1.97 . . . . 0.0 110.597 175.558 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 55.8 m -62.5 122.0 70.79 Favored Pre-proline 0 N--CA 1.478 0.966 0 C-N-CA 125.678 1.591 . . . . 0.0 112.229 -176.09 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 66.4 Cg_endo -80.06 169.36 17.81 Favored 'Trans proline' 0 CA--C 1.537 0.65 0 C-N-CA 124.128 3.219 . . . . 0.0 111.7 176.097 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 33.7 ttmt -66.27 140.26 58.12 Favored 'General case' 0 CA--C 1.549 0.917 0 C-N-CA 123.694 0.798 . . . . 0.0 112.041 172.446 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 18.8 m . . . . . 0 C--O 1.253 1.275 0 C-N-CA 126.278 1.831 . . . . 0.0 112.889 -178.336 . . . . . . . . 0 0 . 1 . 036 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.67 0 N-CA-C 112.52 -0.232 . . . . 0.0 112.52 . . . . . . . . . 0 0 . 1 . 036 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 20.1 pt -63.11 -37.34 79.13 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.249 0 N-CA-C 115.086 1.513 . . . . 0.0 115.086 -163.973 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 85.2 t -63.99 -35.87 74.92 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.259 0 CA-C-N 118.952 0.796 . . . . 0.0 110.909 176.102 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -74.04 -47.81 34.29 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 123.097 0.559 . . . . 0.0 110.102 176.379 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 13.3 tm0? -58.74 -47.07 85.9 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 124.499 1.12 . . . . 0.0 111.693 -177.409 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 12.4 m -59.15 -23.89 62.56 Favored 'General case' 0 N--CA 1.47 0.525 0 N-CA-C 113.727 1.01 . . . . 0.0 113.727 174.988 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 49.4 t -98.13 -49.23 4.81 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 124.97 1.308 . . . . 0.0 113.324 -172.191 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 77.0 p -79.04 -36.11 41.57 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 124.641 1.176 . . . . 0.0 112.087 -179.662 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 13.2 t -106.77 -154.68 0.53 Allowed 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 125.554 1.542 . . . . 0.0 109.319 164.438 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 26.7 pt -117.29 155.6 18.88 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.624 0 C-N-CA 125.704 1.602 . . . . 0.0 111.474 178.036 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 16.1 p -145.87 162.32 38.0 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 124.041 0.936 . . . . 0.0 111.935 171.772 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 32.6 t -101.85 156.27 17.62 Favored 'General case' 0 N--CA 1.465 0.318 0 C-N-CA 124.071 0.948 . . . . 0.0 112.74 -173.383 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 55.5 mt -59.56 -31.95 69.9 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 124.178 0.991 . . . . 0.0 111.461 174.192 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 3.5 m-30 -67.62 -25.26 65.66 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 124.307 1.043 . . . . 0.0 112.727 173.703 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 89.2 mt-30 -88.41 -31.04 19.03 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 124.405 1.082 . . . . 0.0 110.527 178.505 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 10.9 mp -57.28 -52.65 64.48 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 122.964 0.506 . . . . 0.0 110.578 161.694 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 5.6 tm-20 -58.95 -29.51 67.19 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 124.956 1.303 . . . . 0.0 113.413 -173.971 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 22.3 t30 -51.76 -30.01 21.04 Favored 'General case' 0 CA--C 1.549 0.918 0 C-N-CA 124.934 1.293 . . . . 0.0 114.29 175.087 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 95.2 m-85 -94.79 0.45 54.93 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 125.347 1.459 . . . . 0.0 113.993 -177.343 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 75.3 m -87.36 160.87 18.21 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 124.303 1.041 . . . . 0.0 113.409 177.77 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.253 1.242 0 C-N-CA 124.785 1.234 . . . . 0.0 112.62 179.913 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 94.4 m-85 . . . . . 0 N--CA 1.486 1.349 0 CA-C-O 119.089 -0.481 . . . . 0.0 110.755 . . . . . . . . . 0 0 . 1 . 036 nuclear orig full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 7.2 p -165.75 121.89 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.046 0 C-N-CA 125.189 1.396 . . . . 0.0 109.522 171.344 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 40.3 m-80 -99.92 145.66 27.55 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 124.567 1.147 . . . . 0.0 113.331 -168.512 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 36.9 mt-30 -145.57 164.19 32.45 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 125.69 1.596 . . . . 0.0 110.552 177.656 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 98.9 m-70 -81.45 128.98 34.45 Favored 'General case' 0 CA--C 1.538 0.5 0 N-CA-C 108.711 -0.848 . . . . 0.0 108.711 157.889 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 89.9 mt -142.24 124.69 15.7 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 125.498 1.519 . . . . 0.0 109.169 -176.302 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 61.5 m -127.67 137.55 52.54 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 124.256 1.022 . . . . 0.0 111.251 -173.646 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 45.59 -118.85 3.25 Favored Glycine 0 N--CA 1.472 1.075 0 C-N-CA 126.04 1.781 . . . . 0.0 114.708 165.404 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 19.1 m -60.0 -33.11 71.54 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 124.33 1.052 . . . . 0.0 112.693 -178.655 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 83.0 m-70 -78.77 -29.91 45.34 Favored 'General case' 0 CA--C 1.543 0.686 0 O-C-N 121.083 -1.01 . . . . 0.0 112.659 176.885 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 54.4 tp -65.48 -45.44 83.64 Favored 'General case' 0 N--CA 1.47 0.571 0 O-C-N 121.444 -0.785 . . . . 0.0 110.991 167.909 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 77.1 t -65.89 -35.02 74.12 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.022 0 C-N-CA 123.869 0.868 . . . . 0.0 111.934 175.95 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -63.87 -50.4 68.95 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 124.799 1.239 . . . . 0.0 111.569 171.623 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -58.76 -43.55 90.36 Favored 'General case' 0 CA--C 1.54 0.567 0 O-C-N 121.895 -0.503 . . . . 0.0 111.594 176.564 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 52.9 tp -58.8 -47.74 83.71 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 124.818 1.247 . . . . 0.0 111.677 177.23 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 89.7 t80 -59.27 -40.46 86.12 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 123.613 0.765 . . . . 0.0 112.452 173.119 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 90.0 mt -75.61 -35.22 60.58 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 124.113 0.965 . . . . 0.0 113.314 -178.156 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 41.4 t -65.24 -44.22 95.16 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.958 0 C-N-CA 124.378 1.071 . . . . 0.0 110.303 174.406 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 74.4 m -98.77 -17.72 18.35 Favored 'General case' 0 N--CA 1.471 0.611 0 N-CA-C 115.094 1.516 . . . . 0.0 115.094 -169.838 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 65.14 -138.79 39.42 Favored Glycine 0 CA--C 1.53 1.016 0 C-N-CA 124.81 1.195 . . . . 0.0 113.019 176.79 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -63.07 -19.66 64.61 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 125.524 1.53 . . . . 0.0 113.553 -176.392 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 50.8 mtm180 -61.47 -36.69 81.16 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 124.042 0.937 . . . . 0.0 113.151 -178.584 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.57 -176.45 42.24 Favored Glycine 0 CA--C 1.533 1.212 0 C-N-CA 123.992 0.806 . . . . 0.0 113.565 -178.17 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 37.9 p90 -156.89 169.98 23.54 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 125.332 1.453 . . . . 0.0 113.121 -168.362 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 89.1 t80 -126.99 133.19 50.61 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 125.124 1.37 . . . . 0.0 109.051 161.577 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -152.28 141.01 20.93 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 123.512 0.725 . . . . 0.0 112.261 -171.53 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 31.1 p -142.41 155.47 64.21 Favored Pre-proline 0 N--CA 1.475 0.776 0 C-N-CA 125.88 1.672 . . . . 0.0 110.792 -174.952 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 88.9 Cg_endo -75.88 -21.67 14.05 Favored 'Trans proline' 0 C--N 1.35 0.644 0 C-N-CA 123.026 2.484 . . . . 0.0 113.09 176.578 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 40.4 ttmt -153.87 143.74 21.9 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 125.597 1.559 . . . . 0.0 110.948 -175.952 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 9.2 t . . . . . 0 C--O 1.253 1.259 0 C-N-CA 126.637 1.975 . . . . 0.0 111.413 -176.33 . . . . . . . . 0 0 . 1 . 037 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.797 0 N-CA-C 111.343 -0.703 . . . . 0.0 111.343 . . . . . . . . . 0 0 . 1 . 037 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 13.3 tt -60.42 -29.67 44.87 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.255 0 N-CA-C 114.555 1.317 . . . . 0.0 114.555 -169.069 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 55.4 t -68.61 -25.62 31.25 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.056 0 CA-C-N 119.026 0.83 . . . . 0.0 111.917 179.62 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 78.5 mt-10 -86.66 -48.06 8.62 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-N 118.946 0.794 . . . . 0.0 111.047 168.72 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 61.8 tp60 -60.46 -44.32 95.99 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 123.144 0.578 . . . . 0.0 112.176 -175.162 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -79.59 -19.61 48.91 Favored 'General case' 0 CA--C 1.536 0.408 0 N-CA-C 113.641 0.978 . . . . 0.0 113.641 -177.128 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 48.3 t -100.54 -55.46 2.59 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 124.212 1.005 . . . . 0.0 113.002 -174.706 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 50.7 m -76.17 -42.99 44.78 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 125.45 1.5 . . . . 0.0 110.217 -177.244 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 16.4 t -99.98 -150.92 0.39 Allowed 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 123.725 0.81 . . . . 0.0 109.266 158.468 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 34.9 pt -120.99 158.24 23.66 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.675 0 C-N-CA 125.402 1.481 . . . . 0.0 112.078 179.056 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -148.78 165.8 30.35 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-O 121.974 0.892 . . . . 0.0 113.035 166.411 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 16.6 t -109.81 166.97 10.5 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 123.986 0.914 . . . . 0.0 112.182 -175.717 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 49.1 mt -57.26 -31.85 66.0 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 124.575 1.15 . . . . 0.0 111.705 174.817 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 27.7 m-85 -59.66 -33.54 71.68 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.215 1.006 . . . . 0.0 113.576 171.334 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 20.7 mm100 -82.05 -32.64 30.31 Favored 'General case' 0 N--CA 1.468 0.428 0 C-N-CA 124.483 1.113 . . . . 0.0 111.069 177.472 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 73.4 mt -60.66 -43.13 97.98 Favored 'General case' 0 CA--C 1.542 0.636 0 CA-C-N 118.418 0.554 . . . . 0.0 110.603 167.78 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -65.33 -35.93 82.48 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 123.85 0.86 . . . . 0.0 112.309 174.058 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 21.6 t-20 -63.77 -29.34 70.56 Favored 'General case' 0 CA--C 1.548 0.884 0 O-C-N 120.801 -1.187 . . . . 0.0 113.065 176.964 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 4.9 m-85 -83.01 -0.84 50.74 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 125.074 1.35 . . . . 0.0 113.891 172.349 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 8.1 t -82.07 164.9 21.06 Favored 'General case' 0 CA--C 1.54 0.589 0 O-C-N 120.873 -1.142 . . . . 0.0 113.479 175.422 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 38.3 m-80 . . . . . 0 C--O 1.25 1.088 0 C-N-CA 124.81 1.244 . . . . 0.0 111.206 167.426 . . . . . . . . 0 0 . 1 . 037 nuclear orig full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 80.2 m-85 . . . . . 0 N--CA 1.487 1.419 0 CA-C-O 119.359 -0.353 . . . . 0.0 110.388 . . . . . . . . . 0 0 . 1 . 037 nuclear orig full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 12.9 m -147.19 144.28 19.8 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.205 0 C-N-CA 124.984 1.313 . . . . 0.0 111.994 -176.873 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 60.9 t-20 -100.76 131.7 46.52 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 126.178 1.791 . . . . 0.0 109.653 170.503 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 26.7 mm-40 -150.83 161.37 42.8 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 124.475 1.11 . . . . 0.0 113.207 -160.897 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 85.5 m-70 -80.47 123.79 28.36 Favored 'General case' 0 CA--C 1.542 0.636 0 N-CA-C 108.786 -0.82 . . . . 0.0 108.786 156.944 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 91.1 mt -138.67 127.46 23.6 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 126.133 1.773 . . . . 0.0 108.878 178.368 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 73.5 m -132.41 143.87 50.11 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 124.961 1.304 . . . . 0.0 111.066 -173.566 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 52.78 -123.77 24.85 Favored Glycine 0 N--CA 1.471 0.997 0 C-N-CA 124.907 1.242 . . . . 0.0 113.776 166.302 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 20.3 m -61.25 -33.01 72.81 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 123.958 0.903 . . . . 0.0 112.702 -179.063 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 99.5 m-70 -73.52 -35.46 65.58 Favored 'General case' 0 CA--C 1.54 0.568 0 O-C-N 121.196 -0.94 . . . . 0.0 111.81 176.65 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 56.5 tp -64.5 -46.97 80.7 Favored 'General case' 0 N--CA 1.466 0.326 0 C-N-CA 123.332 0.653 . . . . 0.0 110.706 170.509 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 76.5 t -60.77 -41.15 87.36 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 C-N-CA 123.296 0.638 . . . . 0.0 111.515 176.063 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 42.9 tt0 -63.34 -48.34 78.39 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 123.575 0.75 . . . . 0.0 111.434 177.253 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.12 -45.75 92.1 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 123.069 0.548 . . . . 0.0 111.887 177.923 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 37.2 tp -60.43 -43.68 96.53 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 125.056 1.343 . . . . 0.0 111.436 178.454 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 68.8 t80 -64.76 -34.05 77.42 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 124.079 0.952 . . . . 0.0 113.328 172.381 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 65.8 mt -74.13 -31.93 62.96 Favored 'General case' 0 N--CA 1.472 0.626 0 O-C-N 121.044 -1.035 . . . . 0.0 113.142 176.317 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 79.4 t -72.96 -44.03 58.12 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.039 0 CA-C-N 118.367 0.531 . . . . 0.0 111.135 172.6 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -148.27 11.05 0.9 Allowed 'General case' 0 N--CA 1.473 0.705 0 N-CA-C 117.065 2.246 . . . . 0.0 117.065 -161.744 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . -63.76 -23.83 67.62 Favored Glycine 0 N--CA 1.476 1.317 0 O-C-N 120.803 -1.186 . . . . 0.0 115.46 -171.86 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -73.96 -22.51 59.62 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-N 118.255 1.028 . . . . 0.0 113.755 173.436 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 29.4 mtp180 -94.09 -37.08 11.8 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 125.486 1.514 . . . . 0.0 111.835 172.99 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 94.13 142.15 11.98 Favored Glycine 0 CA--C 1.527 0.844 0 C-N-CA 126.051 1.786 . . . . 0.0 112.851 176.707 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 25.9 p90 -127.13 159.76 33.26 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 125.115 1.366 . . . . 0.0 114.221 -166.909 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 40.3 t80 -90.04 159.07 17.03 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 126.024 1.73 . . . . 0.0 110.555 164.523 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 64.9 t80 -161.7 126.54 3.44 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 125.221 1.408 . . . . 0.0 111.056 -171.174 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 14.4 t -170.01 148.1 3.01 Favored Pre-proline 0 N--CA 1.482 1.142 0 C-N-CA 125.109 1.363 . . . . 0.0 112.601 -176.879 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_endo -78.3 -26.42 6.22 Favored 'Trans proline' 0 C--N 1.35 0.632 0 C-N-CA 123.254 2.636 . . . . 0.0 112.852 163.881 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -119.48 125.79 49.73 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.415 1.086 . . . . 0.0 112.148 -163.777 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 10.3 m . . . . . 0 C--O 1.254 1.292 0 C-N-CA 125.581 1.553 . . . . 0.0 112.407 -173.865 . . . . . . . . 0 0 . 1 . 038 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.824 0 N-CA-C 110.939 -0.864 . . . . 0.0 110.939 . . . . . . . . . 0 0 . 1 . 038 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 36.7 pt -65.53 -20.36 27.29 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.272 0 N-CA-C 115.353 1.612 . . . . 0.0 115.353 -161.847 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 20.4 t -54.71 -36.7 37.33 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.262 0 C-N-CA 123.932 0.893 . . . . 0.0 110.746 169.494 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -71.6 -13.96 61.93 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 123.653 0.781 . . . . 0.0 112.796 -178.476 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 53.6 tp60 -85.63 -77.69 0.29 Allowed 'General case' 0 C--O 1.226 -0.176 0 N-CA-C 108.082 -1.081 . . . . 0.0 108.082 156.193 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 64.3 m -55.3 -27.1 44.55 Favored 'General case' 0 N--CA 1.472 0.66 0 N-CA-C 115.794 1.776 . . . . 0.0 115.794 -159.844 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 11.0 t -90.78 -23.34 20.67 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 123.929 0.891 . . . . 0.0 112.565 -176.84 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 32.3 m -107.11 -28.15 10.16 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 126.702 2.001 . . . . 0.0 112.224 -175.029 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 16.1 t -147.89 168.46 22.17 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 126.094 1.758 . . . . 0.0 110.36 172.222 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 34.6 pt -68.65 150.16 10.9 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.708 0 O-C-N 120.379 -1.451 . . . . 0.0 113.569 -170.582 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 14.8 p -147.31 163.06 37.61 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 124.783 1.233 . . . . 0.0 112.334 174.384 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 48.7 m -120.08 155.05 33.76 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 124.082 0.953 . . . . 0.0 113.089 -171.366 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 46.8 mt -60.99 -33.52 73.37 Favored 'General case' 0 N--CA 1.471 0.594 0 O-C-N 121.256 -0.903 . . . . 0.0 112.137 177.361 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 83.7 t80 -62.44 -27.0 68.81 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 124.09 0.956 . . . . 0.0 113.519 172.643 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 91.6 mt-30 -81.12 -40.61 23.78 Favored 'General case' 0 N--CA 1.467 0.396 0 C-N-CA 124.132 0.973 . . . . 0.0 110.395 172.517 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 41.8 mt -57.72 -33.32 68.3 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-N 118.921 0.782 . . . . 0.0 112.499 174.19 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 8.4 tm-20 -56.3 -34.7 66.74 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 125.086 1.354 . . . . 0.0 113.003 176.332 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 25.1 t30 -63.34 -34.27 77.33 Favored 'General case' 0 CA--C 1.543 0.711 0 O-C-N 121.203 -0.936 . . . . 0.0 112.256 175.443 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 74.5 m-85 -88.57 2.13 53.63 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 125.849 1.659 . . . . 0.0 113.762 -178.129 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 82.5 m -76.55 56.09 1.09 Allowed 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 126.146 1.778 . . . . 0.0 113.051 168.227 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 13.8 p30 . . . . . 0 C--O 1.253 1.253 0 C-N-CA 126.798 2.039 . . . . 0.0 113.037 -179.586 . . . . . . . . 0 0 . 1 . 038 nuclear orig full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 84.8 m-85 . . . . . 0 N--CA 1.489 1.49 0 CA-C-O 119.979 -0.058 . . . . 0.0 110.939 . . . . . . . . . 0 0 . 1 . 038 nuclear orig full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 73.8 t -78.39 135.85 25.2 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.884 0 C-N-CA 124.031 0.932 . . . . 0.0 109.547 175.982 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 24.8 t-20 -128.25 136.7 51.4 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 126.399 1.88 . . . . 0.0 110.74 179.302 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 48.5 mm-40 -156.32 167.41 30.53 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 124.771 1.228 . . . . 0.0 112.15 -167.554 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 16.8 m170 -84.78 138.43 32.6 Favored 'General case' 0 CA--C 1.542 0.636 0 N-CA-C 109.329 -0.619 . . . . 0.0 109.329 150.226 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 72.1 mt -146.41 136.44 23.5 Favored 'General case' 0 N--CA 1.465 0.314 0 C-N-CA 125.067 1.347 . . . . 0.0 109.455 -175.476 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 3.0 t -154.64 153.44 31.36 Favored 'General case' 0 N--CA 1.466 0.327 0 C-N-CA 123.502 0.721 . . . . 0.0 111.451 -176.117 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 47.76 -124.79 10.59 Favored Glycine 0 CA--C 1.529 0.928 0 C-N-CA 125.19 1.376 . . . . 0.0 113.772 176.82 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 24.3 p -60.35 -33.93 73.13 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 125.028 1.331 . . . . 0.0 113.197 179.301 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 98.2 m-70 -70.12 -39.27 75.56 Favored 'General case' 0 CA--C 1.542 0.646 0 O-C-N 121.204 -0.935 . . . . 0.0 111.583 177.025 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 63.5 tp -65.96 -45.14 82.83 Favored 'General case' 0 N--CA 1.471 0.604 0 O-C-N 121.616 -0.678 . . . . 0.0 110.869 172.735 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 24.7 t -59.59 -39.68 80.1 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.936 0 C-N-CA 124.187 0.995 . . . . 0.0 111.806 176.238 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -67.84 -46.61 71.31 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 123.879 0.872 . . . . 0.0 111.601 175.074 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.87 -46.2 90.04 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.158 0.583 . . . . 0.0 111.602 178.2 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 30.6 mt -54.74 -59.2 5.04 Favored 'General case' 0 N--CA 1.466 0.357 0 C-N-CA 124.099 0.96 . . . . 0.0 110.255 171.472 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 69.6 t80 -51.85 -38.71 57.01 Favored 'General case' 0 CA--C 1.543 0.707 0 CA-C-N 119.443 1.02 . . . . 0.0 113.234 -179.495 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 86.7 mt -72.71 -32.2 65.57 Favored 'General case' 0 N--CA 1.471 0.593 0 N-CA-C 113.914 1.079 . . . . 0.0 113.914 177.732 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 68.0 t -78.07 -38.06 23.61 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.01 0 C-N-CA 123.922 0.889 . . . . 0.0 111.316 174.384 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 44.1 m -89.48 -33.43 16.79 Favored 'General case' 0 N--CA 1.466 0.348 0 N-CA-C 114.28 1.215 . . . . 0.0 114.28 -170.633 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 60.79 -131.93 49.15 Favored Glycine 0 CA--C 1.533 1.192 0 N-CA-C 111.391 -0.684 . . . . 0.0 111.391 -172.18 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -72.46 -7.75 51.48 Favored 'General case' 0 CA--C 1.546 0.826 0 N-CA-C 114.364 1.246 . . . . 0.0 114.364 -179.311 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 68.8 mtp180 -62.95 -26.85 69.02 Favored 'General case' 0 N--CA 1.476 0.875 0 CA-C-N 119.336 0.971 . . . . 0.0 113.414 177.938 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 75.38 173.62 33.67 Favored Glycine 0 CA--C 1.531 1.075 0 C-N-CA 124.419 1.009 . . . . 0.0 112.192 -168.629 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 35.6 p90 -150.12 157.73 43.42 Favored 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 114.789 1.403 . . . . 0.0 114.789 -171.619 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 89.5 t80 -111.92 107.66 16.75 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 126.321 1.848 . . . . 0.0 109.617 171.306 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 27.9 p90 -106.37 -12.88 15.53 Favored 'General case' 0 CA--C 1.542 0.659 0 N-CA-C 115.709 1.744 . . . . 0.0 115.709 -171.219 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 41.2 p -69.59 154.3 94.93 Favored Pre-proline 0 N--CA 1.479 1.013 0 N-CA-C 114.439 1.274 . . . . 0.0 114.439 -152.838 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -76.94 -34.17 2.42 Favored 'Trans proline' 0 C--N 1.35 0.631 0 C-N-CA 123.214 2.609 . . . . 0.0 113.006 177.959 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 6.1 tttp -172.05 167.46 6.06 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 125.189 1.396 . . . . 0.0 112.714 -174.452 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 18.8 m . . . . . 0 C--O 1.251 1.164 0 C-N-CA 125.947 1.699 . . . . 0.0 112.604 179.493 . . . . . . . . 0 0 . 1 . 039 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.736 0 N-CA-C 111.218 -0.753 . . . . 0.0 111.218 . . . . . . . . . 0 0 . 1 . 039 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 10.2 tp -64.01 -33.77 64.32 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.0 0 N-CA-C 114.472 1.286 . . . . 0.0 114.472 -167.739 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 38.2 t -66.98 -37.01 78.54 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.113 0 CA-C-N 119.71 1.141 . . . . 0.0 111.535 176.878 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -71.45 -47.39 56.05 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-N 119.169 0.895 . . . . 0.0 110.491 173.906 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 65.3 tp60 -56.84 -46.24 81.84 Favored 'General case' 0 N--CA 1.467 0.393 0 C-N-CA 123.698 0.799 . . . . 0.0 111.963 179.347 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -82.85 -17.11 45.05 Favored 'General case' 0 N--CA 1.469 0.487 0 N-CA-C 114.477 1.288 . . . . 0.0 114.477 -175.056 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 29.3 t -102.89 -43.92 5.4 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 123.986 0.915 . . . . 0.0 112.807 -175.983 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 61.7 m -85.63 -37.17 19.79 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 125.476 1.511 . . . . 0.0 111.118 178.89 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 18.1 t -110.69 -149.55 0.45 Allowed 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 124.15 0.98 . . . . 0.0 109.366 160.944 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 11.9 tt -116.86 157.45 17.81 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.932 0 C-N-CA 126.099 1.759 . . . . 0.0 111.258 177.828 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 1.6 p -143.72 -171.75 3.59 Favored 'General case' 0 N--CA 1.476 0.865 0 O-C-N 121.237 -0.914 . . . . 0.0 111.719 167.663 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 59.5 p -131.72 168.93 16.93 Favored 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 124.478 1.111 . . . . 0.0 112.573 177.534 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 32.9 mt -61.41 -31.65 71.58 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 123.374 0.669 . . . . 0.0 112.103 174.164 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 87.0 t80 -65.1 -33.01 75.01 Favored 'General case' 0 CA--C 1.54 0.569 0 N-CA-C 112.946 0.721 . . . . 0.0 112.946 171.827 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 19.7 mm100 -75.83 -28.02 58.1 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-O 118.699 -0.667 . . . . 0.0 112.274 172.571 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 53.3 mt -68.9 -40.26 79.28 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-N 119.412 1.005 . . . . 0.0 111.639 168.579 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -58.49 -24.72 61.16 Favored 'General case' 0 CA--C 1.547 0.84 0 N-CA-C 113.428 0.899 . . . . 0.0 113.428 -177.414 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 25.0 t30 -54.83 -26.0 32.2 Favored 'General case' 0 CA--C 1.551 0.989 0 C-N-CA 124.567 1.147 . . . . 0.0 113.844 171.727 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 98.6 m-85 -101.83 4.31 40.2 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 126.051 1.74 . . . . 0.0 114.021 -175.468 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 61.2 m -63.56 150.89 42.95 Favored 'General case' 0 CA--C 1.543 0.674 0 O-C-N 121.352 -0.843 . . . . 0.0 111.59 166.384 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 22.5 t-20 . . . . . 0 C--O 1.253 1.267 0 C-N-CA 124.544 1.138 . . . . 0.0 113.008 -177.602 . . . . . . . . 0 0 . 1 . 039 nuclear orig full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 53.3 t80 . . . . . 0 N--CA 1.484 1.263 0 CA-C-O 119.591 -0.242 . . . . 0.0 110.676 . . . . . . . . . 0 0 . 1 . 039 nuclear orig full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 13.8 m -79.56 63.0 0.24 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.14 0 C-N-CA 125.8 1.64 . . . . 0.0 112.657 -176.108 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 11.5 m120 -93.54 138.23 32.03 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 126.156 1.782 . . . . 0.0 111.229 174.344 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 38.2 mt-30 -152.43 154.11 34.91 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 124.948 1.299 . . . . 0.0 110.332 -173.066 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 95.1 m-70 -87.89 123.37 32.57 Favored 'General case' 0 CA--C 1.54 0.57 0 N-CA-C 108.372 -0.973 . . . . 0.0 108.372 162.572 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 72.1 mt -140.75 142.57 34.75 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 125.541 1.536 . . . . 0.0 108.397 -171.621 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -149.15 150.91 33.45 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 123.486 0.715 . . . . 0.0 112.25 -173.609 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 43.95 -125.06 5.41 Favored Glycine 0 N--CA 1.473 1.129 0 C-N-CA 125.754 1.645 . . . . 0.0 114.316 172.427 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 20.1 m -62.13 -31.13 71.56 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 124.653 1.181 . . . . 0.0 112.803 -178.06 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 97.7 m-70 -72.38 -37.1 68.83 Favored 'General case' 0 CA--C 1.539 0.546 0 O-C-N 121.037 -1.039 . . . . 0.0 111.463 177.308 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 8.8 tt -66.27 -44.72 82.83 Favored 'General case' 0 C--N 1.344 0.346 0 O-C-N 121.719 -0.613 . . . . 0.0 110.974 169.941 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 53.9 t -61.75 -36.72 75.33 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.986 0 C-N-CA 123.212 0.605 . . . . 0.0 111.782 177.836 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -65.8 -48.47 71.62 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 123.905 0.882 . . . . 0.0 111.739 172.107 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.8 -44.07 94.15 Favored 'General case' 0 CA--C 1.543 0.678 0 O-C-N 121.633 -0.667 . . . . 0.0 111.704 176.77 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 52.3 tp -58.28 -50.94 71.83 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 125.885 1.674 . . . . 0.0 111.005 176.122 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 52.8 t80 -54.76 -42.21 71.4 Favored 'General case' 0 CA--C 1.541 0.634 0 N-CA-C 113.009 0.744 . . . . 0.0 113.009 173.434 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 89.5 mt -74.04 -33.36 63.7 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 123.925 0.89 . . . . 0.0 113.348 179.957 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 24.4 t -65.11 -47.18 88.74 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.819 0 C-N-CA 124.864 1.266 . . . . 0.0 110.361 171.457 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 84.7 m -75.74 -36.27 59.95 Favored 'General case' 0 N--CA 1.469 0.482 0 N-CA-C 112.753 0.649 . . . . 0.0 112.753 -176.436 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 62.81 -134.35 43.92 Favored Glycine 0 CA--C 1.529 0.927 0 C-N-CA 124.384 0.992 . . . . 0.0 111.412 -178.195 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -61.13 -18.4 57.86 Favored 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 114.681 1.363 . . . . 0.0 114.681 178.714 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 86.0 mtm180 -65.2 -30.45 71.35 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 124.117 0.967 . . . . 0.0 113.212 179.815 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 77.73 177.82 47.56 Favored Glycine 0 CA--C 1.533 1.212 0 C-N-CA 124.507 1.051 . . . . 0.0 112.888 -173.221 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 33.3 p90 -158.55 168.26 27.39 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 124.641 1.176 . . . . 0.0 112.64 -172.134 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 92.0 t80 -156.69 132.36 9.47 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 124.389 1.076 . . . . 0.0 111.83 164.085 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 84.4 t80 -161.53 147.84 14.15 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 126.378 1.871 . . . . 0.0 111.325 165.804 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 13.4 p -134.33 132.83 21.2 Favored Pre-proline 0 N--CA 1.474 0.739 0 C-N-CA 126.32 1.848 . . . . 0.0 109.778 173.692 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -72.63 121.34 7.32 Favored 'Trans proline' 0 C--N 1.352 0.725 0 C-N-CA 123.35 2.7 . . . . 0.0 111.565 -171.424 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 2.8 tppp? 70.6 -32.49 0.24 Allowed 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 128.23 2.612 . . . . 0.0 115.432 170.462 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 28.8 p . . . . . 0 C--O 1.254 1.303 0 C-N-CA 126.475 1.91 . . . . 0.0 113.931 -176.875 . . . . . . . . 0 0 . 1 . 040 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.612 0 N-CA-C 111.946 -0.462 . . . . 0.0 111.946 . . . . . . . . . 0 0 . 1 . 040 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 17.8 tt -98.24 -28.31 3.62 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.239 0 C-N-CA 124.298 1.039 . . . . 0.0 113.752 178.692 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 83.7 t -64.61 -34.67 71.31 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.211 0 CA-C-N 119.758 1.163 . . . . 0.0 110.412 -176.368 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 14.9 pt-20 -61.98 -36.29 81.04 Favored 'General case' 0 CA--C 1.543 0.695 0 CA-C-N 118.722 0.692 . . . . 0.0 112.296 172.566 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 28.5 tt0 -74.0 -43.92 56.37 Favored 'General case' 0 C--O 1.225 -0.223 0 C-N-CA 123.534 0.734 . . . . 0.0 110.365 -179.704 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 92.6 m -72.27 -36.3 68.97 Favored 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 113.746 1.017 . . . . 0.0 113.746 179.098 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 15.8 t -93.46 -45.61 7.69 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 123.601 0.76 . . . . 0.0 112.826 -168.447 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 25.1 m -91.47 -38.33 12.62 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 124.747 1.219 . . . . 0.0 111.488 -177.298 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.7 t -105.09 -152.32 0.46 Allowed 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 124.493 1.117 . . . . 0.0 111.393 171.221 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 24.1 mt -109.87 140.38 29.04 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.791 0 C-N-CA 126.002 1.721 . . . . 0.0 110.092 168.817 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 9.7 p -124.39 -172.9 2.65 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.74 1.216 . . . . 0.0 111.129 167.366 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 8.4 t -148.8 166.66 27.8 Favored 'General case' 0 N--CA 1.469 0.503 0 O-C-N 120.655 -1.278 . . . . 0.0 111.898 179.264 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 34.0 mt -59.86 -33.49 71.88 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 124.628 1.171 . . . . 0.0 112.143 -178.234 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 86.6 t80 -61.42 -29.91 70.23 Favored 'General case' 0 CA--C 1.546 0.792 0 N-CA-C 113.565 0.95 . . . . 0.0 113.565 171.908 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 54.0 mm-40 -80.16 -36.47 35.08 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 123.343 0.657 . . . . 0.0 110.522 174.503 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 32.5 mt -62.27 -37.86 87.09 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 118.523 0.601 . . . . 0.0 111.52 172.193 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -61.31 -32.1 71.96 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 124.878 1.271 . . . . 0.0 112.903 179.004 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 24.1 t30 -62.5 -24.24 67.37 Favored 'General case' 0 CA--C 1.548 0.901 0 O-C-N 121.405 -0.809 . . . . 0.0 112.794 176.424 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 38.8 m-85 -95.51 1.59 54.01 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 125.584 1.553 . . . . 0.0 114.475 179.785 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 70.2 m -69.27 153.99 42.75 Favored 'General case' 0 CA--C 1.544 0.74 0 O-C-N 121.002 -1.061 . . . . 0.0 113.234 173.294 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.253 1.241 0 C-N-CA 126.166 1.786 . . . . 0.0 111.302 178.626 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 17.2 p90 . . . . . 0 N--CA 1.486 1.332 0 N-CA-C 111.311 0.115 . . . . 0.0 111.311 . . . . . . . . . 0 0 . 1 . 040 nuclear orig full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 14.4 p -166.27 -177.65 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.483 1.195 0 C-N-CA 127.108 2.163 . . . . 0.0 109.092 -174.958 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 10.0 p30 -61.04 127.78 33.2 Favored 'General case' 0 CA--C 1.543 0.681 0 O-C-N 120.542 -1.349 . . . . 0.0 110.498 167.441 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 30.5 mt-30 -148.3 165.82 29.87 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 124.043 0.937 . . . . 0.0 112.374 -158.888 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 93.8 m-70 -82.37 134.36 35.25 Favored 'General case' 0 CA--C 1.545 0.752 0 N-CA-C 108.968 -0.753 . . . . 0.0 108.968 157.592 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 76.4 mt -147.54 133.92 19.63 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 125.735 1.614 . . . . 0.0 108.619 -177.649 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 3.7 t -158.42 153.17 24.84 Favored 'General case' 0 N--CA 1.469 0.492 0 O-C-N 121.428 -0.795 . . . . 0.0 112.225 -177.38 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 61.01 -134.4 49.11 Favored Glycine 0 CA--C 1.53 0.992 0 C-N-CA 124.719 1.152 . . . . 0.0 113.139 179.171 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 20.3 m -60.9 -30.92 70.46 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 124.467 1.107 . . . . 0.0 112.029 -178.43 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 13.5 m80 -66.52 -41.82 88.19 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 124.543 1.137 . . . . 0.0 111.541 178.046 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 48.8 tp -69.46 -42.7 74.54 Favored 'General case' 0 N--CA 1.466 0.336 0 C-N-CA 124.284 1.033 . . . . 0.0 111.359 174.585 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 48.1 t -60.32 -41.07 85.82 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.038 0 C-N-CA 123.635 0.774 . . . . 0.0 111.349 175.458 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -66.61 -45.17 80.01 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 124.065 0.946 . . . . 0.0 111.829 174.399 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.99 -45.68 91.92 Favored 'General case' 0 CA--C 1.54 0.582 0 O-C-N 121.656 -0.652 . . . . 0.0 112.129 178.096 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 17.6 mt -54.74 -54.19 45.22 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 124.493 1.117 . . . . 0.0 110.974 172.795 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 77.8 t80 -55.45 -41.66 73.19 Favored 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 113.196 0.813 . . . . 0.0 113.196 177.177 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 85.4 mt -73.22 -35.76 66.35 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 123.9 0.88 . . . . 0.0 113.127 179.839 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 43.6 t -67.89 -42.47 85.76 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.845 0 C-N-CA 123.525 0.73 . . . . 0.0 110.903 173.842 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 82.7 m -80.75 -27.28 36.85 Favored 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 113.483 0.92 . . . . 0.0 113.483 -175.658 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 65.65 -111.96 4.59 Favored Glycine 0 CA--C 1.53 0.996 0 C-N-CA 124.298 0.951 . . . . 0.0 111.908 173.565 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -75.47 -18.91 59.72 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 124.395 1.078 . . . . 0.0 113.074 176.131 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 95.6 mtt-85 -76.9 158.16 30.9 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 124.059 0.943 . . . . 0.0 111.678 173.16 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . -74.46 179.37 43.43 Favored Glycine 0 CA--C 1.531 1.058 0 C-N-CA 123.839 0.733 . . . . 0.0 111.668 168.768 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 42.1 p90 -153.73 169.54 23.07 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.542 1.137 . . . . 0.0 112.473 -178.247 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 63.6 t80 -153.85 149.49 27.41 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 124.828 1.251 . . . . 0.0 111.983 179.406 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 42.5 p90 -134.96 149.02 50.16 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 126.762 2.025 . . . . 0.0 111.288 175.854 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 7.3 t -159.0 138.25 8.27 Favored Pre-proline 0 N--CA 1.476 0.862 0 C-N-CA 124.785 1.234 . . . . 0.0 111.745 -178.033 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 16.9 Cg_endo -90.24 -160.23 0.09 OUTLIER 'Trans proline' 0 CA--C 1.541 0.866 0 C-N-CA 125.212 3.941 . . . . 0.0 112.067 -179.137 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 22.6 ptmt -78.69 -20.85 49.18 Favored 'General case' 0 CA--C 1.547 0.861 0 N-CA-C 114.77 1.396 . . . . 0.0 114.77 177.346 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 21.6 p . . . . . 0 N--CA 1.483 1.198 0 C-N-CA 125.684 1.593 . . . . 0.0 113.745 -175.304 . . . . . . . . 0 0 . 1 . 041 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.858 0 N-CA-C 111.987 -0.445 . . . . 0.0 111.987 . . . . . . . . . 0 0 . 1 . 041 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 38.8 pt -104.0 -22.19 4.93 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.378 0 C-N-CA 127.776 2.43 . . . . 0.0 113.827 -4.805 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 85.5 t -56.84 -48.12 81.79 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.048 0 CA-C-N 119.014 0.824 . . . . 0.0 112.048 -173.124 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -59.75 -35.45 74.61 Favored 'General case' 0 N--CA 1.474 0.755 0 CA-C-N 118.958 0.799 . . . . 0.0 112.573 -178.546 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 28.7 tp60 -71.44 -32.8 68.76 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-O 118.663 -0.684 . . . . 0.0 112.02 -178.536 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -95.23 -22.0 18.1 Favored 'General case' 0 CA--C 1.539 0.557 0 N-CA-C 114.161 1.171 . . . . 0.0 114.161 177.172 . . . . . . . . 2 2 . 1 . 041 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 51.1 t -100.52 -56.08 2.43 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 124.764 1.226 . . . . 0.0 112.983 -172.976 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 26.8 m -81.06 -47.35 13.68 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 124.635 1.174 . . . . 0.0 109.894 -178.245 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 13.7 t -84.83 -158.35 0.35 Allowed 'General case' 0 CA--C 1.552 1.035 0 C-N-CA 123.045 0.538 . . . . 0.0 110.283 155.791 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 29.8 pt -128.82 150.4 34.44 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.552 0 C-N-CA 125.181 1.392 . . . . 0.0 111.974 178.842 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -145.12 166.56 25.04 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 123.962 0.905 . . . . 0.0 112.099 170.546 . . . . . . . . 2 2 . 1 . 041 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 3.4 t -118.52 167.11 11.92 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 124.064 0.946 . . . . 0.0 112.703 -173.943 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 47.7 mt -58.02 -35.65 71.58 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 124.713 1.205 . . . . 0.0 111.946 179.959 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 75.2 m-85 -62.06 -30.78 71.22 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 124.463 1.105 . . . . 0.0 113.543 173.287 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 17.6 mm100 -82.96 -33.68 26.63 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 124.328 1.051 . . . . 0.0 110.951 174.57 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 48.4 mt -62.51 -36.33 82.22 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 119.238 0.927 . . . . 0.0 111.418 170.988 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 25.5 tt0 -63.17 -27.75 69.58 Favored 'General case' 0 CA--C 1.544 0.726 0 N-CA-C 113.331 0.863 . . . . 0.0 113.331 178.894 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 30.8 t30 -59.59 -25.65 64.78 Favored 'General case' 0 CA--C 1.547 0.856 0 O-C-N 121.264 -0.897 . . . . 0.0 113.181 174.423 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 59.3 m-85 -94.55 -0.31 54.66 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 125.282 1.433 . . . . 0.0 114.117 -178.728 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 81.2 m -67.18 154.04 42.21 Favored 'General case' 0 CA--C 1.544 0.747 0 CA-C-N 119.076 0.853 . . . . 0.0 113.183 175.338 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.252 1.214 0 C-N-CA 126.619 1.967 . . . . 0.0 110.977 179.804 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 67.7 m-85 . . . . . 0 N--CA 1.488 1.426 0 N-CA-C 111.221 0.082 . . . . 0.0 111.221 . . . . . . . . . 0 0 . 1 . 041 nuclear orig full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 9.3 m -141.7 151.39 19.11 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.091 0 C-N-CA 125.4 1.48 . . . . 0.0 110.916 177.424 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 40.8 m-80 77.25 135.59 0.06 Allowed 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 129.269 3.028 . . . . 0.0 113.638 -178.427 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 53.8 mm-40 -140.55 166.55 24.43 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 125.804 1.642 . . . . 0.0 110.442 -179.096 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 92.2 m-70 -84.96 116.7 23.52 Favored 'General case' 0 CA--C 1.541 0.628 0 N-CA-C 108.655 -0.869 . . . . 0.0 108.655 164.219 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 91.8 mt -132.35 126.33 33.0 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 125.743 1.617 . . . . 0.0 108.507 179.169 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 77.7 m -132.2 144.21 50.49 Favored 'General case' 0 N--CA 1.465 0.29 0 C-N-CA 124.839 1.255 . . . . 0.0 111.76 -168.01 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 53.04 -124.7 28.71 Favored Glycine 0 CA--C 1.531 1.081 0 C-N-CA 125.307 1.432 . . . . 0.0 114.271 164.647 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 22.2 p -56.85 -41.39 77.84 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 124.726 1.21 . . . . 0.0 112.238 176.968 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 19.3 m-70 -69.57 -29.89 67.54 Favored 'General case' 0 CA--C 1.541 0.628 0 O-C-N 120.613 -1.305 . . . . 0.0 112.712 177.946 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 48.0 tp -69.06 -43.06 75.4 Favored 'General case' 0 N--CA 1.47 0.564 0 O-C-N 121.544 -0.723 . . . . 0.0 111.275 169.559 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 52.1 t -60.57 -41.33 87.5 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.99 0 C-N-CA 123.927 0.891 . . . . 0.0 111.67 173.535 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -63.7 -46.5 85.17 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 124.372 1.069 . . . . 0.0 111.527 173.58 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.12 -45.06 96.22 Favored 'General case' 0 CA--C 1.544 0.734 0 CA-C-N 118.761 0.71 . . . . 0.0 111.923 178.872 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 22.2 mt -55.33 -54.36 44.54 Favored 'General case' 0 N--CA 1.467 0.416 0 C-N-CA 124.186 0.995 . . . . 0.0 111.056 173.018 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 71.1 t80 -55.61 -42.28 74.66 Favored 'General case' 0 N--CA 1.47 0.544 0 N-CA-C 113.007 0.743 . . . . 0.0 113.007 177.48 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 84.9 mt -74.88 -33.38 62.06 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 124.127 0.971 . . . . 0.0 113.341 -178.6 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 37.7 t -69.26 -44.02 80.86 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.849 0 C-N-CA 123.974 0.909 . . . . 0.0 110.684 172.498 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 72.9 m -76.79 -33.51 58.03 Favored 'General case' 0 CA--C 1.538 0.508 0 N-CA-C 113.074 0.768 . . . . 0.0 113.074 -175.936 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 68.89 -111.68 4.1 Favored Glycine 0 CA--C 1.529 0.91 0 C-N-CA 124.662 1.125 . . . . 0.0 112.044 172.166 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -69.12 -27.14 65.3 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 124.171 0.988 . . . . 0.0 112.131 173.975 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 82.8 mtm180 -72.91 153.99 40.76 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 124.803 1.241 . . . . 0.0 110.758 175.988 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . -76.22 -174.83 38.54 Favored Glycine 0 N--CA 1.474 1.175 0 C-N-CA 123.915 0.769 . . . . 0.0 111.581 168.423 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 52.5 p90 -152.46 148.09 27.01 Favored 'General case' 0 CA--C 1.536 0.442 0 N-CA-C 113.287 0.847 . . . . 0.0 113.287 179.234 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 90.7 t80 -89.89 146.32 24.5 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 125.787 1.635 . . . . 0.0 110.671 169.664 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 85.2 t80 -158.94 140.68 13.48 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 125.59 1.556 . . . . 0.0 111.527 179.69 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 11.8 t -167.78 139.33 2.45 Favored Pre-proline 0 N--CA 1.477 0.889 0 C-N-CA 125.375 1.47 . . . . 0.0 111.646 176.131 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 69.6 Cg_endo -80.67 172.44 13.34 Favored 'Trans proline' 0 C--N 1.352 0.716 0 C-N-CA 123.879 3.053 . . . . 0.0 111.531 172.411 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 22.4 ptmt -61.61 150.0 37.6 Favored 'General case' 0 CA--C 1.549 0.936 0 N-CA-C 113.146 0.795 . . . . 0.0 113.146 173.7 . . . . . . . . 1 1 . 1 . 041 nuclear orig full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 12.8 t . . . . . 0 C--O 1.253 1.278 0 C-N-CA 126.652 1.981 . . . . 0.0 111.783 -175.79 . . . . . . . . 0 0 . 1 . 042 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.503 0 N-CA-C 111.184 -0.766 . . . . 0.0 111.184 . . . . . . . . . 0 0 . 1 . 042 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 46.2 pt -76.9 -23.26 14.96 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.916 0 N-CA-C 114.68 1.363 . . . . 0.0 114.68 -167.208 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 53.0 t -59.32 -37.85 71.49 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.121 0 CA-C-N 119.816 1.189 . . . . 0.0 111.6 178.699 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 44.2 mm-40 -79.14 -56.73 4.15 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-O 118.969 -0.539 . . . . 0.0 110.518 168.609 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 23.8 tt0 -61.58 -40.91 96.44 Favored 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 113.865 1.061 . . . . 0.0 113.865 -166.692 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 25.7 m -69.49 -21.69 63.67 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 119.204 0.911 . . . . 0.0 112.766 175.948 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 13.2 t -88.12 -41.52 12.98 Favored 'General case' 0 CA--C 1.538 0.513 0 O-C-N 121.393 -0.817 . . . . 0.0 111.617 179.814 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 72.7 p -82.29 -18.17 43.27 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 125.243 1.417 . . . . 0.0 114.034 179.668 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 71.3 p -148.36 172.42 14.44 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 124.919 1.288 . . . . 0.0 111.905 -179.485 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 64.9 mt -73.9 129.03 36.59 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.679 0 O-C-N 121.238 -0.914 . . . . 0.0 109.774 174.549 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 17.3 p -123.49 159.77 28.36 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 124.866 1.267 . . . . 0.0 111.727 169.629 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 18.8 m -108.97 153.52 23.46 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 124.3 1.04 . . . . 0.0 111.276 -171.667 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 36.6 mt -60.69 -31.15 70.41 Favored 'General case' 0 N--CA 1.472 0.629 0 O-C-N 120.907 -1.121 . . . . 0.0 112.357 179.678 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 86.9 m-85 -64.59 -25.89 68.17 Favored 'General case' 0 CA--C 1.543 0.711 0 N-CA-C 114.096 1.147 . . . . 0.0 114.096 171.684 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 57.5 mm-40 -88.41 -25.93 22.42 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 124.752 1.221 . . . . 0.0 111.38 175.136 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 9.2 mp -62.42 -49.27 76.15 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 119.467 1.03 . . . . 0.0 110.588 162.993 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 37.5 tt0 -59.55 -28.45 67.12 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 124.679 1.191 . . . . 0.0 113.411 -179.874 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 26.2 t30 -54.33 -30.99 53.22 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 124.582 1.153 . . . . 0.0 113.889 179.321 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 99.4 m-85 -95.95 0.44 51.85 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 124.989 1.316 . . . . 0.0 113.865 -177.88 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 83.0 m -86.36 162.09 18.36 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 124.594 1.158 . . . . 0.0 113.655 174.959 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.251 1.155 0 C-N-CA 126.2 1.8 . . . . 0.0 112.308 -179.055 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 86.6 t80 . . . . . 0 N--CA 1.487 1.382 0 CA-C-O 119.465 -0.302 . . . . 0.0 110.667 . . . . . . . . . 0 0 . 1 . 042 nuclear orig full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 75.7 t -144.47 136.92 22.38 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.024 0 C-N-CA 125.626 1.57 . . . . 0.0 109.461 -179.367 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 51.7 p-10 -148.65 143.31 26.43 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 125.79 1.636 . . . . 0.0 111.328 171.434 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 42.5 mt-30 -152.3 164.93 36.44 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 124.46 1.104 . . . . 0.0 111.937 -162.946 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 21.9 m-70 -84.79 135.25 34.19 Favored 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 108.758 -0.831 . . . . 0.0 108.758 153.607 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 81.5 mt -145.09 125.16 13.61 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 126.302 1.841 . . . . 0.0 109.465 -177.671 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 58.1 m -124.74 138.1 54.3 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 125.097 1.359 . . . . 0.0 110.489 -178.141 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 51.05 -117.25 5.27 Favored Glycine 0 N--CA 1.474 1.173 0 C-N-CA 125.091 1.329 . . . . 0.0 113.947 167.352 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 19.9 m -59.84 -32.94 71.14 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 124.495 1.118 . . . . 0.0 112.786 -178.066 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 96.2 m-70 -71.25 -38.66 71.9 Favored 'General case' 0 CA--C 1.539 0.535 0 O-C-N 121.253 -0.904 . . . . 0.0 111.42 176.418 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 56.5 tp -66.68 -42.95 85.7 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 123.508 0.723 . . . . 0.0 111.241 172.913 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 42.5 t -60.61 -43.26 94.32 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.916 0 C-N-CA 124.018 0.927 . . . . 0.0 111.699 175.061 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -64.28 -45.39 88.23 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 123.74 0.816 . . . . 0.0 111.425 175.5 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.46 -46.18 91.15 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 123.068 0.547 . . . . 0.0 112.034 177.309 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 28.7 mt -56.66 -48.38 77.7 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 124.091 0.956 . . . . 0.0 111.444 175.559 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 61.9 t80 -56.84 -41.13 77.33 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 123.773 0.829 . . . . 0.0 113.095 174.774 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 90.8 mt -78.02 -35.03 50.32 Favored 'General case' 0 N--CA 1.47 0.554 0 N-CA-C 113.426 0.898 . . . . 0.0 113.426 -179.455 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 40.8 t -67.23 -44.89 87.31 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 C-N-CA 124.645 1.178 . . . . 0.0 110.415 175.94 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 74.3 m -95.34 -25.84 16.14 Favored 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 113.628 0.973 . . . . 0.0 113.628 -170.758 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 63.08 -109.37 2.67 Favored Glycine 0 CA--C 1.531 1.052 0 C-N-CA 124.361 0.982 . . . . 0.0 112.72 168.509 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 39.1 mm-40 -69.8 -24.93 63.56 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 124.418 1.087 . . . . 0.0 112.86 175.818 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 96.0 mtt-85 -77.48 141.31 39.75 Favored 'General case' 0 N--CA 1.467 0.382 0 C-N-CA 124.046 0.938 . . . . 0.0 110.617 172.768 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . -74.0 152.48 45.58 Favored Glycine 0 N--CA 1.469 0.843 0 C-N-CA 124.652 1.12 . . . . 0.0 111.6 175.192 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 45.3 p90 -131.02 166.2 21.53 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 124.867 1.267 . . . . 0.0 112.508 -173.967 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 50.3 t80 -151.55 142.03 22.56 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 124.215 1.006 . . . . 0.0 111.557 170.441 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 8.5 p90 -104.31 98.12 7.97 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 126.869 2.068 . . . . 0.0 109.966 179.443 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 30.6 p -68.47 137.8 91.13 Favored Pre-proline 0 N--CA 1.478 0.932 0 CA-C-O 118.23 -0.89 . . . . 0.0 111.166 -176.976 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_endo -78.62 -152.76 0.04 OUTLIER 'Trans proline' 0 CA--C 1.544 0.979 0 C-N-CA 124.749 3.632 . . . . 0.0 111.878 -169.422 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -56.04 -38.56 70.73 Favored 'General case' 0 CA--C 1.547 0.843 0 O-C-N 120.548 -1.345 . . . . 0.0 112.036 173.586 . . . . . . . . 1 1 . 1 . 042 nuclear orig full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 23.7 m . . . . . 0 C--O 1.251 1.142 0 C-N-CA 125.738 1.615 . . . . 0.0 111.357 171.09 . . . . . . . . 0 0 . 1 . 043 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.497 0 N-CA-C 110.854 -0.899 . . . . 0.0 110.854 . . . . . . . . . 0 0 . 1 . 043 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 20.7 pt -59.5 -31.59 47.04 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.277 0 N-CA-C 115.584 1.698 . . . . 0.0 115.584 -163.866 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 93.4 t -67.77 -28.68 42.48 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.217 0 CA-C-N 119.408 1.004 . . . . 0.0 111.996 -179.242 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 33.4 mm-40 -89.38 -54.74 3.95 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 123.149 0.579 . . . . 0.0 110.093 169.034 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 64.4 tt0 -62.75 -44.19 96.83 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 124.77 1.228 . . . . 0.0 112.865 -168.511 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 2.7 t -81.16 -12.43 59.21 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-N 118.847 0.749 . . . . 0.0 112.777 -179.658 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 13.6 t -89.12 -40.04 13.2 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 124.227 1.011 . . . . 0.0 111.684 178.034 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 2.4 t -89.98 -36.15 15.13 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 124.813 1.245 . . . . 0.0 112.804 178.001 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 14.3 t -120.56 -149.95 0.44 Allowed 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 126.034 1.733 . . . . 0.0 109.42 172.349 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 47.7 pt -113.09 159.84 12.89 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.704 0 C-N-CA 125.099 1.36 . . . . 0.0 112.338 179.924 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 17.0 p -142.03 163.02 34.02 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 124.758 1.223 . . . . 0.0 112.166 167.194 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 13.8 m -104.93 152.48 22.61 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 125.056 1.342 . . . . 0.0 111.363 -176.052 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 33.9 mt -60.21 -34.4 73.59 Favored 'General case' 0 N--CA 1.47 0.526 0 O-C-N 120.999 -1.063 . . . . 0.0 111.549 176.42 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 85.4 t80 -60.06 -32.55 71.04 Favored 'General case' 0 CA--C 1.547 0.834 0 N-CA-C 113.213 0.82 . . . . 0.0 113.213 172.658 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 84.4 mt-30 -77.17 -36.75 54.85 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 123.773 0.829 . . . . 0.0 110.767 175.762 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 57.3 mt -60.93 -40.74 94.39 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-N 118.538 0.608 . . . . 0.0 111.729 170.416 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -62.31 -39.15 92.07 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 124.534 1.134 . . . . 0.0 112.03 175.076 . . . . . . . . 2 2 . 1 . 043 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 31.3 t30 -63.41 -26.22 68.64 Favored 'General case' 0 CA--C 1.549 0.918 0 N-CA-C 113.363 0.875 . . . . 0.0 113.363 178.091 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 7.7 m-85 -77.5 -12.39 59.96 Favored 'General case' 0 CA--C 1.545 0.775 0 N-CA-C 114.247 1.203 . . . . 0.0 114.247 173.629 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 74.0 m -90.67 158.93 16.66 Favored 'General case' 0 CA--C 1.544 0.746 0 N-CA-C 114.181 1.178 . . . . 0.0 114.181 -178.102 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 23.5 t-20 . . . . . 0 C--O 1.253 1.253 0 C-N-CA 126.795 2.038 . . . . 0.0 112.364 -174.924 . . . . . . . . 0 0 . 1 . 043 nuclear orig full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 69.9 t80 . . . . . 0 N--CA 1.483 1.182 0 CA-C-O 119.486 -0.292 . . . . 0.0 110.916 . . . . . . . . . 0 0 . 1 . 043 nuclear orig full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 10.0 p -165.68 151.22 2.01 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.118 0 C-N-CA 125.443 1.497 . . . . 0.0 111.178 178.706 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -133.01 145.04 50.49 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 125.934 1.694 . . . . 0.0 111.768 173.469 . . . . . . . . 2 2 . 1 . 043 nuclear orig full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 42.4 mt-30 -146.9 165.63 29.18 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 124.301 1.04 . . . . 0.0 111.668 -166.89 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 96.6 m-70 -84.2 134.09 34.57 Favored 'General case' 0 CA--C 1.541 0.61 0 N-CA-C 108.948 -0.76 . . . . 0.0 108.948 156.882 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 92.0 mt -150.31 136.69 18.84 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 125.39 1.476 . . . . 0.0 108.995 -175.715 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 3.7 t -155.53 151.86 28.16 Favored 'General case' 0 N--CA 1.467 0.377 0 C-N-CA 123.294 0.638 . . . . 0.0 112.05 -177.241 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 54.62 -127.95 41.33 Favored Glycine 0 CA--C 1.531 1.06 0 C-N-CA 124.868 1.223 . . . . 0.0 113.338 178.851 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 24.8 m -62.58 -29.67 70.76 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 124.434 1.093 . . . . 0.0 111.988 -178.247 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 16.7 m80 -70.53 -39.39 74.08 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 124.065 0.946 . . . . 0.0 111.247 179.485 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 59.6 tp -67.9 -43.47 79.22 Favored 'General case' 0 N--CA 1.467 0.393 0 C-N-CA 123.998 0.919 . . . . 0.0 111.153 172.866 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 44.8 t -62.4 -39.17 83.3 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.941 0 C-N-CA 123.59 0.756 . . . . 0.0 111.812 176.028 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -66.3 -45.99 78.51 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 124.185 0.994 . . . . 0.0 111.541 173.985 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.0 -48.87 80.04 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 122.917 0.487 . . . . 0.0 111.766 177.109 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 23.4 mt -51.39 -53.27 38.21 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 124.882 1.273 . . . . 0.0 111.627 173.058 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 69.6 t80 -58.12 -42.88 86.72 Favored 'General case' 0 CA--C 1.54 0.592 0 N-CA-C 113.359 0.874 . . . . 0.0 113.359 177.846 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 89.5 mt -75.58 -32.07 60.22 Favored 'General case' 0 N--CA 1.47 0.55 0 N-CA-C 113.119 0.785 . . . . 0.0 113.119 -178.276 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 25.3 t -69.25 -44.42 80.6 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.746 0 C-N-CA 124.526 1.13 . . . . 0.0 110.795 174.175 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 80.9 m -94.74 -24.62 17.03 Favored 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 114.333 1.234 . . . . 0.0 114.333 -169.409 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 61.5 -109.11 2.28 Favored Glycine 0 CA--C 1.53 0.995 0 C-N-CA 124.327 0.965 . . . . 0.0 112.433 174.971 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -73.59 -24.19 60.03 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 124.079 0.951 . . . . 0.0 113.099 177.892 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 38.5 mtp85 -73.05 139.33 46.48 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 123.703 0.801 . . . . 0.0 110.496 172.895 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . -84.23 128.53 8.67 Favored Glycine 0 N--CA 1.467 0.743 0 C-N-CA 124.908 1.242 . . . . 0.0 111.269 -174.393 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 53.1 p90 -90.97 166.05 13.23 Favored 'General case' 0 CA--C 1.536 0.416 0 N-CA-C 113.446 0.906 . . . . 0.0 113.446 -177.73 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 70.9 t80 -148.74 109.91 4.36 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 124.987 1.315 . . . . 0.0 110.219 174.59 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 54.9 p90 -86.03 146.31 26.7 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 124.501 1.12 . . . . 0.0 111.118 171.207 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 7.3 t -163.44 146.23 8.01 Favored Pre-proline 0 N--CA 1.474 0.761 0 C-N-CA 125.002 1.321 . . . . 0.0 111.69 -178.398 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 87.9 Cg_endo -78.14 -17.47 13.39 Favored 'Trans proline' 0 C--N 1.349 0.599 0 C-N-CA 123.513 2.809 . . . . 0.0 112.758 170.68 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 85.7 tttt -114.67 141.98 47.08 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 124.675 1.19 . . . . 0.0 112.488 -164.319 . . . . . . . . 1 1 . 1 . 043 nuclear orig full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 24.4 m . . . . . 0 C--O 1.251 1.174 0 C-N-CA 125.318 1.447 . . . . 0.0 111.647 -176.898 . . . . . . . . 0 0 . 1 . 044 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.72 0 N-CA-C 111.293 -0.723 . . . . 0.0 111.293 . . . . . . . . . 0 0 . 1 . 044 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -55.97 -48.3 78.85 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.334 0 C-N-CA 124.419 1.088 . . . . 0.0 113.537 -171.056 . . . . . . . . 2 2 . 1 . 044 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 93.1 t -64.05 -45.47 96.55 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.852 0 CA-C-N 118.643 0.656 . . . . 0.0 110.834 -175.853 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -64.36 -43.35 94.82 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-O 119.078 -0.487 . . . . 0.0 111.345 177.902 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 42.9 tt0 -61.35 -52.61 63.92 Favored 'General case' 0 CA--C 1.533 0.302 0 CA-C-N 118.633 0.651 . . . . 0.0 111.076 176.56 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 59.7 m -60.08 -32.76 71.26 Favored 'General case' 0 N--CA 1.467 0.38 0 N-CA-C 112.906 0.706 . . . . 0.0 112.906 -176.383 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 68.8 m -76.42 -57.39 3.89 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 123.78 0.832 . . . . 0.0 111.871 176.517 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 69.7 p -81.62 -20.61 39.36 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 124.641 1.176 . . . . 0.0 113.91 -169.168 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 10.5 t -140.86 -162.58 1.38 Allowed 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 126.73 2.012 . . . . 0.0 109.575 177.891 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 38.6 pt -93.88 147.06 5.82 Favored 'Isoleucine or valine' 0 C--O 1.236 0.362 0 O-C-N 120.932 -1.105 . . . . 0.0 112.034 176.492 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 17.2 p -137.87 165.11 27.3 Favored 'General case' 0 N--CA 1.466 0.355 0 C-N-CA 125.06 1.344 . . . . 0.0 110.231 166.747 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 13.5 t -115.96 161.67 18.5 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-O 121.604 0.716 . . . . 0.0 112.419 -179.076 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 53.0 mt -58.89 -33.39 70.45 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 125.009 1.324 . . . . 0.0 111.558 174.772 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 29.0 m-85 -58.79 -33.79 70.75 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 123.788 0.835 . . . . 0.0 113.223 171.304 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 63.4 mm-40 -83.18 -29.37 28.64 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 124.226 1.01 . . . . 0.0 111.327 177.869 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 41.1 mt -64.65 -39.96 94.6 Favored 'General case' 0 N--CA 1.471 0.608 0 CA-C-N 119.148 0.886 . . . . 0.0 111.046 168.593 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 26.9 tt0 -60.84 -27.16 67.87 Favored 'General case' 0 CA--C 1.545 0.751 0 N-CA-C 113.586 0.958 . . . . 0.0 113.586 -179.561 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 21.8 t30 -58.8 -26.29 63.95 Favored 'General case' 0 CA--C 1.548 0.882 0 O-C-N 121.062 -1.024 . . . . 0.0 113.1 173.656 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 89.7 m-85 -100.8 5.95 43.66 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 125.597 1.559 . . . . 0.0 113.967 -178.046 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 63.8 m -65.24 149.57 49.71 Favored 'General case' 0 CA--C 1.542 0.66 0 O-C-N 120.999 -1.063 . . . . 0.0 111.995 166.081 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 5.9 t30 . . . . . 0 C--O 1.252 1.192 0 C-N-CA 125.709 1.604 . . . . 0.0 112.287 176.551 . . . . . . . . 0 0 . 1 . 044 nuclear orig full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 67.0 m-85 . . . . . 0 N--CA 1.487 1.386 0 CA-C-O 119.327 -0.368 . . . . 0.0 110.32 . . . . . . . . . 0 0 . 1 . 044 nuclear orig full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 17.3 m -149.01 156.32 7.77 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.206 0 C-N-CA 125.143 1.377 . . . . 0.0 112.293 -173.528 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 8.7 m120 -88.2 143.82 26.82 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 125.245 1.418 . . . . 0.0 111.696 169.082 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 42.7 mt-30 -150.93 161.12 43.32 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 125.45 1.5 . . . . 0.0 111.031 -178.493 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 37.1 m-70 -80.51 136.54 36.31 Favored 'General case' 0 CA--C 1.544 0.74 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 152.122 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 90.1 mt -150.07 127.17 11.24 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 125.86 1.664 . . . . 0.0 107.727 -172.917 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 4.2 t -152.19 156.64 40.17 Favored 'General case' 0 CA--C 1.535 0.404 0 O-C-N 121.44 -0.787 . . . . 0.0 112.586 -172.375 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 61.47 -138.6 47.11 Favored Glycine 0 CA--C 1.528 0.888 0 C-N-CA 125.002 1.287 . . . . 0.0 112.941 177.386 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 23.8 p -57.01 -39.2 74.28 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 123.915 0.886 . . . . 0.0 112.516 174.996 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 17.2 m-70 -65.12 -29.17 70.01 Favored 'General case' 0 CA--C 1.545 0.763 0 O-C-N 121.131 -0.981 . . . . 0.0 113.364 -179.4 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 55.9 tp -69.49 -41.76 75.69 Favored 'General case' 0 N--CA 1.469 0.476 0 O-C-N 121.476 -0.765 . . . . 0.0 111.527 170.115 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 94.6 t -64.25 -38.7 83.19 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.901 0 C-N-CA 123.098 0.559 . . . . 0.0 110.942 175.976 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 49.7 mt-10 -64.02 -48.08 77.72 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 124.485 1.114 . . . . 0.0 111.421 173.02 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.29 -45.51 93.11 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-N 119.158 0.89 . . . . 0.0 111.752 178.233 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 53.2 tp -57.45 -51.87 67.68 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 124.403 1.081 . . . . 0.0 110.933 175.077 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 54.8 t80 -56.67 -40.59 75.81 Favored 'General case' 0 CA--C 1.539 0.548 0 N-CA-C 113.42 0.896 . . . . 0.0 113.42 175.283 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 76.7 mt -73.04 -32.2 64.92 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 124.088 0.955 . . . . 0.0 112.934 179.641 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 37.1 t -68.41 -45.88 81.51 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.752 0 C-N-CA 123.739 0.816 . . . . 0.0 110.739 171.039 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 85.0 m -75.94 -36.07 59.49 Favored 'General case' 0 CA--C 1.535 0.398 0 N-CA-C 113.389 0.885 . . . . 0.0 113.389 -175.575 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 63.64 -134.56 41.39 Favored Glycine 0 CA--C 1.531 1.069 0 C-N-CA 124.433 1.016 . . . . 0.0 111.632 -176.136 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -62.94 -17.59 62.09 Favored 'General case' 0 CA--C 1.543 0.703 0 N-CA-C 114.741 1.385 . . . . 0.0 114.741 179.06 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 84.0 mtm180 -62.96 -32.0 73.23 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 124.418 1.087 . . . . 0.0 113.344 -179.152 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 80.32 -178.9 53.68 Favored Glycine 0 CA--C 1.532 1.148 0 C-N-CA 124.707 1.146 . . . . 0.0 112.431 -171.358 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 51.7 p90 -156.04 164.77 38.02 Favored 'General case' 0 N--CA 1.469 0.493 0 N-CA-C 113.531 0.937 . . . . 0.0 113.531 -172.506 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 40.1 t80 -127.76 99.89 5.73 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 126.139 1.776 . . . . 0.0 109.502 174.5 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 84.6 t80 -82.02 129.39 34.78 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 124.986 1.314 . . . . 0.0 111.662 -178.737 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 38.9 p -127.93 80.98 71.23 Favored Pre-proline 0 N--CA 1.482 1.165 0 C-N-CA 124.737 1.215 . . . . 0.0 112.487 -170.538 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 63.0 Cg_endo -81.0 164.43 19.97 Favored 'Trans proline' 0 CA--C 1.539 0.727 0 C-N-CA 123.935 3.09 . . . . 0.0 111.013 171.585 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 89.1 mttt -75.53 151.13 38.0 Favored 'General case' 0 CA--C 1.547 0.846 0 N-CA-C 112.579 0.585 . . . . 0.0 112.579 168.341 . . . . . . . . 1 1 . 1 . 044 nuclear orig full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 24.9 m . . . . . 0 N--CA 1.488 1.431 0 C-N-CA 128.684 2.794 . . . . 0.0 112.043 175.246 . . . . . . . . 0 0 . 1 . 045 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.186 0 N-CA-C 112.288 -0.325 . . . . 0.0 112.288 . . . . . . . . . 0 0 . 1 . 045 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 35.0 pt -107.9 -39.38 4.36 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.139 0 C-N-CA 127.289 2.236 . . . . 0.0 113.478 -2.286 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 73.0 t -63.07 -36.94 77.96 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.126 0 CA-C-N 119.96 1.254 . . . . 0.0 112.036 -166.711 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -84.76 -6.05 59.34 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 125.286 1.434 . . . . 0.0 113.907 179.535 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 64.1 tt0 -106.38 -57.24 2.08 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 124.904 1.282 . . . . 0.0 110.099 -178.891 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 89.7 m -66.22 -28.23 68.59 Favored 'General case' 0 N--CA 1.465 0.322 0 C-N-CA 124.881 1.273 . . . . 0.0 113.931 -178.276 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 8.4 t -80.48 -42.91 21.72 Favored 'General case' 0 CA--C 1.541 0.622 0 O-C-N 121.636 -0.665 . . . . 0.0 110.733 178.526 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 20.1 m -77.02 -33.45 57.46 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 127.386 2.274 . . . . 0.0 112.924 -173.763 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.5 t -146.07 -173.62 4.21 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 124.879 1.272 . . . . 0.0 111.142 -179.305 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 65.0 mt -74.28 134.22 29.98 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.58 0 O-C-N 120.613 -1.304 . . . . 0.0 110.256 175.192 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 8.3 p -128.6 173.1 10.57 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 124.86 1.264 . . . . 0.0 111.142 166.103 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 5.7 m -123.58 149.24 45.54 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 123.728 0.811 . . . . 0.0 110.917 -169.938 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 39.8 mt -59.49 -33.07 70.88 Favored 'General case' 0 N--CA 1.471 0.617 0 O-C-N 120.89 -1.131 . . . . 0.0 111.856 173.345 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 79.9 t80 -60.11 -28.24 67.69 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 124.366 1.066 . . . . 0.0 113.612 171.729 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 58.4 mm-40 -84.32 -36.26 22.7 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 124.131 0.973 . . . . 0.0 110.644 174.402 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 49.7 mt -60.33 -30.93 69.83 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-N 119.723 1.147 . . . . 0.0 112.278 172.13 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -59.26 -27.39 65.76 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 124.376 1.07 . . . . 0.0 113.512 176.18 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 33.3 t30 -65.74 -24.24 66.92 Favored 'General case' 0 CA--C 1.55 0.945 0 O-C-N 121.1 -1.0 . . . . 0.0 113.057 174.129 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 87.6 m-85 -99.7 5.01 45.8 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 126.081 1.752 . . . . 0.0 113.368 -176.154 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 56.5 m -63.96 154.12 35.0 Favored 'General case' 0 CA--C 1.544 0.712 0 O-C-N 121.408 -0.807 . . . . 0.0 112.025 163.575 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 21.7 t30 . . . . . 0 C--O 1.252 1.193 0 C-N-CA 126.478 1.911 . . . . 0.0 112.151 176.076 . . . . . . . . 0 0 . 1 . 045 nuclear orig full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 95.4 m-85 . . . . . 0 N--CA 1.489 1.503 0 CA-C-O 119.654 -0.212 . . . . 0.0 110.759 . . . . . . . . . 0 0 . 1 . 045 nuclear orig full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 7.3 p -91.68 143.03 12.15 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.001 0 C-N-CA 124.612 1.165 . . . . 0.0 110.388 170.995 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 30.5 m-20 -120.67 133.55 55.35 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 124.806 1.243 . . . . 0.0 109.745 -179.439 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 44.3 mt-30 -151.51 165.08 35.31 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 124.593 1.157 . . . . 0.0 112.181 -168.564 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 17.5 m-70 -77.07 137.22 38.81 Favored 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 108.631 -0.877 . . . . 0.0 108.631 150.951 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 70.0 mt -146.02 129.26 16.69 Favored 'General case' 0 C--N 1.331 -0.2 0 C-N-CA 125.612 1.565 . . . . 0.0 108.295 -176.565 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 4.2 t -148.67 154.36 39.55 Favored 'General case' 0 N--CA 1.465 0.316 0 C-N-CA 123.238 0.615 . . . . 0.0 111.716 -175.863 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 52.06 -129.46 35.54 Favored Glycine 0 CA--C 1.529 0.923 0 C-N-CA 125.336 1.446 . . . . 0.0 113.056 176.975 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 19.9 m -57.86 -34.62 69.94 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 124.251 1.02 . . . . 0.0 112.737 -179.32 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 75.1 m-70 -75.11 -28.96 60.44 Favored 'General case' 0 CA--C 1.541 0.602 0 O-C-N 121.073 -1.017 . . . . 0.0 113.017 177.797 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 50.1 tp -70.68 -42.63 70.47 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 119.037 0.835 . . . . 0.0 111.058 169.008 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 82.1 t -59.48 -42.45 87.88 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.106 0 CA-C-N 118.477 0.58 . . . . 0.0 111.442 172.548 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -61.83 -48.85 78.72 Favored 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 125.439 1.496 . . . . 0.0 111.843 176.458 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -64.29 -45.26 88.76 Favored 'General case' 0 CA--C 1.54 0.572 0 O-C-N 121.681 -0.637 . . . . 0.0 111.733 179.818 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 45.8 tp -59.76 -46.32 89.52 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 123.868 0.867 . . . . 0.0 110.816 175.994 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 39.1 t80 -58.8 -39.81 82.24 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 123.875 0.87 . . . . 0.0 113.183 172.965 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 68.5 mt -69.59 -31.93 70.37 Favored 'General case' 0 N--CA 1.469 0.516 0 O-C-N 121.482 -0.761 . . . . 0.0 112.952 177.993 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 70.2 t -77.35 -40.04 28.69 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.887 0 C-N-CA 124.238 1.015 . . . . 0.0 111.564 174.693 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 85.4 m -108.34 4.92 25.02 Favored 'General case' 0 N--CA 1.47 0.556 0 N-CA-C 115.246 1.573 . . . . 0.0 115.246 -167.269 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . -60.45 -24.17 61.29 Favored Glycine 0 N--CA 1.478 1.446 0 N-CA-C 116.837 1.495 . . . . 0.0 116.837 -161.469 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -77.06 -27.08 54.22 Favored 'General case' 0 CA--C 1.549 0.94 0 CA-C-N 118.406 1.103 . . . . 0.0 112.834 173.714 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 66.1 mtp180 -100.37 -35.4 9.6 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 126.238 1.815 . . . . 0.0 113.497 -174.695 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 88.88 174.43 46.82 Favored Glycine 0 CA--C 1.533 1.192 0 C-N-CA 124.738 1.161 . . . . 0.0 111.44 -159.953 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 40.4 p90 -151.17 167.76 26.77 Favored 'General case' 0 N--CA 1.475 0.775 0 N-CA-C 114.466 1.284 . . . . 0.0 114.466 -172.37 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 45.1 t80 -122.33 97.43 5.46 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 126.005 1.722 . . . . 0.0 110.401 172.406 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 71.8 t80 -74.81 130.73 39.97 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 124.942 1.297 . . . . 0.0 110.506 172.614 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 8.8 t -163.76 142.33 6.12 Favored Pre-proline 0 N--CA 1.479 0.979 0 N-CA-C 114.947 1.462 . . . . 0.0 114.947 -167.906 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 88.9 Cg_endo -86.5 142.06 6.92 Favored 'Trans proline' 0 C--N 1.35 0.615 0 C-N-CA 124.24 3.293 . . . . 0.0 110.574 157.105 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 24.4 ttpp -63.43 -46.65 85.35 Favored 'General case' 0 CA--C 1.543 0.688 0 O-C-N 121.146 -0.971 . . . . 0.0 112.448 171.344 . . . . . . . . 1 1 . 1 . 045 nuclear orig full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 23.1 m . . . . . 0 C--O 1.252 1.197 0 C-N-CA 125.837 1.655 . . . . 0.0 112.245 -167.474 . . . . . . . . 0 0 . 1 . 046 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.389 0 N-CA-C 111.687 -0.565 . . . . 0.0 111.687 . . . . . . . . . 0 0 . 1 . 046 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -54.85 -35.92 35.51 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.202 0 C-N-CA 125.246 1.418 . . . . 0.0 113.994 -173.205 . . . . . . . . 2 2 . 1 . 046 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 75.8 t -62.41 -34.45 64.6 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.377 0 CA-C-N 119.296 0.953 . . . . 0.0 112.981 177.96 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 43.3 tt0 -76.98 -50.77 12.42 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-N 118.171 0.441 . . . . 0.0 110.131 169.621 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 61.2 tt0 -61.37 -40.48 94.49 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 113.483 0.92 . . . . 0.0 113.483 -169.587 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 7.5 m -64.99 -23.16 67.14 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 113.634 0.976 . . . . 0.0 113.634 174.388 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 26.6 t -94.03 -39.8 10.43 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 124.12 0.968 . . . . 0.0 112.811 -177.544 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 73.2 p -85.41 -40.7 16.15 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 124.856 1.262 . . . . 0.0 112.57 179.116 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 47.8 m -105.32 -170.23 1.72 Allowed 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 125.597 1.559 . . . . 0.0 110.152 170.515 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 11.7 tt -103.43 146.86 10.52 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.8 0 C-N-CA 124.979 1.312 . . . . 0.0 110.025 175.971 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 14.2 p -142.04 162.04 36.47 Favored 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 113.613 0.968 . . . . 0.0 113.613 -178.304 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 19.4 m -112.96 150.1 32.34 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 124.386 1.075 . . . . 0.0 111.994 -170.234 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 28.2 mt -61.1 -33.37 73.25 Favored 'General case' 0 N--CA 1.473 0.713 0 O-C-N 121.275 -0.891 . . . . 0.0 111.858 177.461 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 57.5 m-85 -62.03 -31.85 72.28 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 124.538 1.135 . . . . 0.0 113.082 173.121 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 22.6 mm100 -81.81 -31.18 31.89 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 124.407 1.083 . . . . 0.0 111.684 174.021 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 53.7 mt -62.07 -38.76 90.03 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-N 119.644 1.111 . . . . 0.0 111.397 168.472 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 28.7 tt0 -61.3 -26.02 67.51 Favored 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 113.45 0.907 . . . . 0.0 113.45 -179.396 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 16.1 t-20 -59.72 -22.96 62.76 Favored 'General case' 0 CA--C 1.551 1.015 0 O-C-N 121.156 -0.965 . . . . 0.0 113.547 173.004 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 96.2 m-85 -97.61 1.22 48.52 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 125.61 1.564 . . . . 0.0 114.033 179.574 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 59.6 m -66.88 153.58 43.13 Favored 'General case' 0 CA--C 1.543 0.706 0 O-C-N 121.144 -0.973 . . . . 0.0 111.962 168.402 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 25.6 t-20 . . . . . 0 C--O 1.255 1.389 0 C-N-CA 124.715 1.206 . . . . 0.0 112.667 178.142 . . . . . . . . 0 0 . 1 . 046 nuclear orig full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 68.1 t80 . . . . . 0 N--CA 1.487 1.397 0 CA-C-O 119.97 -0.062 . . . . 0.0 110.89 . . . . . . . . . 0 0 . 1 . 046 nuclear orig full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 28.6 m -74.37 155.62 6.5 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.957 0 C-N-CA 124.535 1.134 . . . . 0.0 113.454 -174.836 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 10.1 p30 -75.42 148.15 39.37 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 126.051 1.74 . . . . 0.0 111.712 170.022 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 34.3 mm-40 -150.89 162.12 41.39 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 124.282 1.033 . . . . 0.0 112.32 -162.28 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 98.1 m-70 -85.91 130.07 34.65 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 123.612 0.765 . . . . 0.0 109.046 164.185 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 90.3 mt -142.83 128.51 19.23 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 125.16 1.384 . . . . 0.0 109.445 -172.112 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 62.7 m -131.62 143.2 50.15 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 124.932 1.293 . . . . 0.0 111.046 -176.246 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 54.51 -127.44 39.83 Favored Glycine 0 N--CA 1.475 1.287 0 C-N-CA 124.846 1.212 . . . . 0.0 114.363 165.275 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 20.3 m -61.09 -33.67 73.72 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 124.152 0.981 . . . . 0.0 112.223 -177.749 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 27.2 m170 -70.93 -37.6 72.89 Favored 'General case' 0 CA--C 1.544 0.716 0 O-C-N 121.353 -0.842 . . . . 0.0 111.391 177.83 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 54.7 tp -66.38 -45.78 78.9 Favored 'General case' 0 N--CA 1.466 0.339 0 C-N-CA 123.697 0.799 . . . . 0.0 111.543 171.398 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 62.4 t -63.0 -36.44 75.8 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.785 0 C-N-CA 123.121 0.569 . . . . 0.0 111.465 177.421 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -66.14 -47.34 74.4 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 123.924 0.89 . . . . 0.0 112.046 172.278 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.47 -46.14 89.63 Favored 'General case' 0 CA--C 1.538 0.505 0 O-C-N 121.554 -0.716 . . . . 0.0 111.754 177.007 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 50.8 tp -58.5 -49.93 75.6 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 124.849 1.26 . . . . 0.0 110.997 174.828 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 52.1 t80 -56.17 -41.04 74.85 Favored 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 113.11 0.782 . . . . 0.0 113.11 174.329 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 80.1 mt -72.24 -35.51 68.85 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 123.91 0.884 . . . . 0.0 112.818 179.083 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 37.8 t -64.01 -46.14 94.73 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.912 0 C-N-CA 123.793 0.837 . . . . 0.0 110.827 171.333 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 81.5 m -78.18 -30.96 49.33 Favored 'General case' 0 N--CA 1.469 0.493 0 N-CA-C 113.437 0.902 . . . . 0.0 113.437 -175.743 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 63.92 -137.76 41.53 Favored Glycine 0 CA--C 1.531 1.057 0 C-N-CA 123.843 0.735 . . . . 0.0 111.417 -174.924 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 28.2 tt0 -67.71 -15.22 63.53 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 124.428 1.091 . . . . 0.0 113.907 -178.573 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 81.7 mtm180 -57.69 -41.11 80.96 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 124.126 0.971 . . . . 0.0 112.574 178.441 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 81.71 -178.29 53.75 Favored Glycine 0 CA--C 1.532 1.108 0 C-N-CA 124.133 0.873 . . . . 0.0 112.1 -168.591 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 52.5 p90 -159.71 167.68 27.76 Favored 'General case' 0 CA--C 1.539 0.548 0 N-CA-C 113.76 1.022 . . . . 0.0 113.76 -167.258 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 86.3 t80 -154.33 110.6 3.26 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 126.134 1.773 . . . . 0.0 109.76 166.672 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 20.8 p90 -82.42 161.37 22.49 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 125.219 1.408 . . . . 0.0 113.391 177.254 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 31.2 m -91.38 125.14 59.11 Favored Pre-proline 0 N--CA 1.477 0.894 0 C-N-CA 124.201 1.0 . . . . 0.0 108.529 164.258 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_endo -75.48 -164.14 0.22 Allowed 'Trans proline' 0 CA--C 1.543 0.933 0 C-N-CA 123.623 2.882 . . . . 0.0 112.158 -172.724 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 23.1 pttp -71.3 11.14 0.48 Allowed 'General case' 0 CA--C 1.555 1.137 0 N-CA-C 115.575 1.695 . . . . 0.0 115.575 -179.572 . . . . . . . . 1 1 . 1 . 046 nuclear orig full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 20.4 p . . . . . 0 C--O 1.254 1.32 0 C-N-CA 126.332 1.853 . . . . 0.0 113.661 175.2 . . . . . . . . 0 0 . 1 . 047 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.525 0 N-CA-C 111.589 -0.604 . . . . 0.0 111.589 . . . . . . . . . 0 0 . 1 . 047 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 10.9 tp -157.6 -43.47 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.476 0.856 0 O-C-N 118.476 -2.779 . . . . 0.0 113.407 3.38 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 44.2 t -63.46 -51.3 72.39 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.385 0 CA-C-N 120.873 1.67 . . . . 0.0 112.87 -169.853 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -84.17 -32.04 24.83 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 123.395 0.678 . . . . 0.0 111.465 177.969 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 63.9 tt0 -65.88 -40.21 91.39 Favored 'General case' 0 CA--C 1.537 0.446 0 O-C-N 121.516 -0.74 . . . . 0.0 112.091 179.666 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 13.2 t -77.03 -15.95 59.45 Favored 'General case' 0 CA--C 1.539 0.543 0 N-CA-C 113.405 0.891 . . . . 0.0 113.405 174.872 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 33.8 t -82.14 -40.1 22.33 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 124.715 1.206 . . . . 0.0 112.123 174.128 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 25.8 p -85.84 -49.37 7.95 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 125.991 1.716 . . . . 0.0 112.047 179.817 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 63.3 m -97.73 -139.05 0.29 Allowed 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 125.586 1.555 . . . . 0.0 109.673 166.308 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 32.8 pt -136.06 161.15 38.24 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.783 0 C-N-CA 125.558 1.543 . . . . 0.0 111.643 -177.705 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 14.9 p -154.71 159.18 40.54 Favored 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 124.758 1.223 . . . . 0.0 112.08 170.576 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 2.3 t -106.01 165.58 11.11 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 124.104 0.962 . . . . 0.0 111.938 177.193 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -59.99 -32.44 70.86 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.958 1.303 . . . . 0.0 111.422 178.161 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 80.3 t80 -63.79 -26.61 68.71 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 124.56 1.144 . . . . 0.0 113.425 172.838 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 72.9 mt-30 -87.82 -31.7 19.43 Favored 'General case' 0 N--CA 1.467 0.386 0 C-N-CA 124.511 1.124 . . . . 0.0 111.17 175.518 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 70.9 mt -59.6 -38.41 81.2 Favored 'General case' 0 N--CA 1.472 0.656 0 CA-C-N 119.322 0.964 . . . . 0.0 111.171 166.018 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 27.2 tt0 -58.1 -25.83 61.83 Favored 'General case' 0 CA--C 1.548 0.885 0 N-CA-C 113.85 1.055 . . . . 0.0 113.85 179.424 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 32.0 t30 -60.78 -26.27 67.13 Favored 'General case' 0 CA--C 1.547 0.86 0 O-C-N 121.024 -1.047 . . . . 0.0 113.205 174.081 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 92.8 m-85 -100.08 5.17 44.97 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 125.75 1.62 . . . . 0.0 114.285 -175.348 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 68.8 m -64.96 160.77 19.96 Favored 'General case' 0 N--CA 1.473 0.7 0 N-CA-C 113.583 0.957 . . . . 0.0 113.583 167.818 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.253 1.267 0 C-N-CA 127.784 2.434 . . . . 0.0 112.102 175.016 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 91.5 m-85 . . . . . 0 N--CA 1.486 1.351 0 N-CA-C 110.735 -0.098 . . . . 0.0 110.735 . . . . . . . . . 0 0 . 1 . 047 nuclear orig full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 9.6 p -130.07 148.58 33.17 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.059 0 C-N-CA 129.194 2.998 . . . . 0.0 110.536 3.561 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . 0.279 0.5 OUTLIER 34.96 95.95 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 128.804 2.842 . . . . 0.0 116.259 177.665 . . . . . . . . 3 3 . 1 . 047 nuclear orig full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 71.3 mm-40 -123.31 168.6 12.28 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 125.242 1.417 . . . . 0.0 111.394 -168.446 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 98.4 m-70 -82.9 125.76 31.73 Favored 'General case' 0 CA--C 1.537 0.462 0 O-C-N 121.296 -0.878 . . . . 0.0 108.667 165.804 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 93.7 mt -142.62 137.08 29.76 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 125.255 1.422 . . . . 0.0 108.118 -179.668 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 4.5 t -143.68 151.83 40.57 Favored 'General case' 0 N--CA 1.466 0.374 0 N-CA-C 112.836 0.68 . . . . 0.0 112.836 -171.797 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 46.14 -128.66 10.13 Favored Glycine 0 CA--C 1.529 0.915 0 C-N-CA 125.985 1.755 . . . . 0.0 114.377 170.378 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 20.0 m -59.48 -33.12 70.93 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 124.777 1.231 . . . . 0.0 112.549 -178.619 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 97.4 m-70 -71.48 -39.81 70.63 Favored 'General case' 0 CA--C 1.541 0.605 0 O-C-N 121.088 -1.008 . . . . 0.0 111.472 178.555 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 8.2 tt -65.57 -44.35 87.0 Favored 'General case' 0 N--CA 1.466 0.329 0 C-N-CA 123.171 0.588 . . . . 0.0 111.003 170.8 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 53.3 t -64.31 -34.34 68.54 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.964 0 CA-C-N 118.406 0.548 . . . . 0.0 111.758 179.012 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -67.53 -48.09 68.02 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 123.95 0.9 . . . . 0.0 111.562 171.864 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -58.99 -44.8 91.65 Favored 'General case' 0 CA--C 1.542 0.668 0 O-C-N 121.736 -0.602 . . . . 0.0 111.775 176.141 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 61.4 tp -56.41 -52.5 64.42 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 125.603 1.561 . . . . 0.0 110.753 173.825 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 48.7 t80 -56.14 -39.78 72.82 Favored 'General case' 0 CA--C 1.543 0.69 0 N-CA-C 113.334 0.864 . . . . 0.0 113.334 174.715 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 82.7 mt -72.75 -32.53 65.72 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 123.87 0.868 . . . . 0.0 113.071 178.613 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 34.2 t -67.76 -44.56 85.64 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.995 0 C-N-CA 124.651 1.18 . . . . 0.0 110.594 171.736 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 62.4 m -83.31 -30.23 27.7 Favored 'General case' 0 N--CA 1.471 0.576 0 N-CA-C 114.375 1.25 . . . . 0.0 114.375 -173.888 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 65.32 -151.29 51.68 Favored Glycine 0 CA--C 1.533 1.203 0 C-N-CA 124.464 1.03 . . . . 0.0 112.355 -173.004 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -61.48 -13.65 22.58 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 125.535 1.534 . . . . 0.0 114.246 -178.286 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 59.1 ttm-85 -63.2 -25.43 68.33 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 125.022 1.329 . . . . 0.0 113.013 175.135 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 78.32 -171.63 55.15 Favored Glycine 0 N--CA 1.471 0.992 0 C-N-CA 124.582 1.087 . . . . 0.0 113.036 -178.785 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 50.3 p90 -162.0 166.67 25.68 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 125.028 1.331 . . . . 0.0 113.143 -170.544 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 83.9 t80 -153.51 115.52 4.32 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 125.63 1.572 . . . . 0.0 109.766 167.81 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 11.7 p90 -94.99 171.61 8.66 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 125.48 1.512 . . . . 0.0 114.356 -175.129 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 21.0 p -132.22 158.12 76.43 Favored Pre-proline 0 N--CA 1.477 0.92 0 C-N-CA 127.227 2.211 . . . . 0.0 110.284 172.385 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -72.8 -55.42 0.1 Allowed 'Trans proline' 0 CA--C 1.537 0.654 0 C-N-CA 122.331 2.02 . . . . 0.0 112.038 -177.477 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 16.2 ptpt -161.01 20.63 0.13 Allowed 'General case' 0 CA--C 1.553 1.069 0 C-N-CA 125.415 1.486 . . . . 0.0 113.331 -171.005 . . . . . . . . 1 1 . 1 . 047 nuclear orig full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 25.8 m . . . . . 0 C--O 1.251 1.167 0 C-N-CA 127.829 2.451 . . . . 0.0 112.683 -175.395 . . . . . . . . 0 0 . 1 . 048 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.988 0 N-CA-C 111.74 -0.544 . . . . 0.0 111.74 . . . . . . . . . 0 0 . 1 . 048 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 24.7 pt -63.06 -27.47 43.23 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.427 0 O-C-N 121.1 -1.235 . . . . 0.0 114.192 -173.286 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 78.1 t -61.01 -31.04 48.84 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.293 0 C-N-CA 123.413 0.685 . . . . 0.0 111.86 173.743 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 -79.09 -56.89 4.04 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 123.267 0.627 . . . . 0.0 109.957 169.632 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 23.0 tt0 -67.28 -40.3 86.12 Favored 'General case' 0 N--CA 1.467 0.409 0 N-CA-C 112.823 0.675 . . . . 0.0 112.823 -164.483 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 64.5 m -66.81 -24.08 66.12 Favored 'General case' 0 CA--C 1.534 0.334 0 N-CA-C 113.666 0.987 . . . . 0.0 113.666 178.635 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 33.3 t -98.66 -37.5 9.48 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 124.015 0.926 . . . . 0.0 112.76 -175.376 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 76.8 p -88.63 -33.51 17.6 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 125.077 1.351 . . . . 0.0 113.108 178.978 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 49.0 m -117.39 -168.45 1.49 Allowed 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 125.883 1.673 . . . . 0.0 109.85 170.446 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 12.0 tt -96.66 148.07 5.73 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.659 0 O-C-N 120.834 -1.166 . . . . 0.0 109.821 171.034 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 11.0 p -138.83 166.79 23.51 Favored 'General case' 0 N--CA 1.475 0.785 0 O-C-N 121.251 -0.906 . . . . 0.0 112.828 177.714 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 22.7 t -108.99 157.89 18.23 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-O 121.786 0.803 . . . . 0.0 112.936 -177.927 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 44.4 mt -60.86 -31.12 70.59 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 123.572 0.749 . . . . 0.0 111.44 169.437 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 85.1 t80 -62.96 -28.99 70.46 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.31 1.044 . . . . 0.0 113.223 172.439 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 64.9 mt-30 -80.28 -38.18 31.31 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 123.494 0.718 . . . . 0.0 110.702 174.164 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 42.1 mt -60.49 -37.24 80.44 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-N 118.639 0.654 . . . . 0.0 112.016 170.75 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -61.31 -30.62 70.61 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 124.329 1.052 . . . . 0.0 112.923 178.881 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 14.5 t-20 -65.14 -20.75 66.61 Favored 'General case' 0 CA--C 1.55 0.963 0 O-C-N 121.461 -0.774 . . . . 0.0 112.931 177.134 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 45.4 m-85 -98.91 0.89 45.03 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 125.699 1.599 . . . . 0.0 113.74 179.964 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 60.3 m -65.13 155.51 34.66 Favored 'General case' 0 CA--C 1.544 0.747 0 O-C-N 120.942 -1.099 . . . . 0.0 112.872 172.829 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.247 0.964 0 C-N-CA 126.184 1.794 . . . . 0.0 110.476 167.819 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 84.8 m-85 . . . . . 0 N--CA 1.487 1.403 0 N-CA-C 111.285 0.106 . . . . 0.0 111.285 . . . . . . . . . 0 0 . 1 . 048 nuclear orig full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 95.8 t -137.36 135.32 47.02 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.044 0 C-N-CA 125.468 1.507 . . . . 0.0 108.329 176.567 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 8.5 p30 -132.52 142.25 49.11 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 124.63 1.172 . . . . 0.0 112.516 179.701 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 54.0 mm-40 -153.42 161.18 42.55 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 125.412 1.485 . . . . 0.0 111.228 -164.985 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 92.9 m-70 -87.93 129.56 35.2 Favored 'General case' 0 CA--C 1.539 0.55 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 159.871 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 87.3 mt -142.96 123.47 13.98 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 125.304 1.442 . . . . 0.0 109.895 -172.952 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 68.5 m -127.87 142.39 51.29 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 125.449 1.499 . . . . 0.0 110.177 178.164 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 51.78 -117.03 5.46 Favored Glycine 0 N--CA 1.472 1.041 0 C-N-CA 125.221 1.391 . . . . 0.0 113.941 167.031 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 20.2 t -60.05 -37.38 79.66 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 123.769 0.828 . . . . 0.0 112.266 -178.65 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 92.6 m-70 -68.0 -40.37 83.03 Favored 'General case' 0 CA--C 1.541 0.605 0 O-C-N 120.975 -1.078 . . . . 0.0 111.4 177.21 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 52.5 tp -64.4 -46.03 85.03 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 123.763 0.825 . . . . 0.0 110.949 174.09 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 33.1 t -61.05 -38.91 80.6 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.797 0 C-N-CA 124.453 1.101 . . . . 0.0 111.988 176.475 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -64.97 -48.04 75.46 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 123.45 0.7 . . . . 0.0 111.094 174.61 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.17 -43.38 98.96 Favored 'General case' 0 CA--C 1.542 0.646 0 O-C-N 121.638 -0.664 . . . . 0.0 112.116 178.246 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 19.1 mt -56.31 -48.76 76.02 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 124.162 0.985 . . . . 0.0 111.302 172.707 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 64.1 t80 -64.91 -30.71 71.72 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 119.207 0.912 . . . . 0.0 113.095 176.845 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 73.8 mt -72.52 -36.17 68.27 Favored 'General case' 0 N--CA 1.471 0.578 0 O-C-N 121.091 -1.006 . . . . 0.0 112.981 174.799 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 73.3 t -77.14 -39.12 28.52 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.004 0 C-N-CA 123.851 0.86 . . . . 0.0 111.715 176.351 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 66.6 m -111.27 -4.3 15.01 Favored 'General case' 0 N--CA 1.476 0.843 0 N-CA-C 114.993 1.479 . . . . 0.0 114.993 -167.459 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . -74.04 145.67 35.32 Favored Glycine 0 CA--C 1.535 1.325 0 O-C-N 120.776 -1.203 . . . . 0.0 112.258 -177.246 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -86.39 -0.13 55.28 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 128.041 2.537 . . . . 0.0 113.608 0.326 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 35.7 mtp180 -63.32 -34.84 78.56 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 125.044 1.338 . . . . 0.0 113.407 -173.641 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 93.74 -179.48 38.53 Favored Glycine 0 N--CA 1.472 1.094 0 C-N-CA 125.097 1.332 . . . . 0.0 113.437 178.895 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 39.8 p90 -150.97 161.82 42.01 Favored 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 114.012 1.116 . . . . 0.0 114.012 -169.311 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 47.0 m-85 -119.74 30.93 6.8 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 126.684 1.994 . . . . 0.0 113.123 -172.346 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -52.73 150.73 4.96 Favored 'General case' 0 CA--C 1.547 0.834 0 N-CA-C 114.829 1.418 . . . . 0.0 114.829 -178.139 . . . . . . . . 2 2 . 1 . 048 nuclear orig full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 5.0 t -171.71 151.22 2.79 Favored Pre-proline 0 N--CA 1.475 0.784 0 C-N-CA 124.819 1.248 . . . . 0.0 111.728 -171.216 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 93.6 Cg_endo -79.25 -17.39 11.7 Favored 'Trans proline' 0 C--N 1.353 0.794 0 C-N-CA 123.611 2.874 . . . . 0.0 112.58 165.847 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 49.5 mtpt 67.69 3.97 3.68 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 127.581 2.352 . . . . 0.0 114.575 -177.369 . . . . . . . . 1 1 . 1 . 048 nuclear orig full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 22.4 p . . . . . 0 N--CA 1.483 1.199 0 C-N-CA 126.53 1.932 . . . . 0.0 113.298 177.002 . . . . . . . . 0 0 . 1 . 049 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.925 0 N-CA-C 111.519 -0.632 . . . . 0.0 111.519 . . . . . . . . . 0 0 . 1 . 049 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 29.0 pt -57.65 -31.83 40.68 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.409 0 N-CA-C 115.726 1.75 . . . . 0.0 115.726 -163.393 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 41.8 t -64.46 -36.34 77.01 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.132 0 CA-C-N 119.139 0.881 . . . . 0.0 112.443 -174.762 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -89.71 -49.14 6.82 Favored 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 123.263 0.625 . . . . 0.0 110.376 169.408 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 65.3 tt0 -66.45 -40.49 89.44 Favored 'General case' 0 N--CA 1.464 0.234 0 C-N-CA 124.6 1.16 . . . . 0.0 113.013 -168.013 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 4.3 t -82.08 -15.29 53.99 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 119.096 0.862 . . . . 0.0 112.688 -178.526 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 49.1 t -92.16 -40.71 10.86 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 124.6 1.16 . . . . 0.0 112.363 178.423 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 63.0 p -84.01 -44.67 13.91 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 124.996 1.318 . . . . 0.0 112.007 177.6 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 50.5 m -106.85 -141.73 0.37 Allowed 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 125.473 1.509 . . . . 0.0 109.529 167.028 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 45.0 pt -127.02 165.64 25.24 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.667 0 C-N-CA 125.078 1.351 . . . . 0.0 111.396 179.77 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 16.1 p -147.09 160.61 42.2 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 123.886 0.874 . . . . 0.0 112.543 168.286 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 25.4 t -95.97 160.05 14.66 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 124.826 1.25 . . . . 0.0 112.451 176.802 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 52.7 mt -60.6 -34.57 74.41 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 124.07 0.948 . . . . 0.0 111.101 171.089 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 82.6 t80 -62.63 -26.72 68.77 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 124.596 1.158 . . . . 0.0 113.091 173.197 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 83.0 mt-30 -86.46 -38.01 17.73 Favored 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 123.887 0.875 . . . . 0.0 110.856 175.524 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 79.6 mt -56.64 -36.66 69.76 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-N 119.315 0.961 . . . . 0.0 111.893 170.821 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 30.1 tt0 -57.11 -25.76 59.35 Favored 'General case' 0 CA--C 1.547 0.84 0 N-CA-C 113.618 0.97 . . . . 0.0 113.618 177.908 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 14.5 t-20 -65.65 -24.29 66.99 Favored 'General case' 0 CA--C 1.548 0.895 0 O-C-N 120.947 -1.095 . . . . 0.0 113.319 176.018 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 89.7 m-85 -95.91 -0.32 51.02 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 126.001 1.72 . . . . 0.0 113.369 -177.268 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 60.1 m -69.0 156.61 38.32 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 124.147 0.979 . . . . 0.0 113.127 170.073 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.253 1.273 0 C-N-CA 124.965 1.306 . . . . 0.0 111.866 175.186 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 9.6 p90 . . . . . 0 N--CA 1.486 1.327 0 N-CA-C 112.182 0.438 . . . . 0.0 112.182 . . . . . . . . . 0 0 . 1 . 049 nuclear orig full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 98.3 t -83.3 131.95 32.56 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.948 0 C-N-CA 128.161 2.584 . . . . 0.0 109.178 -8.109 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 1.7 p-10 -139.41 139.59 37.16 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 125.018 1.327 . . . . 0.0 111.697 -177.504 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 38.6 mt-30 -148.96 163.19 38.22 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 123.858 0.863 . . . . 0.0 111.987 -161.69 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 97.9 m-70 -82.7 131.6 35.2 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 108.914 -0.772 . . . . 0.0 108.914 156.282 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 86.7 mt -145.41 129.02 17.11 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 125.263 1.425 . . . . 0.0 110.042 -178.647 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 68.8 m -130.61 142.3 50.45 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 125.614 1.565 . . . . 0.0 110.099 179.744 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 52.33 -121.05 12.8 Favored Glycine 0 N--CA 1.47 0.929 0 C-N-CA 124.704 1.145 . . . . 0.0 114.087 166.588 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 21.5 m -59.53 -33.49 71.45 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 124.222 1.009 . . . . 0.0 112.558 -178.214 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 94.7 m-70 -71.06 -39.13 72.41 Favored 'General case' 0 CA--C 1.538 0.494 0 O-C-N 121.421 -0.799 . . . . 0.0 111.441 176.768 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 48.1 tp -66.16 -42.53 88.87 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 123.653 0.781 . . . . 0.0 111.235 173.569 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 54.7 t -60.31 -45.0 97.01 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.888 0 C-N-CA 123.784 0.833 . . . . 0.0 111.471 173.714 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -62.67 -46.92 85.95 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 123.869 0.867 . . . . 0.0 111.313 178.074 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.66 -46.66 87.16 Favored 'General case' 0 CA--C 1.54 0.56 0 O-C-N 121.674 -0.641 . . . . 0.0 111.778 178.733 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 49.6 tp -59.6 -49.29 78.33 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 123.94 0.896 . . . . 0.0 111.091 177.526 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 53.9 t80 -52.46 -44.91 65.85 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 123.813 0.845 . . . . 0.0 112.902 173.403 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 82.3 mt -70.57 -32.49 69.91 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 123.813 0.845 . . . . 0.0 113.05 179.896 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 42.2 t -69.51 -43.12 80.87 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.814 0 C-N-CA 124.264 1.026 . . . . 0.0 111.238 172.5 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 64.7 m -83.23 -26.38 30.83 Favored 'General case' 0 N--CA 1.469 0.51 0 N-CA-C 114.392 1.256 . . . . 0.0 114.392 -173.987 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 63.29 -134.73 42.47 Favored Glycine 0 CA--C 1.532 1.108 0 C-N-CA 124.283 0.944 . . . . 0.0 112.252 -177.912 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 32.4 mm-40 -66.92 -15.21 63.52 Favored 'General case' 0 CA--C 1.545 0.762 0 N-CA-C 114.06 1.133 . . . . 0.0 114.06 -176.913 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 86.3 mtt-85 -61.25 -41.73 97.41 Favored 'General case' 0 N--CA 1.473 0.712 0 N-CA-C 113.571 0.952 . . . . 0.0 113.571 -178.768 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 79.0 -175.48 55.09 Favored Glycine 0 CA--C 1.534 1.28 0 C-N-CA 123.248 0.452 . . . . 0.0 111.997 -160.697 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 33.9 p90 -160.46 165.79 30.35 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 124.662 1.185 . . . . 0.0 113.18 -166.452 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 50.2 m-85 -99.68 -32.49 11.04 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 125.403 1.481 . . . . 0.0 113.336 -177.108 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 91.7 t80 67.34 -39.68 0.38 Allowed 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 129.031 2.932 . . . . 0.0 116.394 174.259 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 38.2 p -57.58 148.16 57.33 Favored Pre-proline 0 N--CA 1.476 0.851 0 C-N-CA 125.723 1.609 . . . . 0.0 112.855 -171.062 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 92.1 Cg_endo -74.69 -21.91 16.11 Favored 'Trans proline' 0 C--N 1.353 0.767 0 C-N-CA 123.104 2.536 . . . . 0.0 113.175 -177.416 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 22.5 ptmt -171.26 -25.61 0.01 OUTLIER 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 126.712 2.005 . . . . 0.0 113.574 -179.121 . . . . . . . . 1 1 . 1 . 049 nuclear orig full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 4.0 m . . . . . 0 C--O 1.251 1.136 0 C-N-CA 127.094 2.158 . . . . 0.0 113.103 -179.528 . . . . . . . . 0 0 . 1 . 050 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.676 0 N-CA-C 110.993 -0.843 . . . . 0.0 110.993 . . . . . . . . . 0 0 . 1 . 050 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 11.4 tp -60.09 -39.56 80.78 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.01 0 N-CA-C 113.86 1.059 . . . . 0.0 113.86 -165.506 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 85.3 t -68.7 -34.27 64.0 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.009 0 CA-C-N 119.047 0.839 . . . . 0.0 111.693 -176.595 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 21.0 mm-40 -74.61 -46.24 39.79 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-N 118.315 0.507 . . . . 0.0 111.015 173.117 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 73.4 tp60 -59.48 -44.8 92.97 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 123.662 0.785 . . . . 0.0 111.653 -178.673 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 62.5 m -70.44 -25.92 63.42 Favored 'General case' 0 N--CA 1.466 0.366 0 N-CA-C 114.758 1.392 . . . . 0.0 114.758 179.715 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 17.3 t -106.74 -36.61 6.65 Favored 'General case' 0 CA--C 1.541 0.611 0 N-CA-C 113.701 1.001 . . . . 0.0 113.701 -168.937 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 46.7 p -85.43 -33.02 22.02 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 124.637 1.175 . . . . 0.0 112.055 175.51 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 65.6 m -121.42 -161.62 0.92 Allowed 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 126.68 1.992 . . . . 0.0 109.63 171.303 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 48.4 pt -97.06 157.9 3.26 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.518 0 O-C-N 121.203 -0.935 . . . . 0.0 111.243 168.038 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 21.4 p -137.55 163.83 30.23 Favored 'General case' 0 N--CA 1.466 0.359 0 C-N-CA 124.235 1.014 . . . . 0.0 111.498 170.431 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 32.2 m -104.86 149.18 25.89 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 123.932 0.893 . . . . 0.0 111.215 -177.353 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 56.3 mt -58.71 -32.12 68.89 Favored 'General case' 0 N--CA 1.471 0.611 0 O-C-N 121.358 -0.839 . . . . 0.0 111.686 174.876 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 72.7 t80 -62.22 -27.98 69.37 Favored 'General case' 0 CA--C 1.542 0.646 0 N-CA-C 113.817 1.043 . . . . 0.0 113.817 171.649 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 20.9 mm100 -83.5 -34.2 25.39 Favored 'General case' 0 N--CA 1.465 0.301 0 C-N-CA 124.124 0.97 . . . . 0.0 111.088 175.911 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 10.9 mp -56.1 -49.14 74.68 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-N 118.692 0.678 . . . . 0.0 110.385 165.961 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 4.0 tm-20 -61.99 -39.65 92.93 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 124.898 1.279 . . . . 0.0 112.39 178.694 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 21.6 t30 -64.93 -35.12 80.15 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 123.989 0.916 . . . . 0.0 113.239 175.605 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -74.37 -20.86 59.92 Favored 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 114.116 1.154 . . . . 0.0 114.116 178.969 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 77.2 m -66.52 159.07 28.09 Favored 'General case' 0 CA--C 1.54 0.596 0 N-CA-C 114.407 1.262 . . . . 0.0 114.407 178.13 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.251 1.141 0 C-N-CA 125.604 1.561 . . . . 0.0 114.147 -166.718 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 60.1 m-85 . . . . . 0 N--CA 1.487 1.415 0 CA-C-O 119.845 -0.121 . . . . 0.0 111.268 . . . . . . . . . 0 0 . 1 . 050 nuclear orig full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 83.5 t -78.55 135.63 25.58 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.971 0 C-N-CA 123.792 0.837 . . . . 0.0 108.886 170.448 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -133.05 141.14 48.07 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 124.512 1.125 . . . . 0.0 112.345 177.905 . . . . . . . . 2 2 . 1 . 050 nuclear orig full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 27.7 mm-40 -148.88 164.22 35.14 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 124.968 1.307 . . . . 0.0 111.19 -165.438 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 94.7 m-70 -85.59 132.17 34.22 Favored 'General case' 0 CA--C 1.538 0.516 0 N-CA-C 108.991 -0.744 . . . . 0.0 108.991 155.407 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 97.3 mt -144.55 130.6 19.44 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 125.706 1.603 . . . . 0.0 109.154 -178.216 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 86.0 m -137.67 147.51 44.94 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 125.06 1.344 . . . . 0.0 110.389 -176.436 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 55.66 -131.53 49.43 Favored Glycine 0 N--CA 1.472 1.052 0 C-N-CA 124.278 0.942 . . . . 0.0 113.658 166.178 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 21.1 m -61.28 -31.07 70.89 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 124.603 1.161 . . . . 0.0 112.524 -178.415 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 94.2 m-70 -70.09 -39.33 75.62 Favored 'General case' 0 CA--C 1.539 0.547 0 O-C-N 121.365 -0.835 . . . . 0.0 111.359 176.854 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 51.4 tp -65.94 -44.4 85.19 Favored 'General case' 0 C--N 1.343 0.317 0 CA-C-O 118.594 -0.717 . . . . 0.0 111.043 170.964 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 71.3 t -57.96 -44.94 87.8 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.102 0 CA-C-N 118.884 0.766 . . . . 0.0 111.624 176.171 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -63.55 -47.58 80.98 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 123.702 0.801 . . . . 0.0 111.248 177.664 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.71 -48.44 81.78 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 123.3 0.64 . . . . 0.0 111.409 178.524 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 50.1 tp -58.49 -47.41 84.17 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 125.683 1.593 . . . . 0.0 111.622 179.24 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 82.0 t80 -59.16 -42.18 90.15 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 123.948 0.899 . . . . 0.0 113.2 174.032 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 89.4 mt -75.89 -33.04 59.93 Favored 'General case' 0 N--CA 1.471 0.614 0 N-CA-C 113.191 0.812 . . . . 0.0 113.191 -179.743 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 23.7 t -65.38 -45.54 92.86 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.734 0 C-N-CA 124.619 1.168 . . . . 0.0 110.598 173.792 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 71.5 m -90.72 -27.36 19.01 Favored 'General case' 0 N--CA 1.47 0.542 0 N-CA-C 114.349 1.241 . . . . 0.0 114.349 -172.467 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . -53.31 133.68 42.14 Favored Glycine 0 CA--C 1.536 1.379 0 C-N-CA 124.193 0.902 . . . . 0.0 112.851 -171.977 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -77.71 -11.48 59.88 Favored 'General case' 0 CA--C 1.551 0.996 0 C-N-CA 128.501 2.72 . . . . 0.0 115.006 10.843 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 55.0 ttp85 -65.67 140.9 58.52 Favored 'General case' 0 N--CA 1.473 0.708 0 O-C-N 120.826 -1.171 . . . . 0.0 111.87 178.669 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . -80.94 151.01 31.38 Favored Glycine 0 N--CA 1.47 0.931 0 C-N-CA 125.342 1.449 . . . . 0.0 112.648 -173.877 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 45.3 p90 -105.83 166.92 10.13 Favored 'General case' 0 CA--C 1.536 0.439 0 N-CA-C 114.57 1.322 . . . . 0.0 114.57 -173.393 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 45.1 t80 -137.0 136.81 38.8 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 126.35 1.86 . . . . 0.0 109.206 171.553 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 66.5 t80 -135.6 125.6 25.93 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 125.613 1.565 . . . . 0.0 110.627 -164.847 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 8.8 t -162.45 143.77 7.97 Favored Pre-proline 0 N--CA 1.477 0.925 0 C-N-CA 123.96 0.904 . . . . 0.0 113.07 -171.295 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 93.0 Cg_endo -77.1 -17.05 15.41 Favored 'Trans proline' 0 C--N 1.352 0.741 0 C-N-CA 123.44 2.76 . . . . 0.0 113.229 168.355 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 18.1 ttpp -114.91 139.42 49.81 Favored 'General case' 0 CA--C 1.543 0.673 0 C-N-CA 124.102 0.961 . . . . 0.0 112.588 -164.699 . . . . . . . . 1 1 . 1 . 050 nuclear orig full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 20.6 m . . . . . 0 C--O 1.254 1.295 0 C-N-CA 125.023 1.329 . . . . 0.0 111.273 173.752 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 44.6 t . . . . . 0 N--CA 1.481 1.119 0 N-CA-C 112.315 0.487 . . . . 0.0 112.315 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -95.19 -52.95 3.97 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-N 119.478 1.035 . . . . 0.0 111.702 164.399 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 68.9 tp60 -64.18 -33.81 76.65 Favored 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 113.087 0.773 . . . . 0.0 113.087 -169.268 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 98.2 m -85.78 -28.17 24.72 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 119.5 1.045 . . . . 0.0 113.387 176.46 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 45.4 t -97.38 -60.1 1.65 Allowed 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 123.385 0.674 . . . . 0.0 112.65 -171.382 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 35.6 m -73.49 -41.71 62.75 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 125.748 1.619 . . . . 0.0 110.141 -179.157 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.4 t -102.49 -163.39 1.0 Allowed 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 124.045 0.938 . . . . 0.0 111.189 165.328 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 35.0 mt -108.25 145.1 15.73 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.743 0 C-N-CA 125.8 1.64 . . . . 0.0 110.499 175.916 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 10.2 p -133.32 163.83 28.45 Favored 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 112.957 0.725 . . . . 0.0 112.957 169.186 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 65.6 p -101.52 161.97 13.24 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 124.514 1.126 . . . . 0.0 113.703 176.519 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 52.5 mt -62.56 -34.37 76.81 Favored 'General case' 0 CA--C 1.539 0.532 0 O-C-N 121.308 -0.87 . . . . 0.0 111.696 171.0 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 91.2 t80 -63.61 -32.84 74.44 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 124.056 0.942 . . . . 0.0 112.748 173.356 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 91.6 mt-30 -73.62 -39.82 64.25 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-O 118.293 -0.861 . . . . 0.0 111.682 171.673 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 84.7 mt -59.82 -34.08 72.61 Favored 'General case' 0 N--CA 1.476 0.857 0 CA-C-N 119.825 1.193 . . . . 0.0 112.175 173.448 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 26.5 tt0 -60.56 -24.29 65.3 Favored 'General case' 0 CA--C 1.548 0.892 0 N-CA-C 113.326 0.861 . . . . 0.0 113.326 178.854 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 30.7 t30 -65.59 -25.65 67.5 Favored 'General case' 0 CA--C 1.546 0.799 0 O-C-N 121.046 -1.034 . . . . 0.0 113.058 173.837 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 97.0 m-85 -99.11 2.5 46.06 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 125.404 1.482 . . . . 0.0 113.899 -174.515 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 57.6 m . . . . . 0 CA--C 1.543 0.683 0 C-N-CA 123.871 0.868 . . . . 0.0 112.768 165.358 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 2.9 p-10 . . . . . 0 CA--C 1.538 0.512 0 N-CA-C 112.548 0.573 . . . . 0.0 112.548 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 30.2 mm-40 -153.79 168.58 25.82 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 125.084 1.354 . . . . 0.0 112.007 -168.147 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 80.0 m-70 -82.61 129.06 34.87 Favored 'General case' 0 CA--C 1.545 0.765 0 N-CA-C 109.241 -0.652 . . . . 0.0 109.241 155.289 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 79.7 mt -142.37 125.19 16.03 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 126.74 2.016 . . . . 0.0 108.977 -177.355 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 79.0 m -132.43 143.98 50.17 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 124.943 1.297 . . . . 0.0 111.392 -174.222 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 55.42 -122.52 26.77 Favored Glycine 0 N--CA 1.474 1.218 0 C-N-CA 124.923 1.249 . . . . 0.0 113.861 168.037 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 22.2 m -61.73 -33.43 74.02 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 123.747 0.819 . . . . 0.0 111.554 -179.644 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 20.9 m80 -72.69 -37.65 67.78 Favored 'General case' 0 CA--C 1.538 0.502 0 O-C-N 121.249 -0.907 . . . . 0.0 111.279 178.826 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 51.9 tp -63.12 -48.37 78.81 Favored 'General case' 0 N--CA 1.467 0.416 0 C-N-CA 124.056 0.943 . . . . 0.0 111.003 170.801 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 55.4 t -63.49 -37.74 80.38 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.87 0 C-N-CA 123.473 0.709 . . . . 0.0 111.946 178.743 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -66.5 -47.77 71.92 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 124.169 0.987 . . . . 0.0 111.839 174.207 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.69 -44.71 96.19 Favored 'General case' 0 CA--C 1.536 0.436 0 O-C-N 121.772 -0.58 . . . . 0.0 111.892 178.077 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 48.6 tp -58.55 -50.88 72.18 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 124.408 1.083 . . . . 0.0 110.858 174.932 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 50.8 t80 -56.92 -39.02 73.69 Favored 'General case' 0 CA--C 1.544 0.725 0 N-CA-C 113.286 0.847 . . . . 0.0 113.286 174.652 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 77.1 mt -71.12 -33.58 70.25 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 123.725 0.81 . . . . 0.0 112.878 177.94 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 42.5 t -68.31 -43.13 84.65 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.967 0 C-N-CA 124.067 0.947 . . . . 0.0 111.093 172.144 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 66.6 m -83.9 -29.31 27.27 Favored 'General case' 0 N--CA 1.471 0.625 0 N-CA-C 114.304 1.224 . . . . 0.0 114.304 -174.063 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 70.47 -159.23 53.63 Favored Glycine 0 CA--C 1.532 1.114 0 C-N-CA 124.653 1.12 . . . . 0.0 112.281 -170.721 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -64.1 -10.63 23.65 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 124.851 1.261 . . . . 0.0 114.185 -179.506 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 23.1 ttp85 -58.26 -31.62 67.6 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 125.287 1.435 . . . . 0.0 112.993 173.105 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 86.29 -176.65 48.59 Favored Glycine 0 CA--C 1.532 1.147 0 C-N-CA 124.412 1.006 . . . . 0.0 114.148 -179.671 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 49.5 p90 -163.91 172.67 13.65 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 124.654 1.181 . . . . 0.0 112.938 -164.091 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 91.5 t80 . . . . . 0 CA--C 1.538 0.486 0 C-N-CA 125.417 1.487 . . . . 0.0 110.048 166.219 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 3' ' ' VAL . . . . . 0.508 HG13 ' H ' ' B' ' 8' ' ' GLY . 78.3 t . . . . . 0 N--CA 1.477 0.907 0 CA-C-O 119.432 -0.318 . . . . 0.0 111.454 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -67.42 -48.57 66.92 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 118.343 0.519 . . . . 0.0 110.222 -178.886 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 22.2 tt0 -61.16 -55.84 27.64 Favored 'General case' 0 N--CA 1.466 0.357 0 C-N-CA 124.775 1.23 . . . . 0.0 111.284 -179.716 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 78.1 m -68.76 -19.76 64.34 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 114.271 1.211 . . . . 0.0 114.271 -175.129 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 17.9 t -90.44 -41.24 11.56 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 124.398 1.079 . . . . 0.0 112.893 176.946 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 1.4 t -79.61 -37.68 35.6 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 123.632 0.773 . . . . 0.0 112.413 179.15 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 10.3 t -107.63 -149.96 0.44 Allowed 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 125.907 1.683 . . . . 0.0 109.637 169.098 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 27.1 pt -123.08 149.35 26.81 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.444 0 C-N-CA 125.61 1.564 . . . . 0.0 111.481 177.092 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 58.2 m -128.18 162.86 25.96 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 125.399 1.48 . . . . 0.0 111.005 172.453 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 99.5 p -114.47 165.29 12.89 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 124.748 1.219 . . . . 0.0 112.698 -178.415 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 61.1 mt -62.0 -33.41 74.27 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 123.245 0.618 . . . . 0.0 111.756 173.522 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 88.7 t80 -67.26 -34.46 77.47 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 123.566 0.746 . . . . 0.0 113.0 172.806 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 38.9 mt-30 -72.19 -38.17 69.14 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-O 118.768 -0.634 . . . . 0.0 111.052 173.321 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 85.9 mt -60.58 -40.82 93.1 Favored 'General case' 0 CA--C 1.538 0.498 0 CA-C-N 119.128 0.877 . . . . 0.0 111.476 169.03 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 25.7 tt0 -65.45 -33.62 76.36 Favored 'General case' 0 CA--C 1.543 0.709 0 CA-C-N 118.517 0.598 . . . . 0.0 112.406 177.844 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 34.3 t30 -65.15 -22.94 66.99 Favored 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 123.755 0.822 . . . . 0.0 113.032 173.228 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 13.9 m-85 -87.41 -6.59 58.38 Favored 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 124.908 1.283 . . . . 0.0 113.636 176.069 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 70.2 m . . . . . 0 N--CA 1.473 0.71 0 O-C-N 120.914 -1.116 . . . . 0.0 113.518 177.302 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 7.4 m-80 . . . . . 0 CA--C 1.537 0.452 0 CA-C-O 121.135 0.493 . . . . 0.0 111.536 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 38.3 mt-30 -145.58 158.71 43.81 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 125.565 1.546 . . . . 0.0 110.617 -173.877 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 99.5 m-70 -82.34 130.19 35.04 Favored 'General case' 0 CA--C 1.539 0.535 0 N-CA-C 108.289 -1.004 . . . . 0.0 108.289 158.305 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 85.2 mt -138.02 121.53 17.25 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 124.582 1.153 . . . . 0.0 109.732 -173.8 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 33.5 m -131.22 135.19 47.16 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.741 1.216 . . . . 0.0 110.476 -172.91 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 8' ' ' GLY . . . . . 0.508 ' H ' HG13 ' A' ' 3' ' ' VAL . . . 50.42 -120.7 8.92 Favored Glycine 0 CA--C 1.529 0.914 0 C-N-CA 125.163 1.363 . . . . 0.0 114.526 168.54 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 25.2 p -62.02 -32.52 73.02 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 124.484 1.114 . . . . 0.0 113.063 -179.686 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 94.0 m-70 -68.98 -38.62 79.45 Favored 'General case' 0 CA--C 1.538 0.519 0 O-C-N 121.172 -0.955 . . . . 0.0 111.385 175.269 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 8.7 tt -64.0 -48.98 74.25 Favored 'General case' 0 C--N 1.344 0.355 0 CA-C-O 118.875 -0.583 . . . . 0.0 110.552 171.459 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 53.9 t -59.85 -40.5 82.91 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.994 0 C-N-CA 123.234 0.614 . . . . 0.0 111.841 179.864 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -63.4 -49.9 71.96 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 123.676 0.79 . . . . 0.0 111.807 175.404 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.01 -45.98 91.23 Favored 'General case' 0 CA--C 1.539 0.523 0 O-C-N 121.79 -0.569 . . . . 0.0 111.564 178.957 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 40.4 tp -58.26 -51.53 69.4 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 125.619 1.567 . . . . 0.0 111.395 177.857 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 68.7 t80 -55.44 -42.59 74.41 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 123.762 0.825 . . . . 0.0 112.652 174.454 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 87.7 mt -73.7 -32.19 63.8 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 123.951 0.9 . . . . 0.0 113.179 -179.31 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 34.5 t -69.1 -45.25 80.17 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.885 0 C-N-CA 124.025 0.93 . . . . 0.0 110.341 171.883 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 74.0 m -77.06 -35.39 56.71 Favored 'General case' 0 N--CA 1.468 0.44 0 N-CA-C 113.385 0.883 . . . . 0.0 113.385 -175.181 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 62.58 -129.79 42.61 Favored Glycine 0 CA--C 1.532 1.094 0 C-N-CA 123.982 0.801 . . . . 0.0 111.254 -175.986 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -66.57 -14.36 62.26 Favored 'General case' 0 CA--C 1.546 0.802 0 N-CA-C 114.073 1.138 . . . . 0.0 114.073 179.344 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 84.5 mtm180 -69.09 -24.64 64.16 Favored 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 113.672 0.989 . . . . 0.0 113.672 -177.457 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 69.09 -175.48 31.86 Favored Glycine 0 N--CA 1.472 1.064 0 C-N-CA 124.027 0.822 . . . . 0.0 112.446 -170.697 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 44.2 p90 -154.11 157.66 39.26 Favored 'General case' 0 CA--C 1.539 0.545 0 N-CA-C 115.187 1.551 . . . . 0.0 115.187 -174.367 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 91.6 t80 . . . . . 0 CA--C 1.538 0.486 0 C-N-CA 126.476 1.911 . . . . 0.0 109.981 161.514 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 70.5 t . . . . . 0 N--CA 1.479 1.016 0 N-CA-C 111.781 0.289 . . . . 0.0 111.781 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -83.18 -50.23 8.66 Favored 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 123.779 0.832 . . . . 0.0 110.898 171.357 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 31.7 tt0 -64.7 -45.93 84.53 Favored 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 123.6 0.76 . . . . 0.0 112.298 -169.386 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 11.6 m -67.36 -17.89 64.93 Favored 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 113.501 0.926 . . . . 0.0 113.501 175.983 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 28.1 t -95.21 -42.56 8.5 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 124.396 1.078 . . . . 0.0 112.293 -176.506 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 54.3 p -87.2 -33.21 19.42 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 126.002 1.721 . . . . 0.0 112.571 -178.823 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 7.8 t -109.79 -170.25 1.62 Allowed 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 124.805 1.242 . . . . 0.0 110.103 165.797 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 11.8 tt -101.76 147.04 9.01 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.629 0 C-N-CA 125.28 1.432 . . . . 0.0 110.093 173.614 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 16.7 p -140.61 157.91 44.76 Favored 'General case' 0 N--CA 1.474 0.772 0 N-CA-C 112.974 0.731 . . . . 0.0 112.974 176.985 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 83.8 p -104.29 157.57 17.05 Favored 'General case' 0 N--CA 1.469 0.492 0 N-CA-C 114.361 1.245 . . . . 0.0 114.361 -173.916 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 62.5 mt -58.26 -32.53 68.46 Favored 'General case' 0 N--CA 1.47 0.526 0 O-C-N 121.633 -0.667 . . . . 0.0 111.675 173.203 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 84.6 t80 -66.21 -29.68 70.0 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 124.379 1.072 . . . . 0.0 113.685 172.754 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 89.0 mt-30 -81.23 -32.25 33.49 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 124.08 0.952 . . . . 0.0 111.07 174.636 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 8.4 mp -62.88 -42.67 99.85 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 123.437 0.695 . . . . 0.0 111.491 167.75 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 29.4 tt0 -62.64 -25.02 67.91 Favored 'General case' 0 CA--C 1.545 0.766 0 N-CA-C 113.532 0.938 . . . . 0.0 113.532 -177.357 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 24.8 t30 -55.03 -27.51 45.05 Favored 'General case' 0 CA--C 1.547 0.827 0 C-N-CA 124.281 1.032 . . . . 0.0 113.22 173.805 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 97.8 m-85 -97.58 0.87 48.14 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 125.443 1.497 . . . . 0.0 114.487 -176.458 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 65.2 m . . . . . 0 N--CA 1.474 0.726 0 O-C-N 121.369 -0.832 . . . . 0.0 112.818 174.261 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 52.3 p-10 . . . . . 0 CA--C 1.543 0.704 0 N-CA-C 112.975 0.732 . . . . 0.0 112.975 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 41.3 mt-30 -151.05 161.34 42.91 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 125.532 1.533 . . . . 0.0 110.845 -167.018 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 98.4 m-70 -89.85 128.72 36.23 Favored 'General case' 0 CA--C 1.54 0.57 0 N-CA-C 109.297 -0.631 . . . . 0.0 109.297 159.691 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 90.8 mt -141.1 126.6 18.82 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 125.246 1.418 . . . . 0.0 109.577 -172.653 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 39.9 m -128.65 135.9 49.93 Favored 'General case' 0 N--CA 1.466 0.334 0 C-N-CA 124.516 1.126 . . . . 0.0 110.967 -175.218 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 49.68 -117.02 4.19 Favored Glycine 0 CA--C 1.529 0.916 0 C-N-CA 125.415 1.484 . . . . 0.0 113.694 168.365 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 22.3 m -59.56 -32.92 70.79 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 124.609 1.164 . . . . 0.0 112.931 -179.389 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 94.0 m-70 -72.26 -37.64 69.04 Favored 'General case' 0 CA--C 1.539 0.547 0 O-C-N 121.23 -0.919 . . . . 0.0 111.423 177.129 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 59.8 tp -67.11 -43.12 83.26 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 123.155 0.582 . . . . 0.0 110.99 171.981 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 40.4 t -60.17 -42.76 91.32 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.907 0 C-N-CA 124.335 1.054 . . . . 0.0 111.915 175.589 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -63.42 -47.31 82.5 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 123.65 0.78 . . . . 0.0 111.337 173.717 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.6 -42.83 99.42 Favored 'General case' 0 CA--C 1.541 0.606 0 O-C-N 121.303 -0.873 . . . . 0.0 112.446 178.439 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 28.7 mt -57.75 -50.56 72.83 Favored 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 124.124 0.969 . . . . 0.0 110.931 174.453 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 80.5 t80 -55.94 -41.16 74.21 Favored 'General case' 0 CA--C 1.541 0.632 0 N-CA-C 112.997 0.74 . . . . 0.0 112.997 175.007 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 88.2 mt -73.8 -35.97 64.97 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 123.834 0.854 . . . . 0.0 113.234 179.73 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 26.1 t -66.96 -44.29 88.67 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.948 0 C-N-CA 124.687 1.195 . . . . 0.0 110.542 173.84 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 71.0 m -77.62 -32.15 53.3 Favored 'General case' 0 CA--C 1.537 0.449 0 N-CA-C 112.803 0.668 . . . . 0.0 112.803 -176.235 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 68.62 -113.88 5.57 Favored Glycine 0 CA--C 1.529 0.926 0 C-N-CA 124.406 1.003 . . . . 0.0 111.814 173.055 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 37.6 mm-40 -71.09 -21.55 62.21 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 123.853 0.861 . . . . 0.0 112.711 174.882 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 83.6 mtm180 -75.18 155.49 36.86 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 124.923 1.289 . . . . 0.0 111.215 174.534 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . -74.89 179.63 44.37 Favored Glycine 0 CA--C 1.53 1.017 0 C-N-CA 124.246 0.927 . . . . 0.0 111.253 168.087 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 32.2 p90 -154.42 171.24 19.65 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 124.416 1.086 . . . . 0.0 112.61 -177.255 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 76.9 t80 . . . . . 0 CA--C 1.539 0.544 0 C-N-CA 125.348 1.459 . . . . 0.0 111.582 178.59 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 54.8 t . . . . . 0 N--CA 1.48 1.066 0 CA-C-O 119.17 -0.443 . . . . 0.0 110.782 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -62.77 -43.99 97.35 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 118.705 0.684 . . . . 0.0 110.572 178.925 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 16.9 tt0 -56.78 -55.68 31.24 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 123.961 0.904 . . . . 0.0 111.25 175.44 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -80.03 -16.92 54.08 Favored 'General case' 0 CA--C 1.541 0.608 0 N-CA-C 114.558 1.318 . . . . 0.0 114.558 -172.209 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 38.4 t -99.33 -50.47 4.11 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 124.127 0.971 . . . . 0.0 112.513 -176.817 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 29.8 m -78.99 -39.83 33.16 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 124.611 1.164 . . . . 0.0 110.726 -178.059 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 10.5 t -104.24 -154.54 0.51 Allowed 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 124.236 1.014 . . . . 0.0 109.908 159.419 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 29.8 pt -112.4 161.47 11.17 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.651 0 C-N-CA 126.117 1.767 . . . . 0.0 111.595 175.953 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 1.6 p -147.08 169.34 19.46 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 123.457 0.703 . . . . 0.0 112.477 165.015 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 70.5 m -112.32 154.19 26.07 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 124.048 0.939 . . . . 0.0 112.956 -170.104 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 62.2 mt -59.09 -29.95 67.73 Favored 'General case' 0 N--CA 1.468 0.456 0 O-C-N 121.197 -0.94 . . . . 0.0 112.189 176.757 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 79.2 t80 -67.48 -26.37 66.33 Favored 'General case' 0 CA--C 1.545 0.77 0 N-CA-C 113.889 1.07 . . . . 0.0 113.889 171.97 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 59.9 mt-30 -77.85 -40.43 40.23 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 123.517 0.727 . . . . 0.0 109.655 171.719 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 9.2 mp -57.47 -39.93 77.45 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 118.401 0.546 . . . . 0.0 111.459 169.571 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -64.7 -37.35 87.31 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 124.307 1.043 . . . . 0.0 112.34 175.854 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 21.8 t30 -66.76 -27.63 67.75 Favored 'General case' 0 CA--C 1.545 0.762 0 O-C-N 121.213 -0.929 . . . . 0.0 112.732 172.721 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 18.9 m-85 -85.31 -4.02 59.02 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 125.14 1.376 . . . . 0.0 113.638 177.699 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 79.2 m . . . . . 0 CA--C 1.541 0.619 0 O-C-N 120.8 -1.188 . . . . 0.0 112.718 172.596 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 5.4 p-10 . . . . . 0 N--CA 1.469 0.513 0 CA-C-O 120.671 0.272 . . . . 0.0 111.618 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 38.9 mt-30 -149.25 163.63 37.1 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 124.429 1.091 . . . . 0.0 111.045 -171.625 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 96.0 m-70 -88.49 126.38 35.22 Favored 'General case' 0 CA--C 1.542 0.641 0 N-CA-C 107.991 -1.114 . . . . 0.0 107.991 154.411 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 85.1 mt -136.64 129.21 30.38 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 125.383 1.473 . . . . 0.0 109.008 -179.979 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 60.2 m -131.67 137.09 48.17 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 124.434 1.094 . . . . 0.0 110.788 -173.614 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 49.37 -120.23 7.21 Favored Glycine 0 N--CA 1.47 0.935 0 C-N-CA 125.06 1.315 . . . . 0.0 113.897 169.648 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 26.9 m -59.28 -31.3 68.99 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 124.81 1.244 . . . . 0.0 112.668 -178.167 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 96.8 m-70 -73.35 -35.96 66.07 Favored 'General case' 0 CA--C 1.541 0.603 0 O-C-N 121.317 -0.864 . . . . 0.0 111.561 177.697 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 32.9 tp -70.3 -40.8 74.04 Favored 'General case' 0 CA--C 1.536 0.44 0 O-C-N 121.667 -0.646 . . . . 0.0 111.392 171.237 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 56.1 t -58.61 -43.48 87.46 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.159 0 C-N-CA 123.569 0.748 . . . . 0.0 111.546 173.093 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -64.41 -45.92 85.48 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 123.703 0.801 . . . . 0.0 111.572 175.194 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.06 -44.31 96.95 Favored 'General case' 0 CA--C 1.541 0.606 0 O-C-N 121.592 -0.693 . . . . 0.0 112.141 178.438 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 34.5 mt -58.51 -48.13 81.82 Favored 'General case' 0 N--CA 1.464 0.253 0 C-N-CA 124.264 1.025 . . . . 0.0 110.876 174.257 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 90.7 t80 -57.63 -38.9 75.78 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-N 118.821 0.737 . . . . 0.0 112.495 175.465 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 84.6 mt -75.78 -36.75 59.71 Favored 'General case' 0 CA--C 1.538 0.483 0 N-CA-C 113.405 0.891 . . . . 0.0 113.405 179.573 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 55.2 t -70.74 -40.4 76.8 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.007 0 C-N-CA 123.695 0.798 . . . . 0.0 110.954 175.796 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 63.3 m -92.95 -23.81 18.6 Favored 'General case' 0 N--CA 1.471 0.604 0 N-CA-C 114.465 1.283 . . . . 0.0 114.465 -172.911 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 63.15 -142.26 47.25 Favored Glycine 0 CA--C 1.531 1.087 0 C-N-CA 124.118 0.866 . . . . 0.0 112.365 -175.829 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -63.52 -12.9 35.97 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 125.626 1.57 . . . . 0.0 114.46 -177.459 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 75.2 mtp180 -59.57 -38.81 82.13 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 124.28 1.032 . . . . 0.0 113.128 178.752 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 82.1 -179.62 53.19 Favored Glycine 0 CA--C 1.536 1.358 0 C-N-CA 124.484 1.04 . . . . 0.0 112.193 -161.994 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 34.9 p90 -157.74 157.92 34.33 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 124.339 1.056 . . . . 0.0 113.653 -169.945 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 81.5 t80 . . . . . 0 CA--C 1.537 0.47 0 C-N-CA 126.084 1.754 . . . . 0.0 110.84 166.187 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 60.0 t . . . . . 0 N--CA 1.475 0.823 0 CA-C-O 119.922 -0.085 . . . . 0.0 111.05 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 35.7 mm-40 -71.94 -44.75 63.09 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-O 118.684 -0.674 . . . . 0.0 111.041 173.281 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 5.5 tt0 -59.43 -53.6 56.33 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 119.253 0.933 . . . . 0.0 111.281 -178.914 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 57.2 m -60.17 -27.6 67.24 Favored 'General case' 0 CA--C 1.535 0.395 0 N-CA-C 113.793 1.035 . . . . 0.0 113.793 -177.571 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 24.9 t -102.37 -41.0 6.48 Favored 'General case' 0 CA--C 1.538 0.508 0 N-CA-C 113.622 0.971 . . . . 0.0 113.622 -170.772 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 59.4 p -84.62 -25.55 28.49 Favored 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 124.166 0.986 . . . . 0.0 112.683 176.989 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 79.8 p -126.06 -139.54 0.27 Allowed 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 125.669 1.588 . . . . 0.0 109.194 166.369 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 38.4 pt -123.46 161.4 25.56 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.524 0 C-N-CA 125.017 1.327 . . . . 0.0 110.844 177.184 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 29.0 p -141.54 156.04 45.74 Favored 'General case' 0 C--O 1.237 0.422 0 C-N-CA 123.354 0.662 . . . . 0.0 112.67 172.421 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 58.5 p -96.42 160.55 14.35 Favored 'General case' 0 N--CA 1.467 0.377 0 N-CA-C 113.343 0.868 . . . . 0.0 113.343 -176.314 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 65.7 mt -61.76 -33.38 73.96 Favored 'General case' 0 CA--C 1.539 0.522 0 O-C-N 121.366 -0.834 . . . . 0.0 111.843 173.066 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 89.5 t80 -66.68 -32.12 73.22 Favored 'General case' 0 CA--C 1.543 0.702 0 N-CA-C 113.066 0.765 . . . . 0.0 113.066 172.665 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 80.4 mt-30 -73.12 -37.76 66.55 Favored 'General case' 0 N--CA 1.466 0.352 0 O-C-N 121.442 -0.786 . . . . 0.0 111.186 171.671 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 46.5 mt -60.4 -40.01 89.4 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 119.413 1.006 . . . . 0.0 111.227 169.824 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -63.98 -40.12 95.68 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 124.285 1.034 . . . . 0.0 112.316 176.16 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 18.5 t30 -60.98 -28.57 69.1 Favored 'General case' 0 CA--C 1.548 0.873 0 O-C-N 121.226 -0.921 . . . . 0.0 112.797 174.538 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 22.4 m-85 -92.38 4.15 53.99 Favored 'General case' 0 CA--C 1.547 0.827 0 C-N-CA 125.063 1.345 . . . . 0.0 114.316 177.438 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 83.4 m . . . . . 0 N--CA 1.471 0.617 0 O-C-N 120.737 -1.227 . . . . 0.0 112.526 166.327 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 12.7 m-80 . . . . . 0 CA--C 1.536 0.431 0 CA-C-O 120.905 0.383 . . . . 0.0 111.638 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 41.0 mt-30 -147.15 160.35 42.54 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 124.834 1.254 . . . . 0.0 111.283 -178.528 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 92.8 m-70 -79.97 130.1 35.01 Favored 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 108.399 -0.963 . . . . 0.0 108.399 153.139 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 88.4 mt -143.36 126.21 16.17 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 125.213 1.405 . . . . 0.0 109.661 -176.892 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 66.4 m -135.41 144.15 46.36 Favored 'General case' 0 N--CA 1.468 0.428 0 C-N-CA 125.337 1.455 . . . . 0.0 110.35 -178.034 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 55.4 -124.55 33.59 Favored Glycine 0 N--CA 1.473 1.102 0 C-N-CA 124.495 1.045 . . . . 0.0 113.953 165.843 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 22.5 p -59.02 -37.12 76.19 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 124.765 1.226 . . . . 0.0 112.755 179.064 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 26.3 m80 -67.36 -38.77 85.31 Favored 'General case' 0 CA--C 1.54 0.576 0 O-C-N 121.171 -0.956 . . . . 0.0 111.577 177.219 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 51.5 tp -68.92 -43.24 75.54 Favored 'General case' 0 N--CA 1.465 0.325 0 O-C-N 121.667 -0.646 . . . . 0.0 111.388 173.387 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 6.4 t -56.88 -43.74 80.86 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.908 0 C-N-CA 124.463 1.105 . . . . 0.0 111.393 174.369 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 30.2 mm-40 -66.75 -44.56 81.15 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 124.1 0.96 . . . . 0.0 111.979 175.169 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -63.43 -45.1 92.49 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-N 118.969 0.804 . . . . 0.0 112.32 179.652 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 40.8 mt -57.44 -52.33 65.83 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 124.145 0.978 . . . . 0.0 110.408 172.058 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 87.9 t80 -55.8 -38.76 70.38 Favored 'General case' 0 CA--C 1.546 0.813 0 CA-C-N 119.321 0.964 . . . . 0.0 113.268 176.989 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 74.2 mt -72.2 -36.14 69.11 Favored 'General case' 0 N--CA 1.47 0.545 0 N-CA-C 113.224 0.824 . . . . 0.0 113.224 178.085 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 58.3 t -74.01 -38.73 49.93 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.133 0 C-N-CA 123.365 0.666 . . . . 0.0 111.53 175.307 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 60.8 m -90.34 -22.75 21.37 Favored 'General case' 0 N--CA 1.473 0.689 0 N-CA-C 114.666 1.358 . . . . 0.0 114.666 -172.906 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 65.99 -145.2 47.65 Favored Glycine 0 CA--C 1.532 1.129 0 C-N-CA 124.171 0.891 . . . . 0.0 112.202 -173.66 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -67.21 -12.37 59.88 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 124.602 1.161 . . . . 0.0 114.044 -178.642 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 76.2 mtp85 -63.85 -33.87 76.67 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 124.17 0.988 . . . . 0.0 113.235 178.832 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 77.01 -170.42 55.13 Favored Glycine 0 CA--C 1.531 1.033 0 C-N-CA 124.476 1.036 . . . . 0.0 113.096 -170.747 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 45.9 p90 -154.66 170.66 21.02 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 125.079 1.352 . . . . 0.0 112.729 -169.109 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 43.3 p90 . . . . . 0 CA--C 1.542 0.667 0 C-N-CA 125.263 1.425 . . . . 0.0 111.042 169.011 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 38.3 t . . . . . 0 N--CA 1.48 1.067 0 N-CA-C 111.793 0.294 . . . . 0.0 111.793 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -68.72 -8.65 44.71 Favored 'General case' 0 CA--C 1.545 0.764 0 N-CA-C 114.5 1.296 . . . . 0.0 114.5 178.379 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 71.5 tp60 -101.46 -55.74 2.46 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 124.191 0.996 . . . . 0.0 110.101 168.695 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 72.5 m -68.66 -28.69 67.1 Favored 'General case' 0 N--CA 1.468 0.436 0 N-CA-C 115.084 1.513 . . . . 0.0 115.084 -171.483 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 22.1 t -90.34 -45.2 9.18 Favored 'General case' 0 N--CA 1.476 0.839 0 N-CA-C 112.989 0.737 . . . . 0.0 112.989 -167.055 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 18.2 p -89.07 -53.97 4.33 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 126.001 1.721 . . . . 0.0 110.986 -177.785 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.9 t -87.69 -160.6 0.63 Allowed 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 124.65 1.18 . . . . 0.0 110.535 164.523 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 2.1 pp -105.03 167.81 2.79 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.535 0 C-N-CA 124.728 1.211 . . . . 0.0 111.98 175.494 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 20.5 p -147.99 160.09 43.2 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 123.71 0.804 . . . . 0.0 112.198 166.576 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 12.5 m -106.57 154.57 20.7 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 124.419 1.088 . . . . 0.0 111.988 -171.488 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 30.4 mt -61.32 -33.45 73.63 Favored 'General case' 0 N--CA 1.47 0.531 0 O-C-N 121.346 -0.846 . . . . 0.0 112.026 178.896 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 59.3 m-85 -60.73 -32.45 71.72 Favored 'General case' 0 CA--C 1.541 0.609 0 N-CA-C 113.565 0.95 . . . . 0.0 113.565 171.976 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 21.3 mm100 -81.6 -31.79 32.34 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 124.373 1.069 . . . . 0.0 110.992 176.707 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 64.1 mt -64.85 -37.73 88.62 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-N 119.23 0.923 . . . . 0.0 111.692 169.186 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 26.7 tt0 -63.07 -27.05 69.13 Favored 'General case' 0 CA--C 1.546 0.825 0 N-CA-C 113.194 0.813 . . . . 0.0 113.194 179.245 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 25.1 t30 -58.73 -24.88 62.32 Favored 'General case' 0 CA--C 1.547 0.841 0 O-C-N 121.103 -0.998 . . . . 0.0 112.91 172.963 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 85.7 m-85 -102.7 9.36 39.23 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 126.074 1.749 . . . . 0.0 113.464 -178.726 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 69.1 m . . . . . 0 CA--C 1.539 0.551 0 O-C-N 120.916 -1.115 . . . . 0.0 111.558 164.337 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 7.3 p30 . . . . . 0 CA--C 1.536 0.42 0 CA-C-O 120.768 0.318 . . . . 0.0 110.773 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 49.4 mm-40 -153.72 163.56 39.81 Favored 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 123.842 0.857 . . . . 0.0 111.882 -162.787 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 99.2 m-70 -78.86 129.28 34.39 Favored 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 109.088 -0.708 . . . . 0.0 109.088 161.823 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 79.6 mt -144.97 132.64 20.99 Favored 'General case' 0 N--CA 1.465 0.294 0 C-N-CA 125.743 1.617 . . . . 0.0 109.079 -174.674 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 2.7 t -153.16 152.96 31.84 Favored 'General case' 0 N--CA 1.467 0.382 0 O-C-N 121.488 -0.757 . . . . 0.0 111.893 -176.898 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 49.69 -126.05 19.89 Favored Glycine 0 N--CA 1.47 0.954 0 C-N-CA 124.794 1.188 . . . . 0.0 113.596 177.751 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 15.1 m -60.28 -31.53 70.32 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 124.765 1.226 . . . . 0.0 112.761 -179.637 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 98.2 m-70 -73.87 -35.53 64.74 Favored 'General case' 0 CA--C 1.539 0.537 0 O-C-N 120.994 -1.066 . . . . 0.0 111.667 178.18 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 33.9 tp -68.81 -43.26 75.96 Favored 'General case' 0 N--CA 1.467 0.405 0 O-C-N 121.485 -0.759 . . . . 0.0 110.753 171.844 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 50.6 t -58.54 -41.38 81.76 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.018 0 C-N-CA 123.81 0.844 . . . . 0.0 111.595 173.249 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -66.26 -44.4 83.73 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 123.885 0.874 . . . . 0.0 112.295 175.336 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.66 -44.72 96.42 Favored 'General case' 0 CA--C 1.54 0.578 0 O-C-N 121.614 -0.679 . . . . 0.0 112.088 177.171 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 30.3 mt -56.16 -50.89 69.88 Favored 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 124.204 1.002 . . . . 0.0 111.169 172.177 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 67.5 t80 -56.24 -40.53 74.28 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 113.081 0.771 . . . . 0.0 113.081 176.017 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 89.7 mt -76.99 -33.5 57.58 Favored 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 113.546 0.943 . . . . 0.0 113.546 -179.408 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 38.7 t -69.95 -44.74 78.34 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.879 0 C-N-CA 124.189 0.995 . . . . 0.0 110.828 173.033 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 76.2 m -85.25 -33.18 22.24 Favored 'General case' 0 N--CA 1.466 0.371 0 N-CA-C 113.4 0.889 . . . . 0.0 113.4 -172.76 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 64.44 -135.25 39.06 Favored Glycine 0 CA--C 1.531 1.071 0 C-N-CA 124.229 0.919 . . . . 0.0 111.659 -177.928 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 30.0 tt0 -64.5 -16.81 63.16 Favored 'General case' 0 CA--C 1.549 0.906 0 C-N-CA 124.9 1.28 . . . . 0.0 113.503 -179.511 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 82.6 mtm180 -61.06 -32.51 72.15 Favored 'General case' 0 N--CA 1.473 0.69 0 N-CA-C 113.642 0.979 . . . . 0.0 113.642 179.965 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 85.39 173.36 49.64 Favored Glycine 0 CA--C 1.533 1.175 0 C-N-CA 124.748 1.166 . . . . 0.0 112.21 -169.388 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 51.1 p90 -159.0 166.81 30.92 Favored 'General case' 0 N--CA 1.47 0.545 0 N-CA-C 113.886 1.069 . . . . 0.0 113.886 -170.432 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 31.3 m-85 . . . . . 0 CA--C 1.541 0.608 0 C-N-CA 127.078 2.151 . . . . 0.0 110.711 178.467 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 4.5 t . . . . . 0 N--CA 1.48 1.059 0 N-CA-C 112.252 0.464 . . . . 0.0 112.252 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -74.3 -11.05 60.16 Favored 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 113.856 1.058 . . . . 0.0 113.856 -179.69 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 60.5 tp60 -98.74 -53.61 3.25 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 123.811 0.844 . . . . 0.0 109.8 166.268 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 32.9 m -61.37 -33.54 73.82 Favored 'General case' 0 N--CA 1.466 0.333 0 N-CA-C 114.542 1.312 . . . . 0.0 114.542 -171.242 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 23.6 t -91.98 -41.92 10.29 Favored 'General case' 0 CA--C 1.537 0.448 0 O-C-N 121.955 -0.465 . . . . 0.0 111.681 -176.632 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 21.4 m -69.27 -34.77 75.26 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 126.409 1.884 . . . . 0.0 112.532 179.942 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 11.6 t -145.14 -162.56 1.53 Allowed 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 125.525 1.53 . . . . 0.0 110.593 -178.287 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 82.1 mt -80.76 135.93 24.24 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.614 0 O-C-N 120.691 -1.255 . . . . 0.0 109.958 172.38 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 21.0 p -119.13 157.2 28.37 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-O 121.718 0.77 . . . . 0.0 111.255 161.641 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 62.2 m -102.97 153.9 19.76 Favored 'General case' 0 N--CA 1.466 0.36 0 C-N-CA 123.659 0.784 . . . . 0.0 112.726 -173.86 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 57.1 mt -59.96 -32.73 71.08 Favored 'General case' 0 N--CA 1.467 0.416 0 O-C-N 121.388 -0.82 . . . . 0.0 112.034 178.995 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 84.6 m-85 -67.55 -29.08 68.37 Favored 'General case' 0 CA--C 1.54 0.594 0 N-CA-C 113.909 1.077 . . . . 0.0 113.909 172.962 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 92.6 mt-30 -75.87 -39.87 55.64 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 123.707 0.803 . . . . 0.0 110.292 172.829 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 94.2 mt -58.54 -41.31 85.24 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-N 118.454 0.57 . . . . 0.0 110.964 170.127 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -65.28 -40.48 93.91 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 124.575 1.15 . . . . 0.0 112.174 177.27 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 35.1 t30 -63.72 -23.88 67.55 Favored 'General case' 0 CA--C 1.548 0.903 0 O-C-N 121.246 -0.909 . . . . 0.0 112.69 172.949 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -90.05 3.95 51.74 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 125.587 1.555 . . . . 0.0 114.658 175.976 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 83.1 m . . . . . 0 CA--C 1.541 0.605 0 C-N-CA 123.533 0.733 . . . . 0.0 112.807 169.718 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 15.2 m-20 . . . . . 0 CA--C 1.544 0.727 0 CA-C-O 121.021 0.439 . . . . 0.0 111.983 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 68.4 mm-40 -152.19 166.87 30.38 Favored 'General case' 0 N--CA 1.471 0.604 0 O-C-N 121.232 -0.918 . . . . 0.0 113.068 -158.462 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 17.5 m-70 -78.6 133.46 37.29 Favored 'General case' 0 CA--C 1.544 0.741 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 154.915 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 77.7 mt -145.83 127.39 15.11 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 126.743 2.017 . . . . 0.0 109.137 -176.009 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 84.2 m -132.74 147.41 52.32 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 124.629 1.172 . . . . 0.0 110.696 -177.683 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 55.39 -128.26 43.93 Favored Glycine 0 N--CA 1.469 0.876 0 C-N-CA 124.832 1.206 . . . . 0.0 113.965 165.474 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 14.3 m -58.42 -34.22 70.54 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 124.395 1.078 . . . . 0.0 112.641 179.916 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 79.2 m-70 -77.44 -27.06 52.04 Favored 'General case' 0 CA--C 1.54 0.562 0 O-C-N 121.292 -0.88 . . . . 0.0 112.918 177.566 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 38.9 tp -71.85 -43.4 65.57 Favored 'General case' 0 N--CA 1.47 0.567 0 O-C-N 121.135 -0.978 . . . . 0.0 111.124 167.386 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 42.1 t -57.8 -41.64 80.19 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.992 0 C-N-CA 123.556 0.743 . . . . 0.0 111.603 172.971 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 44.2 tt0 -62.33 -49.32 76.07 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 125.395 1.478 . . . . 0.0 111.822 173.324 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -63.46 -45.19 91.96 Favored 'General case' 0 CA--C 1.541 0.606 0 O-C-N 121.681 -0.637 . . . . 0.0 112.391 -179.269 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 52.0 mt -54.45 -56.37 19.4 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 124.135 0.974 . . . . 0.0 110.392 171.95 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 74.0 t80 -52.9 -41.38 64.34 Favored 'General case' 0 CA--C 1.542 0.669 0 N-CA-C 113.371 0.878 . . . . 0.0 113.371 177.38 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 86.3 mt -73.46 -34.53 65.43 Favored 'General case' 0 CA--C 1.537 0.479 0 N-CA-C 113.884 1.068 . . . . 0.0 113.884 179.569 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 54.2 t -72.25 -39.97 64.94 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.049 0 CA-C-N 118.7 0.682 . . . . 0.0 110.834 173.417 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 73.4 m -79.85 -28.68 40.03 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 124.38 1.072 . . . . 0.0 113.72 -176.089 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 65.1 -111.43 4.18 Favored Glycine 0 CA--C 1.528 0.899 0 C-N-CA 124.472 1.035 . . . . 0.0 112.082 175.504 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -71.93 -21.0 61.67 Favored 'General case' 0 CA--C 1.544 0.73 0 N-CA-C 113.82 1.045 . . . . 0.0 113.82 175.101 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 84.6 mtp180 -78.63 157.79 28.59 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 124.752 1.221 . . . . 0.0 111.272 175.449 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . -81.83 -167.23 38.85 Favored Glycine 0 CA--C 1.529 0.921 0 C-N-CA 124.092 0.853 . . . . 0.0 111.778 170.676 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 43.7 p90 -156.64 152.17 26.82 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 125.384 1.474 . . . . 0.0 112.162 178.067 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 58.9 m-85 . . . . . 0 CA--C 1.543 0.698 0 N-CA-C 114.313 1.227 . . . . 0.0 114.313 -172.414 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 61.4 t . . . . . 0 N--CA 1.48 1.07 0 CA-C-O 119.614 -0.231 . . . . 0.0 111.562 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -72.49 -45.49 59.19 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 118.499 0.591 . . . . 0.0 110.311 173.404 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 70.6 tp60 -59.88 -47.76 84.43 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 123.127 0.571 . . . . 0.0 111.745 178.979 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 73.1 m -72.0 -30.86 65.67 Favored 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 114.794 1.405 . . . . 0.0 114.794 -177.778 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 22.3 t -103.46 -41.77 5.89 Favored 'General case' 0 N--CA 1.47 0.574 0 N-CA-C 113.711 1.004 . . . . 0.0 113.711 -169.638 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 33.8 m -81.93 -38.01 25.9 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 124.127 0.971 . . . . 0.0 110.911 177.591 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 11.0 t -111.35 -152.58 0.5 Allowed 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 125.055 1.342 . . . . 0.0 110.422 166.073 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 45.3 pt -108.81 158.43 8.64 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.543 0 C-N-CA 125.474 1.51 . . . . 0.0 111.104 170.388 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 21.1 p -137.86 156.09 48.28 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 123.791 0.836 . . . . 0.0 112.588 171.233 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 59.7 p -93.56 165.41 12.75 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 124.456 1.103 . . . . 0.0 112.979 173.942 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 72.7 mt -63.61 -34.05 76.96 Favored 'General case' 0 CA--C 1.537 0.454 0 O-C-N 121.369 -0.832 . . . . 0.0 111.798 171.976 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 91.4 t80 -64.07 -34.97 79.24 Favored 'General case' 0 CA--C 1.544 0.721 0 O-C-N 121.598 -0.689 . . . . 0.0 112.687 171.893 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 91.4 mt-30 -73.77 -32.91 64.04 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-O 118.537 -0.744 . . . . 0.0 112.218 174.022 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 92.4 mt -57.96 -48.84 78.75 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-N 119.612 1.096 . . . . 0.0 110.283 165.989 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 29.3 tt0 -63.75 -30.83 71.88 Favored 'General case' 0 CA--C 1.544 0.74 0 N-CA-C 113.338 0.866 . . . . 0.0 113.338 179.904 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 18.0 t30 -60.29 -27.76 67.55 Favored 'General case' 0 CA--C 1.544 0.74 0 O-C-N 121.131 -0.981 . . . . 0.0 113.231 178.346 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 40.8 m-85 -93.96 8.04 42.83 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 125.604 1.561 . . . . 0.0 113.223 176.071 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 56.2 m . . . . . 0 CA--C 1.541 0.628 0 C-N-CA 125.51 1.524 . . . . 0.0 112.619 174.713 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.537 0.471 0 CA-C-O 120.614 0.245 . . . . 0.0 111.394 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 21.5 mm100 -146.28 163.94 33.92 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 124.542 1.137 . . . . 0.0 111.244 -159.81 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 96.7 m-70 -80.79 131.75 35.44 Favored 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 108.885 -0.783 . . . . 0.0 108.885 157.743 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 77.0 mt -144.37 128.58 17.73 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 125.878 1.671 . . . . 0.0 108.895 -178.937 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 85.4 m -137.08 148.0 46.45 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 125.067 1.347 . . . . 0.0 110.569 -177.614 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 56.03 -128.54 45.78 Favored Glycine 0 CA--C 1.531 1.047 0 C-N-CA 124.762 1.172 . . . . 0.0 114.245 165.095 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 25.5 p -56.54 -42.78 79.08 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 124.524 1.129 . . . . 0.0 112.599 179.935 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 73.4 m-70 -70.57 -29.61 66.1 Favored 'General case' 0 CA--C 1.541 0.616 0 O-C-N 121.142 -0.974 . . . . 0.0 113.304 176.473 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 55.0 tp -67.7 -47.14 70.25 Favored 'General case' 0 N--CA 1.469 0.507 0 O-C-N 121.299 -0.876 . . . . 0.0 111.215 169.265 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 76.4 t -60.25 -39.62 81.26 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.016 0 C-N-CA 123.248 0.619 . . . . 0.0 111.211 175.931 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 44.3 tt0 -62.02 -50.06 73.57 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 125.464 1.506 . . . . 0.0 111.594 174.759 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -63.94 -45.36 89.53 Favored 'General case' 0 N--CA 1.469 0.501 0 O-C-N 121.628 -0.67 . . . . 0.0 112.066 178.985 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 33.5 tp -60.12 -44.56 94.78 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 124.722 1.209 . . . . 0.0 111.234 177.133 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 74.4 t80 -61.65 -37.36 83.72 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 124.126 0.97 . . . . 0.0 113.011 171.359 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 65.5 mt -71.11 -28.38 64.26 Favored 'General case' 0 N--CA 1.471 0.602 0 O-C-N 120.754 -1.216 . . . . 0.0 113.1 177.396 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 96.7 t -80.6 -39.74 18.7 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.152 0 C-N-CA 123.703 0.801 . . . . 0.0 111.478 173.283 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 72.6 m -124.06 -1.02 8.31 Favored 'General case' 0 N--CA 1.479 0.987 0 N-CA-C 116.281 1.956 . . . . 0.0 116.281 -162.216 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . -63.0 -22.15 64.45 Favored Glycine 0 N--CA 1.476 1.308 0 CA-C-N 119.707 1.14 . . . . 0.0 115.837 -165.167 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 35.2 mm-40 -74.47 -23.91 58.96 Favored 'General case' 0 CA--C 1.547 0.837 0 CA-C-N 118.416 1.108 . . . . 0.0 112.897 172.574 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 74.3 mtt180 -102.48 -39.36 7.16 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 125.857 1.663 . . . . 0.0 113.132 -177.503 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 99.97 148.49 22.72 Favored Glycine 0 CA--C 1.534 1.278 0 C-N-CA 125.775 1.655 . . . . 0.0 112.159 -166.694 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 39.8 p90 -133.49 167.88 19.64 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 125.288 1.435 . . . . 0.0 113.238 -175.053 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 98.1 m-85 . . . . . 0 CA--C 1.538 0.515 0 C-N-CA 125.89 1.676 . . . . 0.0 110.713 173.734 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 27.2 t . . . . . 0 N--CA 1.482 1.166 0 N-CA-C 112.449 0.537 . . . . 0.0 112.449 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 3.5 pm0 -72.15 -5.17 33.65 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 125.37 1.468 . . . . 0.0 113.957 -177.789 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 57.1 tp60 -104.18 -53.93 2.64 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 124.508 1.123 . . . . 0.0 110.076 165.849 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 1.8 t -81.12 -17.73 48.9 Favored 'General case' 0 N--CA 1.469 0.477 0 N-CA-C 114.67 1.359 . . . . 0.0 114.67 -165.457 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 27.4 t -87.93 -37.48 16.39 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 123.231 0.612 . . . . 0.0 112.139 -179.947 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 16.7 p -88.94 -52.65 4.98 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 126.71 2.004 . . . . 0.0 111.363 -178.916 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 14.2 t -102.37 -149.91 0.4 Allowed 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 125.778 1.631 . . . . 0.0 109.889 168.044 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 48.0 pt -113.12 160.89 12.44 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.659 0 C-N-CA 125.165 1.386 . . . . 0.0 111.882 178.995 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 15.5 p -139.48 163.2 33.15 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 123.99 0.916 . . . . 0.0 112.108 164.358 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 6.9 t -108.25 162.02 14.47 Favored 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 124.214 1.006 . . . . 0.0 112.925 179.852 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 6.7 mp -61.69 -32.3 72.49 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 124.412 1.085 . . . . 0.0 110.783 176.542 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 86.1 m-85 -65.3 -25.85 67.81 Favored 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 113.45 0.907 . . . . 0.0 113.45 173.932 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 75.2 mt-30 -82.32 -38.79 23.77 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 124.408 1.083 . . . . 0.0 110.921 172.887 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 85.3 mt -59.75 -38.07 80.72 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 119.257 0.935 . . . . 0.0 111.364 170.349 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 -64.95 -21.47 66.84 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 124.778 1.231 . . . . 0.0 113.022 173.184 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 21.9 t30 -82.91 -28.47 29.93 Favored 'General case' 0 CA--C 1.547 0.843 0 O-C-N 121.06 -1.025 . . . . 0.0 112.995 172.419 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 23.5 m-85 -78.36 -23.31 46.98 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 124.133 0.973 . . . . 0.0 113.198 171.234 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 14.0 t . . . . . 0 N--CA 1.47 0.527 0 C-N-CA 124.537 1.135 . . . . 0.0 111.434 160.529 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.542 0.654 0 N-CA-C 112.228 0.455 . . . . 0.0 112.228 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 39.9 mt-30 -145.42 161.52 39.48 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 123.747 0.819 . . . . 0.0 111.769 -163.43 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 97.8 m-70 -81.29 130.57 35.09 Favored 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 108.45 -0.944 . . . . 0.0 108.45 157.235 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 89.8 mt -147.37 138.42 23.69 Favored 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 125.133 1.373 . . . . 0.0 108.501 -177.604 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 3.6 t -149.64 154.85 39.27 Favored 'General case' 0 C--O 1.236 0.351 0 O-C-N 121.575 -0.703 . . . . 0.0 112.25 -178.462 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 54.11 -129.81 43.23 Favored Glycine 0 CA--C 1.53 0.986 0 C-N-CA 125.711 1.624 . . . . 0.0 113.668 174.334 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 33.4 p -57.75 -40.19 79.13 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 124.41 1.084 . . . . 0.0 112.821 -179.621 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 73.7 m-70 -71.57 -28.99 64.22 Favored 'General case' 0 CA--C 1.54 0.585 0 O-C-N 120.951 -1.093 . . . . 0.0 113.108 178.308 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 45.7 tp -70.22 -44.73 67.98 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 119.037 0.835 . . . . 0.0 111.449 169.9 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 76.3 t -62.55 -37.99 80.29 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.056 0 C-N-CA 122.961 0.504 . . . . 0.0 111.558 174.932 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -62.37 -51.0 69.33 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 125.593 1.557 . . . . 0.0 111.149 173.95 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.88 -45.44 93.76 Favored 'General case' 0 CA--C 1.542 0.635 0 O-C-N 121.809 -0.557 . . . . 0.0 111.74 179.264 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 31.0 tp -59.44 -47.48 85.31 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 124.835 1.254 . . . . 0.0 111.228 176.762 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 56.2 t80 -58.24 -43.04 87.62 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 123.978 0.911 . . . . 0.0 113.109 172.304 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 77.1 mt -70.65 -34.45 72.05 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 113.154 0.798 . . . . 0.0 113.154 -179.502 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 41.2 t -70.27 -43.27 78.69 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.011 0 C-N-CA 123.787 0.835 . . . . 0.0 111.146 172.099 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 44.6 t -81.0 -30.23 35.01 Favored 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 114.394 1.257 . . . . 0.0 114.394 -173.157 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 67.93 -147.1 47.52 Favored Glycine 0 CA--C 1.533 1.173 0 C-N-CA 124.604 1.097 . . . . 0.0 112.348 -172.992 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -69.7 -13.57 62.36 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 124.879 1.271 . . . . 0.0 113.616 -177.744 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 40.6 mtp85 -59.05 -37.24 76.54 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 124.773 1.229 . . . . 0.0 113.948 -173.67 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 90.98 150.4 24.87 Favored Glycine 0 CA--C 1.536 1.365 0 C-N-CA 124.94 1.257 . . . . 0.0 113.515 -176.141 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 35.2 p90 -137.46 159.94 40.53 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 125.086 1.354 . . . . 0.0 112.605 -171.448 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 69.5 t80 . . . . . 0 CA--C 1.539 0.555 0 C-N-CA 124.811 1.245 . . . . 0.0 110.125 165.791 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 98.5 t . . . . . 0 N--CA 1.477 0.905 0 CA-C-O 118.411 -0.804 . . . . 0.0 111.425 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -57.86 -46.54 84.67 Favored 'General case' 0 N--CA 1.472 0.674 0 CA-C-N 119.894 1.225 . . . . 0.0 110.398 174.546 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 8.3 tp-100 -64.2 -56.31 15.6 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 124.051 0.94 . . . . 0.0 111.04 178.96 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 4.2 t -79.62 -15.12 58.19 Favored 'General case' 0 N--CA 1.469 0.518 0 N-CA-C 114.777 1.399 . . . . 0.0 114.777 -169.027 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 14.0 t -92.99 -31.09 15.01 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 123.602 0.761 . . . . 0.0 112.606 178.347 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 56.4 p -94.44 -43.2 8.48 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 124.076 0.95 . . . . 0.0 112.144 175.856 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 60.4 m -108.64 -140.69 0.38 Allowed 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 126.203 1.801 . . . . 0.0 109.162 167.486 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 30.2 pt -127.81 163.04 32.38 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.974 0 C-N-CA 124.945 1.298 . . . . 0.0 112.508 -174.96 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 18.7 p -145.76 165.71 28.02 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 125.399 1.479 . . . . 0.0 110.88 167.297 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 95.3 p -111.56 164.1 13.35 Favored 'General case' 0 N--CA 1.467 0.416 0 C-N-CA 124.474 1.11 . . . . 0.0 112.093 177.461 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 70.7 mt -59.64 -32.49 70.49 Favored 'General case' 0 CA--C 1.537 0.447 0 O-C-N 121.576 -0.703 . . . . 0.0 111.489 170.56 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 62.2 m-85 -69.69 -29.09 66.43 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 125.21 1.404 . . . . 0.0 113.047 175.541 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 16.8 mm100 -75.6 -39.65 57.64 Favored 'General case' 0 N--CA 1.467 0.419 0 O-C-N 121.703 -0.623 . . . . 0.0 111.339 168.873 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 87.5 mt -62.15 -34.63 76.75 Favored 'General case' 0 N--CA 1.473 0.702 0 CA-C-N 119.492 1.042 . . . . 0.0 111.693 172.558 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -61.19 -30.11 70.21 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 124.199 0.999 . . . . 0.0 112.335 174.6 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 13.8 t-20 -72.7 -22.56 60.88 Favored 'General case' 0 CA--C 1.548 0.892 0 O-C-N 121.401 -0.812 . . . . 0.0 112.857 175.394 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 27.8 m-85 -85.25 -9.56 57.58 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 124.833 1.253 . . . . 0.0 113.736 173.188 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 61.3 m . . . . . 0 CA--C 1.543 0.699 0 CA-C-N 119.543 1.065 . . . . 0.0 112.409 172.186 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 11.4 p30 . . . . . 0 CA--C 1.539 0.53 0 CA-C-O 121.304 0.573 . . . . 0.0 111.709 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 40.4 mt-30 -150.25 164.58 35.37 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.615 1.166 . . . . 0.0 111.09 -165.712 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 98.7 m-70 -86.78 132.54 33.82 Favored 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 108.462 -0.94 . . . . 0.0 108.462 153.527 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 89.2 mt -145.82 143.16 29.47 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 125.566 1.546 . . . . 0.0 108.767 -179.211 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 2.0 t -148.3 149.51 31.97 Favored 'General case' 0 N--CA 1.466 0.344 0 N-CA-C 112.608 0.595 . . . . 0.0 112.608 -173.185 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 44.2 -125.9 5.99 Favored Glycine 0 N--CA 1.471 1.006 0 C-N-CA 126.271 1.891 . . . . 0.0 114.349 173.641 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 19.8 m -60.13 -30.75 69.49 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 124.549 1.139 . . . . 0.0 113.021 -178.249 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 78.7 m-70 -78.63 -28.11 45.53 Favored 'General case' 0 CA--C 1.538 0.516 0 O-C-N 120.891 -1.131 . . . . 0.0 112.661 176.631 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 6.8 tt -68.21 -45.24 73.88 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 119.445 1.02 . . . . 0.0 110.644 165.884 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 73.3 t -57.56 -41.31 78.76 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.007 0 C-N-CA 123.631 0.772 . . . . 0.0 111.749 174.985 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 45.4 tt0 -61.56 -51.08 70.05 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 125.236 1.414 . . . . 0.0 111.279 174.293 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.43 -46.44 90.08 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 123.275 0.63 . . . . 0.0 111.547 179.09 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 51.5 tp -57.48 -53.52 57.19 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 126.185 1.794 . . . . 0.0 111.118 177.246 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 52.4 t80 -53.91 -43.56 69.81 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 123.656 0.783 . . . . 0.0 112.531 174.166 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 81.7 mt -70.24 -35.03 73.55 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 124.002 0.921 . . . . 0.0 113.065 179.726 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 37.1 t -65.09 -44.64 95.65 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.908 0 C-N-CA 124.369 1.068 . . . . 0.0 110.669 170.987 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 64.3 m -75.52 -28.61 59.18 Favored 'General case' 0 CA--C 1.541 0.607 0 N-CA-C 113.539 0.94 . . . . 0.0 113.539 -177.226 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 68.69 -116.5 7.43 Favored Glycine 0 CA--C 1.528 0.888 0 C-N-CA 124.646 1.117 . . . . 0.0 111.792 175.793 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 1.7 pm0 -73.21 -20.28 60.91 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 124.2 1.0 . . . . 0.0 113.474 174.196 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 76.9 mtp180 -74.32 147.27 42.42 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 124.227 1.011 . . . . 0.0 110.346 173.974 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . -76.78 -173.81 38.46 Favored Glycine 0 CA--C 1.53 1.013 0 C-N-CA 123.496 0.57 . . . . 0.0 111.937 167.607 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 42.8 p90 -149.01 153.74 38.32 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.192 0.997 . . . . 0.0 113.651 178.752 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 61.3 t80 . . . . . 0 CA--C 1.54 0.575 0 C-N-CA 125.394 1.478 . . . . 0.0 109.645 159.699 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 53.1 t . . . . . 0 N--CA 1.48 1.036 0 N-CA-C 112.608 0.596 . . . . 0.0 112.608 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -88.47 -43.45 11.44 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 118.568 0.622 . . . . 0.0 111.3 169.419 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 43.3 tp60 -63.91 -40.72 97.14 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 123.354 0.662 . . . . 0.0 112.725 -171.022 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 11.9 t -77.87 -13.39 59.9 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 118.953 0.797 . . . . 0.0 112.982 175.527 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 17.1 t -84.77 -40.08 17.67 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.05 0.94 . . . . 0.0 112.25 175.059 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 47.1 p -87.25 -48.41 8.04 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 124.937 1.295 . . . . 0.0 111.928 178.194 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 10.3 t -97.92 -146.89 0.31 Allowed 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 125.55 1.54 . . . . 0.0 109.996 166.753 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 31.0 pt -124.31 164.27 22.92 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.865 0 C-N-CA 125.915 1.686 . . . . 0.0 112.488 -177.522 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 19.7 p -149.26 173.33 13.6 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 125.264 1.425 . . . . 0.0 110.993 166.05 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 2.8 m -131.14 164.11 26.2 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 124.225 1.01 . . . . 0.0 111.473 -170.929 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 30.4 mt -62.33 -39.44 93.08 Favored 'General case' 0 N--CA 1.468 0.458 0 O-C-N 121.292 -0.88 . . . . 0.0 111.755 -175.521 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 20.2 p90 -65.68 -31.26 72.17 Favored 'General case' 0 N--CA 1.471 0.581 0 O-C-N 121.277 -0.889 . . . . 0.0 113.27 173.685 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 49.4 mt-30 -76.48 -31.16 57.6 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 123.475 0.71 . . . . 0.0 111.516 176.617 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 80.5 mt -66.52 -43.7 84.52 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 123.996 0.918 . . . . 0.0 111.062 168.459 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 31.8 tt0 -61.3 -23.64 65.84 Favored 'General case' 0 CA--C 1.547 0.83 0 N-CA-C 113.536 0.939 . . . . 0.0 113.536 -178.22 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 22.1 t30 -55.14 -28.43 52.68 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 124.404 1.082 . . . . 0.0 113.539 171.867 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 97.8 m-85 -93.35 5.71 50.63 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.819 1.648 . . . . 0.0 113.646 -178.404 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 68.7 m . . . . . 0 N--CA 1.469 0.512 0 C-N-CA 125.862 1.665 . . . . 0.0 113.886 178.724 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 5.9 p-10 . . . . . 0 N--CA 1.469 0.522 0 N-CA-C 112.611 0.597 . . . . 0.0 112.611 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 43.2 mt-30 -148.2 165.26 31.45 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 125.45 1.5 . . . . 0.0 110.77 -177.578 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 96.1 m-70 -89.02 128.31 35.71 Favored 'General case' 0 CA--C 1.542 0.655 0 N-CA-C 108.178 -1.045 . . . . 0.0 108.178 156.236 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 74.5 mt -140.53 131.49 26.11 Favored 'General case' 0 N--CA 1.466 0.356 0 C-N-CA 124.738 1.215 . . . . 0.0 109.414 -176.884 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 57.0 m -125.94 136.82 53.46 Favored 'General case' 0 N--CA 1.467 0.4 0 C-N-CA 124.72 1.208 . . . . 0.0 110.726 -175.667 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 47.3 -118.02 3.67 Favored Glycine 0 N--CA 1.473 1.145 0 C-N-CA 125.404 1.478 . . . . 0.0 114.564 164.976 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 21.0 p -57.95 -35.9 71.78 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 124.563 1.145 . . . . 0.0 113.254 178.932 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 86.6 m-70 -76.33 -27.93 56.71 Favored 'General case' 0 CA--C 1.542 0.645 0 O-C-N 120.756 -1.215 . . . . 0.0 112.775 176.353 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 8.2 tt -67.03 -46.1 75.47 Favored 'General case' 0 N--CA 1.468 0.434 0 O-C-N 121.24 -0.912 . . . . 0.0 110.78 166.385 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 55.0 t -62.95 -36.39 75.5 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.142 0 C-N-CA 123.622 0.769 . . . . 0.0 111.638 177.543 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 44.2 tt0 -62.48 -51.03 69.07 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 125.503 1.521 . . . . 0.0 111.217 172.548 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.94 -46.42 90.77 Favored 'General case' 0 CA--C 1.539 0.542 0 O-C-N 121.777 -0.577 . . . . 0.0 111.797 177.543 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 53.8 tp -56.29 -49.25 74.78 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 125.688 1.595 . . . . 0.0 111.432 177.069 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 44.6 t80 -58.61 -42.55 88.41 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 123.628 0.771 . . . . 0.0 113.003 173.436 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 83.1 mt -74.6 -31.4 62.02 Favored 'General case' 0 N--CA 1.473 0.682 0 N-CA-C 113.208 0.818 . . . . 0.0 113.208 -177.845 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 41.4 t -67.27 -46.85 83.06 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.877 0 C-N-CA 124.333 1.053 . . . . 0.0 110.474 171.913 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 72.1 m -93.31 -24.96 17.95 Favored 'General case' 0 N--CA 1.469 0.497 0 N-CA-C 114.587 1.329 . . . . 0.0 114.587 -168.147 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 64.65 -136.46 38.87 Favored Glycine 0 CA--C 1.532 1.147 0 C-N-CA 124.478 1.037 . . . . 0.0 112.696 177.444 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -63.3 -17.47 62.56 Favored 'General case' 0 CA--C 1.544 0.728 0 N-CA-C 114.659 1.355 . . . . 0.0 114.659 -177.727 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 83.3 mtm180 -61.71 -31.52 71.68 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 124.506 1.122 . . . . 0.0 113.301 -177.952 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 79.41 166.87 33.01 Favored Glycine 0 CA--C 1.533 1.205 0 C-N-CA 124.403 1.002 . . . . 0.0 113.515 -177.03 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 47.7 p90 -152.7 165.47 35.18 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 124.584 1.154 . . . . 0.0 113.694 -168.15 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 87.4 t80 . . . . . 0 CA--C 1.542 0.638 0 C-N-CA 125.15 1.38 . . . . 0.0 110.287 166.543 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 84.5 t . . . . . 0 N--CA 1.481 1.114 0 CA-C-O 119.347 -0.359 . . . . 0.0 111.539 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 44.1 tt0 -83.99 -53.7 5.38 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 118.431 0.559 . . . . 0.0 110.262 168.429 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 31.7 tt0 -64.81 -41.38 95.83 Favored 'General case' 0 CA--C 1.535 0.367 0 N-CA-C 113.275 0.842 . . . . 0.0 113.275 -165.448 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 4.5 t -85.24 -10.37 56.62 Favored 'General case' 0 N--CA 1.476 0.851 0 CA-C-N 119.907 1.231 . . . . 0.0 113.298 179.768 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 21.7 t -89.98 -34.55 15.95 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 124.863 1.265 . . . . 0.0 111.907 176.243 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 46.2 p -95.94 -45.33 6.98 Favored 'General case' 0 N--CA 1.478 0.925 0 C-N-CA 126.106 1.762 . . . . 0.0 112.518 179.151 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.6 t -104.42 -161.11 0.8 Allowed 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 125.177 1.391 . . . . 0.0 110.029 166.394 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 7.8 tt -113.45 154.06 14.9 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.903 0 C-N-CA 125.685 1.594 . . . . 0.0 111.289 -177.63 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 14.8 p -141.6 162.33 35.75 Favored 'General case' 0 N--CA 1.475 0.779 0 O-C-N 121.259 -0.9 . . . . 0.0 113.154 173.436 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 83.3 p -104.87 166.91 10.06 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 125.429 1.492 . . . . 0.0 113.1 -177.846 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 62.2 mt -63.83 -37.99 89.45 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 123.72 0.808 . . . . 0.0 111.87 174.419 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 20.8 p90 -68.4 -32.56 72.71 Favored 'General case' 0 N--CA 1.469 0.499 0 N-CA-C 113.296 0.85 . . . . 0.0 113.296 175.048 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 16.7 mm100 -70.57 -35.06 72.85 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-O 119.069 -0.491 . . . . 0.0 111.885 172.314 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 88.9 mt -66.94 -37.07 83.63 Favored 'General case' 0 N--CA 1.472 0.674 0 CA-C-N 119.15 0.886 . . . . 0.0 112.226 170.926 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -62.69 -25.6 68.24 Favored 'General case' 0 CA--C 1.543 0.694 0 N-CA-C 113.335 0.865 . . . . 0.0 113.335 -178.73 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 25.9 t30 -53.93 -28.5 37.38 Favored 'General case' 0 CA--C 1.548 0.877 0 C-N-CA 124.287 1.035 . . . . 0.0 113.347 171.74 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 98.7 m-85 -96.77 2.89 52.44 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 125.8 1.64 . . . . 0.0 114.19 -175.43 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 70.0 m . . . . . 0 CA--C 1.544 0.748 0 N-CA-C 113.418 0.895 . . . . 0.0 113.418 174.194 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 3.3 m120 . . . . . 0 N--CA 1.469 0.5 0 CA-C-O 120.797 0.332 . . . . 0.0 111.654 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 90.4 mt-30 -146.15 157.92 43.85 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 124.921 1.288 . . . . 0.0 110.569 -177.767 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 96.8 m-70 -86.26 131.08 34.31 Favored 'General case' 0 CA--C 1.541 0.615 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 162.67 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 83.5 mt -145.53 134.2 22.21 Favored 'General case' 0 N--CA 1.464 0.244 0 C-N-CA 124.899 1.28 . . . . 0.0 109.493 -168.652 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 2.0 t -151.12 153.31 34.77 Favored 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 123.857 0.863 . . . . 0.0 111.517 -176.601 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 48.14 -126.11 14.02 Favored Glycine 0 CA--C 1.532 1.116 0 C-N-CA 125.115 1.341 . . . . 0.0 113.707 176.137 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 19.4 m -60.19 -31.49 70.18 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 124.359 1.064 . . . . 0.0 112.938 -179.001 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 99.2 m-70 -74.41 -35.46 63.42 Favored 'General case' 0 CA--C 1.54 0.589 0 O-C-N 121.157 -0.964 . . . . 0.0 111.918 178.021 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 60.0 tp -67.32 -43.03 82.62 Favored 'General case' 0 N--CA 1.47 0.551 0 O-C-N 121.749 -0.594 . . . . 0.0 111.23 170.43 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 42.7 t -59.91 -42.16 88.38 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.951 0 C-N-CA 124.151 0.98 . . . . 0.0 111.583 174.448 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -64.66 -46.1 83.9 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 124.215 1.006 . . . . 0.0 111.828 174.596 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.3 -46.27 90.45 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 123.27 0.628 . . . . 0.0 112.319 177.641 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 42.3 mt -56.55 -51.95 66.63 Favored 'General case' 0 N--CA 1.466 0.34 0 C-N-CA 124.003 0.921 . . . . 0.0 111.191 173.584 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 59.1 t80 -54.25 -43.18 70.69 Favored 'General case' 0 CA--C 1.542 0.658 0 N-CA-C 112.767 0.655 . . . . 0.0 112.767 176.298 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 91.2 mt -74.05 -36.66 64.39 Favored 'General case' 0 N--CA 1.469 0.494 0 N-CA-C 113.516 0.932 . . . . 0.0 113.516 -179.664 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 33.4 t -66.65 -43.96 90.02 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.958 0 C-N-CA 124.358 1.063 . . . . 0.0 110.637 174.206 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 79.1 m -79.78 -30.61 40.71 Favored 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 113.262 0.838 . . . . 0.0 113.262 -175.291 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 69.21 -113.32 5.08 Favored Glycine 0 CA--C 1.53 0.989 0 C-N-CA 124.489 1.042 . . . . 0.0 111.836 173.041 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 39.7 mm-40 -71.54 -22.38 61.77 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 123.884 0.874 . . . . 0.0 112.819 174.882 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 84.0 mtm180 -75.27 154.25 37.54 Favored 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 124.749 1.22 . . . . 0.0 110.954 175.137 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . -77.72 -174.21 41.71 Favored Glycine 0 N--CA 1.472 1.047 0 C-N-CA 123.814 0.721 . . . . 0.0 111.692 169.321 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 55.1 p90 -157.73 165.5 35.23 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 124.835 1.254 . . . . 0.0 112.7 178.912 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 88.6 t80 . . . . . 0 N--CA 1.466 0.333 0 C-N-CA 124.867 1.267 . . . . 0.0 111.504 170.25 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 91.0 t . . . . . 0 N--CA 1.479 0.986 0 N-CA-C 109.73 -0.47 . . . . 0.0 109.73 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 59.8 tt0 -55.8 -47.9 76.33 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 123.976 0.91 . . . . 0.0 111.355 174.831 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 20.6 tt0 -62.75 -48.33 79.63 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 123.01 0.524 . . . . 0.0 111.492 -179.238 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 65.9 m -63.63 -34.37 77.68 Favored 'General case' 0 N--CA 1.466 0.373 0 N-CA-C 113.766 1.024 . . . . 0.0 113.766 178.643 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 74.7 m -77.25 -38.61 50.7 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.753 0.821 . . . . 0.0 112.277 -179.013 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 78.9 p -95.97 -23.08 17.01 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 124.87 1.268 . . . . 0.0 113.74 -174.186 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.2 t -141.95 -169.3 2.89 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 125.599 1.56 . . . . 0.0 111.154 -177.844 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 38.0 mm -86.24 133.93 28.57 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.704 0 O-C-N 120.696 -1.253 . . . . 0.0 109.793 175.87 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 16.1 p -127.11 163.53 23.6 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 124.193 0.997 . . . . 0.0 112.163 170.908 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 96.5 p -108.28 158.64 17.3 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 124.259 1.024 . . . . 0.0 112.959 -177.581 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 55.6 mt -64.22 -34.18 77.51 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 123.738 0.815 . . . . 0.0 111.391 173.402 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 82.5 t80 -62.66 -35.83 80.89 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 123.756 0.823 . . . . 0.0 113.149 172.474 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 37.1 mt-30 -73.72 -32.76 64.04 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-O 118.502 -0.761 . . . . 0.0 112.121 173.775 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 81.7 mt -65.16 -40.4 94.27 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 119.594 1.088 . . . . 0.0 111.707 168.526 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -60.81 -26.93 67.66 Favored 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 113.478 0.918 . . . . 0.0 113.478 -177.1 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 18.9 t30 -55.34 -27.76 49.33 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 123.921 0.888 . . . . 0.0 113.323 172.522 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 97.0 m-85 -98.79 5.48 47.47 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 125.838 1.655 . . . . 0.0 114.251 -175.451 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 73.5 m . . . . . 0 CA--C 1.543 0.68 0 C-N-CA 123.719 0.808 . . . . 0.0 113.09 169.936 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 55.3 m-20 . . . . . 0 CA--C 1.538 0.514 0 CA-C-O 120.176 0.036 . . . . 0.0 110.935 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 28.9 mm-40 -149.69 167.92 25.08 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 124.1 0.96 . . . . 0.0 112.48 -165.359 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 88.1 m-70 -79.16 138.88 38.06 Favored 'General case' 0 CA--C 1.542 0.646 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 155.092 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 43.1 mt -151.17 136.17 17.42 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 124.78 1.232 . . . . 0.0 108.61 -175.617 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 2.3 t -155.41 153.97 31.21 Favored 'General case' 0 CA--C 1.534 0.328 0 O-C-N 121.549 -0.719 . . . . 0.0 112.343 -176.357 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 54.32 -130.97 45.5 Favored Glycine 0 CA--C 1.532 1.149 0 C-N-CA 125.195 1.379 . . . . 0.0 113.617 175.034 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 25.4 p -57.59 -38.0 74.15 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 124.353 1.061 . . . . 0.0 112.803 178.323 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 73.4 m-70 -71.95 -29.51 64.34 Favored 'General case' 0 CA--C 1.544 0.735 0 O-C-N 121.107 -0.995 . . . . 0.0 112.801 177.533 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 9.7 tt -66.74 -47.19 73.06 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 119.527 1.058 . . . . 0.0 110.877 168.123 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 58.3 t -61.87 -38.78 81.42 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.897 0 C-N-CA 123.239 0.616 . . . . 0.0 111.403 178.971 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -61.73 -51.86 66.62 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 125.709 1.604 . . . . 0.0 111.509 172.425 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.58 -46.16 91.07 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 123.231 0.612 . . . . 0.0 112.01 179.608 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 46.7 tp -58.19 -51.67 68.79 Favored 'General case' 0 CA--C 1.53 0.182 0 C-N-CA 124.807 1.243 . . . . 0.0 111.014 176.699 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 56.8 t80 -54.37 -42.59 70.5 Favored 'General case' 0 CA--C 1.543 0.678 0 N-CA-C 112.868 0.692 . . . . 0.0 112.868 174.262 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 83.0 mt -71.53 -34.68 70.26 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 124.093 0.957 . . . . 0.0 113.163 178.911 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 25.2 t -64.47 -44.42 96.99 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.844 0 C-N-CA 124.534 1.133 . . . . 0.0 110.419 171.277 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 79.4 m -72.61 -34.08 67.13 Favored 'General case' 0 CA--C 1.538 0.513 0 N-CA-C 113.129 0.789 . . . . 0.0 113.129 -178.651 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 69.78 -111.63 3.96 Favored Glycine 0 CA--C 1.529 0.927 0 C-N-CA 124.743 1.163 . . . . 0.0 111.797 173.619 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -70.16 -26.65 64.02 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 124.33 1.052 . . . . 0.0 112.061 174.955 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 83.6 mtm180 -72.44 154.37 40.91 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 124.886 1.274 . . . . 0.0 111.137 176.211 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . -79.86 -167.61 35.47 Favored Glycine 0 N--CA 1.471 0.977 0 C-N-CA 124.255 0.931 . . . . 0.0 111.353 167.817 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 52.9 p90 -159.53 162.85 35.53 Favored 'General case' 0 CA--C 1.538 0.506 0 N-CA-C 113.789 1.033 . . . . 0.0 113.789 179.248 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 83.1 t80 . . . . . 0 CA--C 1.541 0.612 0 C-N-CA 125.733 1.613 . . . . 0.0 110.025 168.908 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 29.5 t . . . . . 0 N--CA 1.48 1.043 0 CA-C-O 119.321 -0.371 . . . . 0.0 110.723 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 46.6 tt0 -62.65 -47.62 82.89 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 118.623 0.647 . . . . 0.0 111.078 174.085 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 63.1 tp60 -63.26 -37.11 85.97 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 123.005 0.522 . . . . 0.0 112.095 -177.426 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 78.2 m -85.64 -29.3 24.15 Favored 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 114.607 1.336 . . . . 0.0 114.607 -179.828 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 41.7 t -98.48 -57.16 2.26 Favored 'General case' 0 N--CA 1.473 0.724 0 N-CA-C 113.272 0.841 . . . . 0.0 113.272 -166.301 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 36.5 p -88.7 -33.02 17.69 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 124.178 0.991 . . . . 0.0 111.914 179.228 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.0 t -94.13 -162.61 0.96 Allowed 'General case' 0 CA--C 1.551 0.982 0 C-N-CA 123.531 0.733 . . . . 0.0 110.935 158.396 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 12.0 tt -118.22 146.55 22.6 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.907 0 C-N-CA 125.926 1.69 . . . . 0.0 111.048 174.95 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 14.9 p -132.45 159.23 39.95 Favored 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 113.122 0.786 . . . . 0.0 113.122 177.675 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 52.6 m -99.72 154.03 18.63 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 125.315 1.446 . . . . 0.0 112.186 -179.612 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 43.9 mt -59.37 -33.13 70.81 Favored 'General case' 0 N--CA 1.472 0.653 0 O-C-N 120.86 -1.15 . . . . 0.0 112.042 173.487 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 83.2 t80 -62.41 -30.69 71.4 Favored 'General case' 0 CA--C 1.546 0.804 0 N-CA-C 113.368 0.877 . . . . 0.0 113.368 171.673 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 94.0 mt-30 -80.15 -33.95 38.08 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 123.83 0.852 . . . . 0.0 111.365 174.895 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 56.3 mt -56.93 -48.49 78.15 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 118.841 0.746 . . . . 0.0 110.397 166.444 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -66.19 -31.7 72.69 Favored 'General case' 0 CA--C 1.544 0.712 0 N-CA-C 112.853 0.686 . . . . 0.0 112.853 179.279 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 32.8 t30 -62.9 -27.25 69.24 Favored 'General case' 0 CA--C 1.55 0.973 0 O-C-N 120.965 -1.084 . . . . 0.0 113.24 176.035 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 10.9 m-85 -80.6 -4.19 53.19 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 124.697 1.199 . . . . 0.0 113.894 172.324 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 72.1 m . . . . . 0 N--CA 1.472 0.627 0 C-N-CA 124.905 1.282 . . . . 0.0 113.738 178.286 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.466 0.351 0 CA-C-O 120.977 0.418 . . . . 0.0 111.201 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 47.9 mm-40 -149.11 155.07 40.15 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 124.293 1.037 . . . . 0.0 110.694 -161.685 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 97.7 m-70 -87.69 122.95 32.0 Favored 'General case' 0 CA--C 1.539 0.552 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 164.545 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 77.5 mt -140.71 130.83 24.81 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 125.869 1.668 . . . . 0.0 109.139 -172.086 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 64.8 m -134.17 143.16 47.74 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 125.024 1.33 . . . . 0.0 111.091 -175.374 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 55.61 -125.66 37.31 Favored Glycine 0 N--CA 1.472 1.099 0 C-N-CA 124.763 1.173 . . . . 0.0 114.427 166.225 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 24.5 p -62.57 -34.57 77.24 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 124.382 1.073 . . . . 0.0 112.607 179.34 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 24.7 m80 -68.13 -38.7 82.5 Favored 'General case' 0 CA--C 1.541 0.622 0 O-C-N 121.275 -0.89 . . . . 0.0 111.422 176.038 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 50.4 tp -63.8 -49.43 72.91 Favored 'General case' 0 N--CA 1.464 0.272 0 C-N-CA 123.469 0.708 . . . . 0.0 111.172 170.889 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 47.8 t -58.32 -39.94 76.04 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.905 0 C-N-CA 123.093 0.557 . . . . 0.0 111.83 177.938 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -64.68 -49.75 69.71 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 123.786 0.835 . . . . 0.0 111.82 175.384 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.9 -46.89 88.86 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 123.34 0.656 . . . . 0.0 111.932 179.362 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 52.4 tp -56.0 -50.71 70.11 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 126.365 1.866 . . . . 0.0 111.409 175.482 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 91.4 t80 -61.14 -40.09 92.53 Favored 'General case' 0 CA--C 1.54 0.572 0 N-CA-C 112.998 0.74 . . . . 0.0 112.998 175.093 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 79.0 mt -72.7 -36.05 67.76 Favored 'General case' 0 N--CA 1.471 0.621 0 N-CA-C 113.284 0.846 . . . . 0.0 113.284 -179.828 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 25.5 t -63.31 -45.86 97.09 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.081 0 C-N-CA 123.43 0.692 . . . . 0.0 110.45 171.408 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 69.7 m -83.6 -19.18 35.97 Favored 'General case' 0 CA--C 1.54 0.576 0 N-CA-C 114.193 1.183 . . . . 0.0 114.193 -173.685 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 76.44 -126.09 7.98 Favored Glycine 0 CA--C 1.53 1.019 0 C-N-CA 124.724 1.154 . . . . 0.0 111.574 174.146 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -72.5 -13.39 61.41 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 123.78 0.832 . . . . 0.0 113.121 175.677 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 87.7 mtm180 -71.07 159.16 35.22 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 124.645 1.178 . . . . 0.0 112.511 178.504 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . -91.76 157.72 24.64 Favored Glycine 0 CA--C 1.528 0.873 0 C-N-CA 125.631 1.586 . . . . 0.0 112.246 174.981 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 49.1 p90 -127.42 151.8 48.35 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 125.255 1.422 . . . . 0.0 112.757 -178.553 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 30.2 t80 . . . . . 0 CA--C 1.542 0.646 0 C-N-CA 126.38 1.872 . . . . 0.0 110.267 165.413 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 91.3 t . . . . . 0 N--CA 1.477 0.922 0 N-CA-C 110.441 -0.207 . . . . 0.0 110.441 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -62.33 -44.01 97.5 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 124.855 1.262 . . . . 0.0 111.359 176.731 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 17.5 tt0 -61.96 -56.44 19.18 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.074 0.949 . . . . 0.0 110.138 177.763 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 70.3 m -56.1 -33.43 65.08 Favored 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 113.759 1.022 . . . . 0.0 113.759 -179.728 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 12.6 t -91.38 -34.84 14.71 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 124.251 1.02 . . . . 0.0 113.691 -171.77 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 43.2 p -108.43 -26.08 10.65 Favored 'General case' 0 N--CA 1.482 1.134 0 N-CA-C 114.485 1.291 . . . . 0.0 114.485 -176.149 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 95.8 p -115.41 -131.28 0.32 Allowed 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 124.43 1.092 . . . . 0.0 109.129 162.337 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 10.0 tt -135.22 149.54 28.9 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 C-N-CA 125.219 1.408 . . . . 0.0 110.46 -177.95 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 15.6 p -140.26 157.19 45.97 Favored 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 113.427 0.899 . . . . 0.0 113.427 178.062 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 22.8 t -100.16 158.8 15.59 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-O 122.254 1.026 . . . . 0.0 113.151 178.271 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 52.7 mt -63.38 -33.92 76.6 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 123.847 0.859 . . . . 0.0 110.947 170.838 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 77.2 t80 -63.06 -29.58 70.92 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 124.103 0.961 . . . . 0.0 112.962 173.481 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 98.5 mt-30 -81.55 -38.88 25.49 Favored 'General case' 0 N--CA 1.467 0.381 0 C-N-CA 123.769 0.828 . . . . 0.0 110.736 176.101 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 86.8 mt -59.23 -36.06 74.75 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-N 119.135 0.88 . . . . 0.0 111.96 170.128 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -59.57 -26.98 65.86 Favored 'General case' 0 CA--C 1.546 0.799 0 N-CA-C 113.462 0.912 . . . . 0.0 113.462 178.722 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 26.4 t30 -60.86 -24.51 65.97 Favored 'General case' 0 CA--C 1.55 0.978 0 O-C-N 120.903 -1.123 . . . . 0.0 113.119 173.654 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 84.2 m-85 -98.47 5.96 47.59 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 126.429 1.892 . . . . 0.0 113.247 -178.079 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 71.1 m . . . . . 0 CA--C 1.543 0.674 0 C-N-CA 123.881 0.872 . . . . 0.0 112.753 166.12 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.541 0.597 0 N-CA-C 113.417 0.895 . . . . 0.0 113.417 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 38.5 mt-30 -147.4 163.04 37.73 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 124.961 1.305 . . . . 0.0 111.434 -168.427 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 98.2 m-70 -80.11 132.68 35.99 Favored 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 109.02 -0.733 . . . . 0.0 109.02 156.74 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 76.5 mt -148.21 139.13 23.14 Favored 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 125.327 1.451 . . . . 0.0 109.082 -176.464 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 2.8 t -159.14 155.7 27.7 Favored 'General case' 0 N--CA 1.468 0.474 0 O-C-N 121.587 -0.695 . . . . 0.0 111.904 -177.472 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 54.1 -135.17 44.02 Favored Glycine 0 CA--C 1.53 1.004 0 C-N-CA 124.922 1.249 . . . . 0.0 113.593 175.072 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 20.0 m -58.15 -33.02 68.73 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 124.056 0.942 . . . . 0.0 112.552 -179.712 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 76.2 m-70 -75.67 -28.76 58.83 Favored 'General case' 0 CA--C 1.543 0.688 0 O-C-N 121.102 -0.999 . . . . 0.0 112.85 178.565 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 9.3 tt -66.15 -46.52 77.19 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 119.312 0.96 . . . . 0.0 110.757 166.198 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 95.4 t -62.36 -38.93 82.45 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.766 0 C-N-CA 122.906 0.482 . . . . 0.0 111.396 179.364 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -62.13 -51.27 68.55 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 125.751 1.62 . . . . 0.0 111.691 172.234 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.04 -46.09 92.14 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 123.159 0.584 . . . . 0.0 111.913 179.151 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 58.5 tp -57.59 -53.19 60.96 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 124.66 1.184 . . . . 0.0 110.84 175.858 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 38.6 t80 -53.73 -41.42 67.05 Favored 'General case' 0 CA--C 1.543 0.693 0 N-CA-C 112.886 0.699 . . . . 0.0 112.886 175.308 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 83.2 mt -72.93 -33.08 65.72 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 124.203 1.001 . . . . 0.0 113.457 178.813 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 25.6 t -65.83 -43.91 93.07 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.922 0 C-N-CA 124.343 1.057 . . . . 0.0 110.344 170.78 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 69.5 m -73.07 -39.56 65.78 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 122.952 0.501 . . . . 0.0 112.335 -178.206 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 62.83 -104.35 0.78 Allowed Glycine 0 CA--C 1.533 1.176 0 C-N-CA 124.244 0.926 . . . . 0.0 112.059 174.006 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -77.05 -21.42 54.51 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 124.362 1.065 . . . . 0.0 113.854 175.045 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 1.4 mpp_? -73.52 154.01 40.05 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 123.528 0.731 . . . . 0.0 109.985 166.866 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . -77.4 -171.31 35.75 Favored Glycine 0 CA--C 1.534 1.267 0 C-N-CA 124.154 0.883 . . . . 0.0 111.248 166.101 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 43.8 p90 -156.53 162.96 39.9 Favored 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 113.969 1.1 . . . . 0.0 113.969 179.405 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 92.0 t80 . . . . . 0 CA--C 1.537 0.474 0 C-N-CA 125.436 1.494 . . . . 0.0 110.412 169.584 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 61.5 t . . . . . 0 N--CA 1.481 1.075 0 CA-C-O 119.285 -0.388 . . . . 0.0 110.971 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 79.5 mm-40 -72.13 -43.32 64.89 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 118.761 0.71 . . . . 0.0 111.149 171.912 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 66.3 tp60 -63.08 -36.24 82.93 Favored 'General case' 0 CA--C 1.534 0.34 0 O-C-N 121.744 -0.598 . . . . 0.0 112.135 -178.794 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 68.3 m -85.77 -29.8 23.55 Favored 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 114.575 1.324 . . . . 0.0 114.575 179.641 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 17.6 t -107.47 -41.67 5.01 Favored 'General case' 0 N--CA 1.473 0.698 0 N-CA-C 113.59 0.959 . . . . 0.0 113.59 -169.53 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 44.3 m -84.54 -46.34 11.69 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 125.013 1.325 . . . . 0.0 109.596 176.132 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 31.4 m -96.8 -162.74 0.98 Allowed 'General case' 0 CA--C 1.55 0.961 0 C-N-CA 124.643 1.177 . . . . 0.0 111.278 166.63 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 12.1 tt -111.38 148.3 14.74 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.944 0 C-N-CA 125.469 1.508 . . . . 0.0 110.154 170.996 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 14.7 p -135.5 163.12 30.81 Favored 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 113.554 0.946 . . . . 0.0 113.554 179.911 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 36.2 t -103.0 156.45 17.66 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 124.46 1.104 . . . . 0.0 112.6 177.07 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 69.0 mt -60.12 -30.0 69.0 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 123.977 0.911 . . . . 0.0 111.606 169.964 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 77.2 t80 -65.07 -27.39 68.74 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 123.997 0.919 . . . . 0.0 113.287 171.66 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 86.9 mt-30 -85.32 -33.16 22.15 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 124.061 0.944 . . . . 0.0 110.826 175.685 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 9.5 mp -56.18 -47.52 78.16 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 118.555 0.616 . . . . 0.0 110.749 165.274 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -66.35 -31.22 71.87 Favored 'General case' 0 CA--C 1.546 0.79 0 N-CA-C 112.817 0.673 . . . . 0.0 112.817 177.68 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 24.3 t30 -64.36 -26.94 68.69 Favored 'General case' 0 CA--C 1.547 0.856 0 O-C-N 120.953 -1.092 . . . . 0.0 112.902 173.934 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 10.7 m-85 -85.03 8.07 19.16 Favored 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 125.329 1.452 . . . . 0.0 114.02 171.901 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 73.3 m . . . . . 0 N--CA 1.472 0.629 0 C-N-CA 125.153 1.381 . . . . 0.0 113.408 175.556 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 44.4 p-10 . . . . . 0 CA--C 1.542 0.657 0 N-CA-C 113.541 0.941 . . . . 0.0 113.541 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 44.8 mt-30 -150.86 158.9 44.72 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 125.796 1.638 . . . . 0.0 110.953 -172.334 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 96.9 m-70 -87.52 127.78 35.24 Favored 'General case' 0 CA--C 1.54 0.59 0 N-CA-C 108.963 -0.754 . . . . 0.0 108.963 159.989 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 87.4 mt -140.62 131.41 25.84 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 125.876 1.67 . . . . 0.0 108.715 -173.476 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 71.7 m -138.07 146.23 42.7 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 124.483 1.113 . . . . 0.0 111.56 -172.861 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 55.57 -131.67 49.33 Favored Glycine 0 N--CA 1.471 0.978 0 C-N-CA 124.961 1.267 . . . . 0.0 114.208 165.262 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 22.6 m -59.13 -33.17 70.55 Favored 'General case' 0 N--CA 1.468 0.465 0 C-N-CA 124.241 1.016 . . . . 0.0 112.375 -179.543 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 75.2 m-70 -75.88 -27.8 57.89 Favored 'General case' 0 CA--C 1.542 0.639 0 O-C-N 121.065 -1.022 . . . . 0.0 112.813 176.336 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 54.9 tp -70.15 -46.79 63.98 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-N 119.104 0.865 . . . . 0.0 110.604 167.26 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 74.4 t -55.93 -43.0 73.41 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.306 0 CA-C-N 118.744 0.702 . . . . 0.0 111.43 174.675 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -60.45 -48.99 79.37 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 125.442 1.497 . . . . 0.0 111.477 173.039 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.35 -42.87 99.4 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 123.467 0.707 . . . . 0.0 112.673 179.215 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -52.71 -55.16 24.69 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-N 119.432 1.014 . . . . 0.0 110.58 172.576 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 70.6 t80 -60.21 -35.12 74.71 Favored 'General case' 0 CA--C 1.543 0.691 0 N-CA-C 113.471 0.915 . . . . 0.0 113.471 178.753 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 83.9 mt -74.93 -34.07 62.05 Favored 'General case' 0 N--CA 1.472 0.649 0 N-CA-C 113.524 0.935 . . . . 0.0 113.524 177.43 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 49.5 t -71.16 -42.89 75.58 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.918 0 C-N-CA 123.812 0.845 . . . . 0.0 110.765 174.544 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 70.2 m -102.67 -24.63 13.74 Favored 'General case' 0 N--CA 1.468 0.463 0 N-CA-C 114.771 1.397 . . . . 0.0 114.771 -165.76 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 64.59 -140.6 42.93 Favored Glycine 0 CA--C 1.534 1.231 0 C-N-CA 124.094 0.854 . . . . 0.0 112.315 -178.536 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 57.3 mp0 -65.03 -11.87 44.03 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 125.732 1.613 . . . . 0.0 114.19 -178.412 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 82.6 mtm180 -61.95 -28.79 69.79 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 124.195 0.998 . . . . 0.0 113.322 177.662 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 81.04 162.35 28.23 Favored Glycine 0 CA--C 1.532 1.155 0 C-N-CA 124.53 1.062 . . . . 0.0 112.918 -178.195 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 54.7 p90 -143.54 158.75 43.41 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 125.201 1.4 . . . . 0.0 113.48 -169.501 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 78.3 m-85 . . . . . 0 CA--C 1.54 0.587 0 C-N-CA 126.573 1.949 . . . . 0.0 110.648 169.912 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 56.1 t . . . . . 0 N--CA 1.48 1.07 0 N-CA-C 112.08 0.4 . . . . 0.0 112.08 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 14.4 mm-40 -82.84 -56.25 3.93 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 118.286 0.493 . . . . 0.0 110.618 167.333 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 1.2 tm0? -60.86 -46.41 90.71 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 123.035 0.534 . . . . 0.0 112.237 -166.673 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 70.4 m -76.65 -21.41 55.49 Favored 'General case' 0 N--CA 1.467 0.398 0 N-CA-C 114.289 1.218 . . . . 0.0 114.289 -177.339 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 10.6 t -100.69 -32.3 10.8 Favored 'General case' 0 CA--C 1.541 0.598 0 N-CA-C 113.244 0.831 . . . . 0.0 113.244 -173.851 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 44.5 p -95.76 -14.63 23.16 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 125.211 1.404 . . . . 0.0 113.429 176.586 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 84.3 p -144.34 -174.49 4.32 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 125.546 1.538 . . . . 0.0 110.173 174.279 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 16.9 tt -91.38 138.05 20.54 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.817 0 O-C-N 120.614 -1.304 . . . . 0.0 110.388 178.652 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 8.7 p -132.29 159.05 40.25 Favored 'General case' 0 N--CA 1.469 0.51 0 O-C-N 121.207 -0.933 . . . . 0.0 113.014 178.547 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 36.7 m -106.96 162.32 13.94 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 124.787 1.235 . . . . 0.0 111.145 -175.852 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 24.8 mt -59.32 -33.0 70.58 Favored 'General case' 0 CA--C 1.535 0.393 0 O-C-N 121.164 -0.96 . . . . 0.0 110.934 172.108 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 89.3 t80 -60.15 -33.16 71.78 Favored 'General case' 0 CA--C 1.546 0.815 0 N-CA-C 113.821 1.045 . . . . 0.0 113.821 170.68 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 14.0 mm100 -75.18 -33.92 61.5 Favored 'General case' 0 N--CA 1.471 0.589 0 O-C-N 121.537 -0.727 . . . . 0.0 111.217 174.941 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 93.2 mt -65.85 -44.33 85.8 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-N 118.307 0.503 . . . . 0.0 111.165 170.45 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -68.67 -26.83 65.51 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 125.325 1.45 . . . . 0.0 112.94 -177.078 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 18.6 t30 -52.73 -32.65 44.18 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 124.922 1.289 . . . . 0.0 113.771 179.773 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 84.3 m-85 -96.1 0.37 51.32 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 125.112 1.365 . . . . 0.0 114.365 -177.366 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 88.8 m . . . . . 0 CA--C 1.542 0.635 0 N-CA-C 114.333 1.234 . . . . 0.0 114.333 178.941 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 44.2 p-10 . . . . . 0 CA--C 1.543 0.698 0 CA-C-O 121.401 0.619 . . . . 0.0 112.403 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 41.4 mt-30 -148.34 162.55 39.3 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.039 0.936 . . . . 0.0 111.625 -160.535 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 95.7 m-70 -88.26 132.63 34.31 Favored 'General case' 0 CA--C 1.54 0.57 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 157.689 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 91.5 mt -144.43 132.5 21.6 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 125.347 1.459 . . . . 0.0 109.406 -174.668 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 62.6 m -139.52 151.2 45.94 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 125.159 1.384 . . . . 0.0 110.641 -175.909 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 57.78 -133.14 52.79 Favored Glycine 0 N--CA 1.473 1.112 0 C-N-CA 124.499 1.047 . . . . 0.0 114.466 165.558 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 13.5 t -59.1 -39.41 82.14 Favored 'General case' 0 N--CA 1.472 0.645 0 O-C-N 121.928 -0.748 . . . . 0.0 111.776 -179.875 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 22.1 m-70 -67.39 -29.56 69.1 Favored 'General case' 0 CA--C 1.544 0.716 0 O-C-N 120.524 -1.36 . . . . 0.0 112.62 178.285 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 55.9 tp -69.46 -40.32 77.21 Favored 'General case' 0 CA--C 1.54 0.572 0 O-C-N 121.524 -0.735 . . . . 0.0 111.508 169.753 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 85.5 t -60.87 -45.49 98.07 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.269 0 C-N-CA 123.101 0.56 . . . . 0.0 110.794 172.926 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -61.26 -48.1 82.98 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 124.039 0.936 . . . . 0.0 111.138 177.639 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.48 -47.59 84.95 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 118.499 0.59 . . . . 0.0 111.686 -179.612 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 61.6 tp -55.3 -52.67 62.71 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 124.57 1.148 . . . . 0.0 111.571 176.164 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 25.9 t80 -57.55 -42.27 82.64 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 123.733 0.813 . . . . 0.0 112.629 175.863 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 81.8 mt -74.95 -32.25 61.69 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 124.145 0.978 . . . . 0.0 113.195 -177.678 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 26.8 t -66.08 -47.42 85.0 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 C-N-CA 123.882 0.873 . . . . 0.0 110.405 171.563 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 85.7 m -84.1 -27.46 28.19 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 113.059 0.763 . . . . 0.0 113.059 -172.2 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 69.1 -118.33 8.65 Favored Glycine 0 N--CA 1.468 0.786 0 C-N-CA 124.837 1.208 . . . . 0.0 112.221 169.141 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -70.58 -19.53 62.85 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 124.38 1.072 . . . . 0.0 113.702 175.591 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 89.3 mtm180 -72.59 158.77 35.04 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 124.976 1.31 . . . . 0.0 111.524 177.433 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . -78.22 147.62 31.86 Favored Glycine 0 N--CA 1.467 0.745 0 N-CA-C 110.939 -0.864 . . . . 0.0 110.939 175.152 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 52.6 p90 -128.02 160.1 32.96 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 124.141 0.976 . . . . 0.0 113.054 179.572 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 27.6 t80 . . . . . 0 CA--C 1.536 0.404 0 C-N-CA 124.818 1.247 . . . . 0.0 110.67 175.376 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 82.9 t . . . . . 0 N--CA 1.478 0.963 0 CA-C-O 119.195 -0.431 . . . . 0.0 111.422 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -70.63 -42.79 70.42 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-N 119.108 0.867 . . . . 0.0 111.15 176.02 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 71.0 tp60 -58.96 -42.83 90.84 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 123.172 0.589 . . . . 0.0 111.647 -179.62 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 97.9 m -76.1 -31.35 58.66 Favored 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 114.487 1.292 . . . . 0.0 114.487 177.707 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 30.3 t -98.06 -43.5 7.02 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 113.468 0.914 . . . . 0.0 113.468 -167.852 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 64.3 m -88.97 -38.47 14.43 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 125.216 1.406 . . . . 0.0 110.926 179.81 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 9.5 t -107.91 -155.86 0.56 Allowed 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 124.923 1.289 . . . . 0.0 110.758 167.561 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 29.8 pt -107.81 152.39 9.55 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.565 0 C-N-CA 125.715 1.606 . . . . 0.0 111.609 172.912 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 14.0 p -139.57 164.21 30.52 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 123.799 0.84 . . . . 0.0 112.276 171.997 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 32.8 t -107.23 156.65 18.62 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 124.111 0.964 . . . . 0.0 113.068 179.251 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 62.9 mt -60.21 -33.08 71.74 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 124.176 0.991 . . . . 0.0 111.081 170.051 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 79.9 t80 -61.85 -28.6 69.6 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 124.685 1.194 . . . . 0.0 113.287 172.241 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 86.1 mt-30 -82.1 -39.56 23.19 Favored 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 123.642 0.777 . . . . 0.0 110.955 174.033 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 40.5 mt -58.16 -37.52 74.86 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-N 118.905 0.775 . . . . 0.0 112.218 172.662 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -59.01 -30.81 68.27 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 124.271 1.028 . . . . 0.0 113.181 179.216 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 89.0 m-20 -66.46 -18.78 65.55 Favored 'General case' 0 CA--C 1.544 0.725 0 O-C-N 121.127 -0.983 . . . . 0.0 113.511 179.196 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 92.2 m-85 -92.93 -7.41 46.13 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.177 1.391 . . . . 0.0 113.341 177.163 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 13.7 t . . . . . 0 N--CA 1.472 0.639 0 C-N-CA 124.835 1.254 . . . . 0.0 112.162 171.323 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 11.2 p30 . . . . . 0 CA--C 1.54 0.558 0 N-CA-C 112.562 0.578 . . . . 0.0 112.562 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 39.3 mt-30 -151.69 167.81 26.99 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.836 1.654 . . . . 0.0 111.224 -171.857 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 99.5 m-70 -87.02 133.34 33.6 Favored 'General case' 0 CA--C 1.541 0.63 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 153.312 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 85.4 mt -145.55 138.72 26.25 Favored 'General case' 0 N--CA 1.466 0.374 0 C-N-CA 126.039 1.736 . . . . 0.0 108.806 -177.812 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 3.3 t -155.79 153.88 30.51 Favored 'General case' 0 N--CA 1.47 0.53 0 O-C-N 121.373 -0.83 . . . . 0.0 112.357 -175.899 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 50.6 -127.44 26.9 Favored Glycine 0 N--CA 1.472 1.042 0 C-N-CA 125.185 1.374 . . . . 0.0 113.69 175.327 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 16.1 m -58.27 -34.75 70.85 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 124.193 0.997 . . . . 0.0 112.556 178.881 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 80.5 m-70 -76.19 -27.54 56.94 Favored 'General case' 0 CA--C 1.541 0.614 0 O-C-N 121.363 -0.836 . . . . 0.0 113.121 178.477 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 56.3 tp -69.17 -45.41 70.08 Favored 'General case' 0 N--CA 1.469 0.492 0 O-C-N 121.423 -0.798 . . . . 0.0 110.889 168.042 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 77.7 t -62.59 -37.28 78.52 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.08 0 C-N-CA 123.607 0.763 . . . . 0.0 111.467 175.715 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 43.9 tt0 -63.54 -48.55 77.02 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 125.174 1.389 . . . . 0.0 111.462 172.507 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.51 -43.54 98.57 Favored 'General case' 0 CA--C 1.54 0.593 0 O-C-N 121.563 -0.71 . . . . 0.0 112.253 178.243 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 18.4 mt -54.7 -48.69 72.15 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 124.244 1.017 . . . . 0.0 111.008 171.67 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 80.6 t80 -62.85 -37.33 86.41 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 113.201 0.815 . . . . 0.0 113.201 176.193 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 78.5 mt -72.95 -34.65 66.66 Favored 'General case' 0 N--CA 1.47 0.564 0 O-C-N 121.266 -0.896 . . . . 0.0 112.891 178.551 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 44.8 t -73.3 -41.86 57.62 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 C-N-CA 124.236 1.014 . . . . 0.0 111.299 174.935 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 44.5 t -90.05 -30.73 17.53 Favored 'General case' 0 CA--C 1.537 0.479 0 N-CA-C 113.957 1.095 . . . . 0.0 113.957 -171.995 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 71.01 -155.71 52.89 Favored Glycine 0 CA--C 1.532 1.102 0 C-N-CA 124.223 0.916 . . . . 0.0 112.078 -171.093 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -71.34 -3.77 22.44 Favored 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 124.746 1.218 . . . . 0.0 113.98 179.734 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 58.5 mtp180 -57.8 -34.09 69.26 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 124.845 1.258 . . . . 0.0 113.178 175.49 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 88.04 147.0 12.5 Favored Glycine 0 CA--C 1.531 1.061 0 C-N-CA 125.349 1.452 . . . . 0.0 112.83 178.746 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 52.2 p90 -137.87 166.66 23.49 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 125.27 1.428 . . . . 0.0 112.21 -173.234 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 88.7 t80 . . . . . 0 CA--C 1.536 0.429 0 C-N-CA 124.661 1.184 . . . . 0.0 110.279 174.377 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 86.5 t . . . . . 0 N--CA 1.48 1.036 0 CA-C-O 118.846 -0.597 . . . . 0.0 112.334 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -73.8 -36.44 65.01 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 119.344 0.974 . . . . 0.0 111.312 175.595 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 8.0 tt0 -61.42 -36.79 81.32 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 124.317 1.047 . . . . 0.0 111.882 179.699 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 95.6 m -88.65 -27.93 20.96 Favored 'General case' 0 CA--C 1.534 0.353 0 N-CA-C 114.679 1.363 . . . . 0.0 114.679 176.807 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 20.7 t -102.04 -46.05 4.98 Favored 'General case' 0 N--CA 1.475 0.781 0 N-CA-C 113.281 0.845 . . . . 0.0 113.281 -169.456 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 22.8 m -86.24 -44.72 11.93 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 125.39 1.476 . . . . 0.0 109.829 178.636 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 69.0 m -95.26 -169.55 2.0 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 124.567 1.147 . . . . 0.0 110.739 163.251 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 32.4 pt -108.35 144.94 16.03 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.755 0 C-N-CA 124.914 1.286 . . . . 0.0 110.403 169.485 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 19.3 p -126.41 151.82 47.17 Favored 'General case' 0 N--CA 1.47 0.575 0 C-N-CA 123.744 0.818 . . . . 0.0 112.332 176.683 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 90.1 p -91.05 166.93 12.74 Favored 'General case' 0 C--N 1.323 -0.56 0 C-N-CA 124.392 1.077 . . . . 0.0 113.428 174.648 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 46.6 mt -61.65 -34.78 76.3 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 123.339 0.656 . . . . 0.0 111.505 169.74 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 59.5 m-85 -66.4 -33.92 76.8 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.599 1.159 . . . . 0.0 112.698 175.001 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 85.5 mt-30 -75.29 -35.27 61.33 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 124.323 1.049 . . . . 0.0 112.026 173.056 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 93.3 mt -61.52 -42.04 98.21 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-N 119.582 1.083 . . . . 0.0 111.049 168.19 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -60.0 -30.18 68.96 Favored 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 123.936 0.895 . . . . 0.0 112.682 179.463 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 15.9 t-20 -64.54 -22.49 66.98 Favored 'General case' 0 CA--C 1.55 0.962 0 N-CA-C 113.402 0.889 . . . . 0.0 113.402 176.486 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 61.7 m-85 -99.34 2.4 45.32 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.644 1.578 . . . . 0.0 114.126 178.905 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 37.7 m . . . . . 0 N--CA 1.474 0.73 0 O-C-N 121.144 -0.973 . . . . 0.0 111.135 163.124 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 9.3 m120 . . . . . 0 CA--C 1.535 0.402 0 CA-C-O 121.347 0.594 . . . . 0.0 111.557 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 43.5 mt-30 -145.5 159.33 43.27 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 125.212 1.405 . . . . 0.0 110.64 -174.628 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 62.4 m-70 -82.31 127.46 33.24 Favored 'General case' 0 CA--C 1.537 0.456 0 N-CA-C 108.766 -0.827 . . . . 0.0 108.766 156.359 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 93.0 mt -141.87 132.68 25.75 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 126.014 1.726 . . . . 0.0 108.092 -177.726 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 3.0 t -153.84 153.92 32.99 Favored 'General case' 0 N--CA 1.468 0.434 0 O-C-N 121.044 -1.035 . . . . 0.0 112.279 -173.91 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 55.45 -129.54 46.59 Favored Glycine 0 CA--C 1.529 0.96 0 C-N-CA 125.097 1.332 . . . . 0.0 113.331 176.676 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 20.5 p -60.96 -33.99 74.05 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 124.506 1.123 . . . . 0.0 112.734 177.718 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 26.1 m80 -68.7 -36.66 78.76 Favored 'General case' 0 CA--C 1.542 0.652 0 O-C-N 121.229 -0.919 . . . . 0.0 111.708 176.292 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 55.7 tp -67.07 -46.04 75.49 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 123.072 0.549 . . . . 0.0 111.004 171.409 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 55.1 t -58.52 -42.56 84.86 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.992 0 C-N-CA 122.959 0.503 . . . . 0.0 111.126 177.011 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -64.98 -47.81 76.24 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 124.175 0.99 . . . . 0.0 111.415 176.562 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.7 -47.5 83.36 Favored 'General case' 0 CA--C 1.54 0.568 0 O-C-N 121.42 -0.8 . . . . 0.0 111.789 -179.508 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 31.0 tp -60.87 -45.65 93.7 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 124.388 1.075 . . . . 0.0 111.019 177.778 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 83.9 t80 -56.79 -43.66 81.14 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 123.621 0.768 . . . . 0.0 112.926 172.758 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 79.7 mt -72.75 -33.41 66.35 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 123.677 0.791 . . . . 0.0 113.04 -179.619 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 41.2 t -68.14 -43.34 85.13 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.739 0 C-N-CA 123.742 0.817 . . . . 0.0 111.105 172.837 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 83.5 m -82.35 -30.27 30.46 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 113.664 0.987 . . . . 0.0 113.664 -175.407 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 62.77 -131.24 43.36 Favored Glycine 0 CA--C 1.531 1.053 0 C-N-CA 124.487 1.041 . . . . 0.0 112.176 -178.771 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 31.1 mm-40 -64.9 -18.95 65.64 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 124.929 1.292 . . . . 0.0 114.193 -176.246 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -70.52 -43.08 70.34 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 124.128 0.971 . . . . 0.0 112.763 -174.19 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 86.19 -179.44 49.58 Favored Glycine 0 CA--C 1.534 1.28 0 C-N-CA 124.359 0.98 . . . . 0.0 113.017 -168.278 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 43.4 p90 -152.65 166.31 32.5 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 125.35 1.46 . . . . 0.0 113.261 -170.032 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 47.7 t80 . . . . . 0 CA--C 1.54 0.57 0 C-N-CA 124.648 1.179 . . . . 0.0 110.01 169.137 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 45.4 t . . . . . 0 N--CA 1.48 1.032 0 CA-C-O 120.411 0.148 . . . . 0.0 111.144 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 14.2 pm0 -69.55 -30.61 68.46 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 125.398 1.479 . . . . 0.0 112.651 176.828 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 33.5 tt0 -73.5 -45.4 54.15 Favored 'General case' 0 N--CA 1.465 0.315 0 C-N-CA 124.093 0.957 . . . . 0.0 110.422 177.25 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 67.0 m -60.01 -24.07 64.18 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 124.545 1.138 . . . . 0.0 113.326 170.835 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 9.5 t -84.78 -51.36 6.84 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 124.129 0.972 . . . . 0.0 111.095 -179.644 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 47.2 p -79.68 -23.47 42.43 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 125.531 1.532 . . . . 0.0 113.721 -175.913 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.5 t -140.37 -173.7 3.75 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 125.857 1.663 . . . . 0.0 110.818 175.008 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 39.1 pt -81.86 144.37 10.49 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.398 0 O-C-N 120.905 -1.122 . . . . 0.0 111.539 175.634 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 12.6 p -137.29 165.69 25.57 Favored 'General case' 0 N--CA 1.466 0.329 0 C-N-CA 124.677 1.191 . . . . 0.0 110.979 166.958 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 96.0 p -108.54 166.55 10.7 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 124.374 1.07 . . . . 0.0 113.73 -174.92 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 56.1 mt -64.38 -35.26 80.32 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 123.376 0.67 . . . . 0.0 112.092 175.013 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 29.1 p90 -68.95 -32.23 71.67 Favored 'General case' 0 N--CA 1.468 0.452 0 O-C-N 121.103 -0.998 . . . . 0.0 113.19 174.034 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 39.0 mt-30 -70.92 -33.69 70.77 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-O 118.819 -0.61 . . . . 0.0 112.187 171.819 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 76.0 mt -65.29 -40.39 93.79 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-N 119.417 1.008 . . . . 0.0 111.608 167.086 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 23.1 tt0 -62.54 -24.02 67.29 Favored 'General case' 0 CA--C 1.54 0.579 0 N-CA-C 113.213 0.82 . . . . 0.0 113.213 -178.125 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 19.9 t-20 -57.58 -26.39 61.41 Favored 'General case' 0 CA--C 1.552 1.034 0 O-C-N 120.967 -1.083 . . . . 0.0 113.367 171.883 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 2.4 m-30 -89.73 -10.35 46.0 Favored 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 125.008 1.323 . . . . 0.0 113.839 174.705 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 64.0 m . . . . . 0 N--CA 1.479 1.003 0 CA-C-N 120.315 1.416 . . . . 0.0 111.823 171.77 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.54 0.585 0 N-CA-C 113.414 0.894 . . . . 0.0 113.414 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 44.7 mt-30 -149.06 163.93 36.11 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 125.683 1.593 . . . . 0.0 110.904 -170.822 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 36.0 m-70 -81.96 132.49 35.26 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 108.915 -0.772 . . . . 0.0 108.915 156.345 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 86.7 mt -146.11 135.2 22.68 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 126.541 1.936 . . . . 0.0 108.851 -177.06 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 4.4 t -151.91 153.57 34.39 Favored 'General case' 0 N--CA 1.467 0.424 0 O-C-N 121.445 -0.785 . . . . 0.0 112.395 -173.386 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 51.53 -132.05 35.02 Favored Glycine 0 CA--C 1.531 1.075 0 C-N-CA 125.38 1.466 . . . . 0.0 113.831 174.817 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 19.8 m -58.56 -36.7 74.32 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 124.341 1.056 . . . . 0.0 112.108 -179.899 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 19.5 m-70 -71.54 -30.8 66.32 Favored 'General case' 0 CA--C 1.541 0.603 0 O-C-N 121.148 -0.97 . . . . 0.0 112.478 179.007 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 7.8 tt -67.01 -44.54 80.08 Favored 'General case' 0 C--N 1.343 0.288 0 O-C-N 121.37 -0.831 . . . . 0.0 111.227 166.381 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 72.4 t -60.1 -38.3 76.42 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.072 0 CA-C-N 118.907 0.776 . . . . 0.0 111.525 177.467 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -63.74 -50.49 68.9 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.496 1.118 . . . . 0.0 111.669 171.604 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.45 -44.23 97.47 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 118.578 0.626 . . . . 0.0 112.21 179.946 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 48.0 tp -57.99 -53.05 62.66 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 125.738 1.615 . . . . 0.0 110.698 175.375 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 51.9 t80 -54.34 -42.21 69.97 Favored 'General case' 0 CA--C 1.543 0.676 0 N-CA-C 112.952 0.723 . . . . 0.0 112.952 174.053 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 77.3 mt -69.94 -35.44 74.52 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 123.983 0.913 . . . . 0.0 112.857 178.682 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 39.6 t -64.21 -44.39 97.45 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.853 0 C-N-CA 124.483 1.113 . . . . 0.0 111.039 170.603 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 56.5 m -73.17 -29.04 62.56 Favored 'General case' 0 CA--C 1.54 0.591 0 N-CA-C 112.961 0.726 . . . . 0.0 112.961 -179.002 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 70.57 -120.1 8.84 Favored Glycine 0 CA--C 1.529 0.918 0 C-N-CA 125.03 1.3 . . . . 0.0 110.748 177.492 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 37.4 mp0 -67.3 -22.4 65.63 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 124.581 1.152 . . . . 0.0 112.659 173.566 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 56.2 mtm-85 -79.18 153.97 29.63 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 124.479 1.111 . . . . 0.0 111.451 -179.724 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . -86.76 -178.35 49.21 Favored Glycine 0 CA--C 1.529 0.943 0 C-N-CA 125.128 1.347 . . . . 0.0 112.618 172.327 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 42.0 p90 -146.06 151.94 38.53 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 124.659 1.183 . . . . 0.0 114.15 -176.74 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 64.1 t80 . . . . . 0 CA--C 1.541 0.601 0 C-N-CA 126.458 1.903 . . . . 0.0 109.76 161.151 . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 78.0 t . . . . . 0 N--CA 1.485 1.321 0 N-CA-C 113.525 0.935 . . . . 0.0 113.525 . . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 68.5 mm-40 -100.79 -44.12 5.89 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 119.074 0.852 . . . . 0.0 109.923 164.378 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 54.7 tt0 -59.21 -45.26 91.56 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 123.967 0.907 . . . . 0.0 113.159 -172.354 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 2.6 t -84.71 -16.74 40.71 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-N 119.756 1.162 . . . . 0.0 113.381 -177.07 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 79.5 m -76.53 -41.67 45.93 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 123.966 0.906 . . . . 0.0 111.809 170.992 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 72.3 p -93.94 -36.31 12.24 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 125.147 1.379 . . . . 0.0 112.928 -175.001 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.9 t -121.08 -160.2 0.84 Allowed 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 126.268 1.827 . . . . 0.0 110.255 174.342 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 69.5 mt -103.3 144.39 14.0 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.746 0 C-N-CA 125.555 1.542 . . . . 0.0 110.163 -178.129 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 15.1 p -130.92 157.7 42.23 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 123.845 0.858 . . . . 0.0 112.749 164.472 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 59.6 p -95.33 162.91 13.48 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 124.784 1.234 . . . . 0.0 113.234 177.358 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 51.6 mt -61.47 -33.39 73.68 Favored 'General case' 0 N--CA 1.468 0.462 0 O-C-N 121.502 -0.749 . . . . 0.0 111.781 172.027 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 58.2 m-85 -65.15 -33.9 77.12 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 123.853 0.861 . . . . 0.0 112.654 173.824 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 90.0 mt-30 -75.76 -34.41 60.25 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 124.061 0.944 . . . . 0.0 111.567 174.166 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 83.3 mt -62.45 -41.11 98.5 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 119.767 1.167 . . . . 0.0 111.49 167.967 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 31.8 tt0 -62.92 -27.32 69.29 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 123.669 0.788 . . . . 0.0 112.89 -179.482 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 15.5 t-20 -59.79 -21.89 61.44 Favored 'General case' 0 CA--C 1.549 0.919 0 N-CA-C 113.485 0.92 . . . . 0.0 113.485 175.237 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 86.5 m-85 -97.39 -0.58 46.05 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 125.419 1.488 . . . . 0.0 114.266 178.255 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 55.5 m . . . . . 0 CA--C 1.543 0.676 0 O-C-N 121.071 -1.018 . . . . 0.0 111.356 167.424 . . . . . . . . 0 0 . 1 . 021 nuclear build core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 1.5 p-10 . . . . . 0 CA--C 1.541 0.621 0 N-CA-C 112.974 0.731 . . . . 0.0 112.974 . . . . . . . . . 0 0 . 1 . 021 nuclear build core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 28.6 mm-40 -152.57 167.94 27.21 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 125.302 1.441 . . . . 0.0 112.041 -169.041 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 98.2 m-70 -83.21 138.23 33.7 Favored 'General case' 0 CA--C 1.543 0.682 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 155.903 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 79.2 mt -151.86 133.95 15.07 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 124.907 1.283 . . . . 0.0 109.08 -175.156 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 2.0 t -151.59 152.05 32.37 Favored 'General case' 0 N--CA 1.465 0.318 0 N-CA-C 112.8 0.667 . . . . 0.0 112.8 -177.815 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 60.99 -130.68 47.95 Favored Glycine 0 CA--C 1.529 0.969 0 C-N-CA 124.886 1.231 . . . . 0.0 113.472 175.543 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 19.8 p -61.3 -33.69 73.99 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 124.016 0.927 . . . . 0.0 112.161 179.481 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 11.6 m80 -64.36 -40.95 96.86 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 124.461 1.104 . . . . 0.0 111.557 176.472 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 60.2 tp -68.33 -43.67 77.02 Favored 'General case' 0 N--CA 1.468 0.433 0 C-N-CA 124.119 0.968 . . . . 0.0 111.461 176.001 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 79.5 t -64.35 -37.77 80.81 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.958 0 C-N-CA 123.422 0.689 . . . . 0.0 111.858 176.172 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -67.19 -45.44 76.88 Favored 'General case' 0 N--CA 1.466 0.375 0 C-N-CA 124.196 0.999 . . . . 0.0 111.581 173.722 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.43 -45.29 91.98 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 123.173 0.589 . . . . 0.0 111.735 176.976 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 27.4 mt -53.63 -54.79 32.67 Favored 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 124.29 1.036 . . . . 0.0 111.526 171.371 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 90.0 t80 -54.86 -42.48 72.06 Favored 'General case' 0 CA--C 1.543 0.688 0 N-CA-C 112.763 0.653 . . . . 0.0 112.763 177.774 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 92.4 mt -74.65 -35.36 62.85 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 124.158 0.983 . . . . 0.0 113.274 -178.893 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 33.9 t -68.07 -43.89 84.98 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 C-N-CA 124.034 0.934 . . . . 0.0 110.664 173.661 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 84.6 m -77.43 -32.11 54.41 Favored 'General case' 0 CA--C 1.54 0.591 0 N-CA-C 112.782 0.66 . . . . 0.0 112.782 -176.409 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 69.14 -119.76 9.85 Favored Glycine 0 N--CA 1.467 0.746 0 C-N-CA 124.354 0.978 . . . . 0.0 111.438 174.927 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -64.25 -24.49 67.68 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 124.839 1.255 . . . . 0.0 112.658 174.203 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 83.9 mtm180 -75.56 146.22 40.62 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 124.625 1.17 . . . . 0.0 110.95 175.896 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . -75.72 178.62 47.98 Favored Glycine 0 N--CA 1.475 1.248 0 C-N-CA 123.4 0.524 . . . . 0.0 111.968 166.514 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 55.0 p90 -148.27 161.23 41.93 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 124.074 0.949 . . . . 0.0 113.231 174.343 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 83.3 t80 . . . . . 0 CA--C 1.536 0.419 0 C-N-CA 124.896 1.278 . . . . 0.0 110.145 171.613 . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 60.5 t . . . . . 0 N--CA 1.484 1.273 0 N-CA-C 112.553 0.575 . . . . 0.0 112.553 . . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -76.44 -44.0 37.68 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 122.858 0.463 . . . . 0.0 110.83 173.602 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -59.22 -49.17 78.87 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 124.827 1.251 . . . . 0.0 111.822 -173.063 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 8.1 t -74.91 -17.99 60.48 Favored 'General case' 0 N--CA 1.472 0.626 0 N-CA-C 113.542 0.941 . . . . 0.0 113.542 -176.696 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 42.3 t -90.06 -41.41 11.7 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 124.977 1.311 . . . . 0.0 112.46 177.286 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 50.1 m -82.35 -44.68 15.87 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 126.718 2.007 . . . . 0.0 110.572 -177.784 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 73.0 m -108.77 -132.4 0.32 Allowed 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 125.948 1.699 . . . . 0.0 108.512 165.851 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 29.8 pt -136.73 161.9 35.64 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.776 0 C-N-CA 125.843 1.657 . . . . 0.0 112.184 -174.363 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 13.8 p -150.81 162.96 39.74 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 123.664 0.786 . . . . 0.0 112.38 167.046 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 10.8 t -106.88 164.11 12.39 Favored 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 125.3 1.44 . . . . 0.0 112.752 -177.919 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 28.5 mt -60.36 -35.62 76.11 Favored 'General case' 0 N--CA 1.468 0.425 0 C-N-CA 124.724 1.209 . . . . 0.0 111.945 -178.526 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 80.3 t80 -62.93 -29.98 71.21 Favored 'General case' 0 CA--C 1.543 0.685 0 N-CA-C 113.665 0.987 . . . . 0.0 113.665 172.349 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 75.8 mt-30 -82.2 -30.95 30.59 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 123.724 0.809 . . . . 0.0 111.376 176.649 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 88.4 mt -60.81 -48.91 79.64 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-N 118.503 0.592 . . . . 0.0 110.667 164.862 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 28.7 tt0 -63.0 -24.48 67.94 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 123.873 0.869 . . . . 0.0 112.938 -176.524 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 26.4 t30 -57.68 -27.26 62.74 Favored 'General case' 0 CA--C 1.549 0.932 0 O-C-N 121.118 -0.989 . . . . 0.0 113.422 174.893 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 64.7 m-85 -89.25 -3.8 58.41 Favored 'General case' 0 CA--C 1.548 0.887 0 C-N-CA 125.215 1.406 . . . . 0.0 113.714 176.965 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 79.8 m . . . . . 0 N--CA 1.47 0.562 0 C-N-CA 124.857 1.263 . . . . 0.0 113.203 176.141 . . . . . . . . 0 0 . 1 . 022 nuclear build core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 11.9 p30 . . . . . 0 CA--C 1.54 0.567 0 N-CA-C 113.209 0.818 . . . . 0.0 113.209 . . . . . . . . . 0 0 . 1 . 022 nuclear build core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 39.6 mt-30 -147.36 160.79 42.14 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 125.247 1.419 . . . . 0.0 110.657 -178.162 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 98.1 m-70 -81.36 127.11 32.4 Favored 'General case' 0 CA--C 1.54 0.576 0 N-CA-C 108.432 -0.951 . . . . 0.0 108.432 155.926 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 90.7 mt -143.28 130.0 20.33 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 124.679 1.192 . . . . 0.0 109.907 -177.204 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 83.8 m -128.72 141.23 51.39 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 124.805 1.242 . . . . 0.0 111.787 -174.926 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 49.0 -120.16 6.76 Favored Glycine 0 N--CA 1.473 1.153 0 C-N-CA 125.652 1.596 . . . . 0.0 114.525 164.556 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 25.3 m -58.2 -38.54 76.94 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 123.979 0.912 . . . . 0.0 112.481 -179.623 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 80.2 m-70 -75.37 -28.18 59.43 Favored 'General case' 0 CA--C 1.541 0.628 0 O-C-N 121.203 -0.936 . . . . 0.0 112.804 177.765 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 51.4 tp -67.23 -46.96 72.21 Favored 'General case' 0 N--CA 1.469 0.507 0 O-C-N 121.345 -0.847 . . . . 0.0 110.824 169.952 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 75.6 t -66.87 -33.88 66.3 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.019 0 C-N-CA 123.752 0.821 . . . . 0.0 111.651 176.591 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 43.2 tt0 -63.69 -49.82 71.65 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 124.987 1.315 . . . . 0.0 111.254 171.781 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -58.94 -45.61 90.01 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 123.159 0.584 . . . . 0.0 112.003 176.845 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 59.9 tp -55.37 -51.44 66.81 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 125.522 1.529 . . . . 0.0 111.745 174.633 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 80.9 t80 -58.61 -40.12 82.37 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 123.823 0.849 . . . . 0.0 112.849 175.062 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 85.8 mt -76.83 -34.35 57.89 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 124.075 0.95 . . . . 0.0 113.246 -177.913 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 27.3 t -63.22 -47.05 94.11 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.843 0 C-N-CA 124.267 1.027 . . . . 0.0 110.25 172.297 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 84.5 m -87.78 -23.78 23.98 Favored 'General case' 0 N--CA 1.471 0.579 0 N-CA-C 113.821 1.045 . . . . 0.0 113.821 -172.82 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 66.48 -115.06 7.0 Favored Glycine 0 CA--C 1.529 0.909 0 C-N-CA 124.625 1.107 . . . . 0.0 111.846 172.464 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -72.56 -19.88 61.42 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 123.844 0.858 . . . . 0.0 112.854 175.257 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 71.6 mtp180 -75.8 133.04 40.76 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 123.969 0.908 . . . . 0.0 109.72 172.932 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . -89.67 167.74 33.93 Favored Glycine 0 N--CA 1.469 0.842 0 C-N-CA 125.268 1.413 . . . . 0.0 113.094 -178.668 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 45.4 p90 -135.36 163.83 29.13 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 124.986 1.314 . . . . 0.0 113.595 -179.502 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 85.1 t80 . . . . . 0 CA--C 1.537 0.478 0 C-N-CA 126.161 1.784 . . . . 0.0 108.484 162.478 . . . . . . . . 0 0 . 1 . 023 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 16.6 t . . . . . 0 N--CA 1.485 1.296 0 CA-C-O 121.597 0.713 . . . . 0.0 110.254 . . . . . . . . . 0 0 . 1 . 023 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 4.9 pm0 -71.41 -0.09 9.47 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 127.322 2.249 . . . . 0.0 113.905 174.007 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 33.4 tt0 -104.72 -60.06 1.65 Allowed 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 123.861 0.865 . . . . 0.0 109.638 161.982 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 92.7 m -58.16 -30.9 66.75 Favored 'General case' 0 N--CA 1.467 0.411 0 N-CA-C 115.308 1.595 . . . . 0.0 115.308 -171.175 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 16.6 t -84.71 -38.94 19.11 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 123.194 0.598 . . . . 0.0 112.604 -172.553 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 22.0 p -99.97 -31.8 11.29 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 125.609 1.563 . . . . 0.0 113.618 -177.727 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.8 t -117.78 -166.2 1.18 Allowed 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 126.112 1.765 . . . . 0.0 110.206 172.603 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 14.9 tt -96.56 149.84 4.65 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.66 0 C-N-CA 124.631 1.172 . . . . 0.0 110.782 176.654 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 15.6 p -141.93 157.11 45.35 Favored 'General case' 0 N--CA 1.471 0.594 0 O-C-N 121.267 -0.896 . . . . 0.0 113.135 174.266 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 35.6 m -103.12 152.57 21.26 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 124.022 0.929 . . . . 0.0 112.335 -171.805 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 42.6 mt -60.27 -32.7 71.42 Favored 'General case' 0 N--CA 1.473 0.719 0 O-C-N 121.101 -0.999 . . . . 0.0 111.7 176.019 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 56.4 m-85 -61.77 -31.94 72.17 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 124.392 1.077 . . . . 0.0 113.534 172.422 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 97.1 mt-30 -79.96 -35.55 37.44 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 124.705 1.202 . . . . 0.0 110.833 175.415 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 63.1 mt -61.74 -39.01 90.08 Favored 'General case' 0 N--CA 1.473 0.684 0 CA-C-N 118.499 0.59 . . . . 0.0 111.946 168.662 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 28.8 tt0 -63.56 -30.53 71.63 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 123.419 0.688 . . . . 0.0 112.769 179.295 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 45.4 t30 -62.3 -20.77 64.66 Favored 'General case' 0 CA--C 1.55 0.977 0 O-C-N 120.924 -1.11 . . . . 0.0 113.007 173.417 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 1.4 m-85 -97.16 5.13 50.71 Favored 'General case' 0 CA--C 1.549 0.909 0 C-N-CA 125.989 1.715 . . . . 0.0 114.089 175.81 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 79.5 m . . . . . 0 N--CA 1.473 0.692 0 CA-C-N 119.355 0.98 . . . . 0.0 112.682 169.034 . . . . . . . . 0 0 . 1 . 023 nuclear build core ' B' B ' 3' ' ' ASN . . . . . 0.471 ' N ' HD21 ' B' ' 3' ' ' ASN . 0.0 OUTLIER . . . . . 0 CA--C 1.542 0.66 0 N-CA-C 113.125 0.787 . . . . 0.0 113.125 . . . . . . . . . 2 2 . 1 . 023 nuclear build core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 45.5 mm-40 -153.4 164.51 38.03 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 125.486 1.514 . . . . 0.0 111.979 -169.516 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 98.4 m-70 -83.74 133.08 34.8 Favored 'General case' 0 CA--C 1.542 0.637 0 O-C-N 121.653 -0.655 . . . . 0.0 109.259 158.359 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 84.0 mt -150.49 135.17 17.4 Favored 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 124.83 1.252 . . . . 0.0 109.97 -170.722 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 3.6 t -154.45 155.54 35.12 Favored 'General case' 0 N--CA 1.468 0.439 0 O-C-N 121.488 -0.757 . . . . 0.0 111.869 -179.925 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 52.84 -129.3 38.37 Favored Glycine 0 N--CA 1.47 0.944 0 C-N-CA 124.923 1.249 . . . . 0.0 113.536 176.393 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 28.3 p -56.78 -36.48 69.9 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 125.028 1.331 . . . . 0.0 113.065 178.662 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 75.3 m-70 -73.76 -29.62 62.32 Favored 'General case' 0 CA--C 1.541 0.631 0 O-C-N 120.883 -1.136 . . . . 0.0 113.07 177.181 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 35.9 tp -71.59 -42.1 68.16 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 119.172 0.896 . . . . 0.0 110.774 170.291 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 49.7 t -59.07 -41.48 83.59 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.074 0 C-N-CA 124.032 0.933 . . . . 0.0 111.526 172.24 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 43.3 tt0 -63.78 -47.29 81.52 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 125.631 1.572 . . . . 0.0 111.779 174.655 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.8 -43.86 97.69 Favored 'General case' 0 CA--C 1.537 0.447 0 O-C-N 121.749 -0.594 . . . . 0.0 111.61 179.168 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 40.1 mt -56.69 -52.45 64.89 Favored 'General case' 0 N--CA 1.465 0.318 0 C-N-CA 123.675 0.79 . . . . 0.0 111.307 172.181 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 77.2 t80 -53.16 -41.39 65.11 Favored 'General case' 0 CA--C 1.542 0.658 0 N-CA-C 112.803 0.668 . . . . 0.0 112.803 176.044 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 88.6 mt -75.24 -36.44 61.29 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 124.401 1.08 . . . . 0.0 113.525 179.962 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 36.9 t -71.25 -41.38 74.8 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.038 0 C-N-CA 124.249 1.02 . . . . 0.0 110.617 176.186 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 86.3 m -81.47 -38.77 25.85 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 123.825 0.85 . . . . 0.0 112.246 -175.175 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 62.26 -100.52 0.31 Allowed Glycine 0 N--CA 1.472 1.048 0 C-N-CA 124.483 1.039 . . . . 0.0 112.813 172.051 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -69.93 -31.29 68.98 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 124.824 1.249 . . . . 0.0 112.458 174.302 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 1.3 mpp_? -75.52 153.88 37.21 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.072 0.949 . . . . 0.0 110.426 170.243 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . -81.44 -164.9 33.74 Favored Glycine 0 CA--C 1.531 1.064 0 C-N-CA 124.027 0.822 . . . . 0.0 111.26 165.12 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 51.3 p90 -154.63 156.92 37.39 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 124.192 0.997 . . . . 0.0 113.503 177.847 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 60.3 t80 . . . . . 0 CA--C 1.541 0.632 0 C-N-CA 125.08 1.352 . . . . 0.0 113.704 -176.103 . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 99.1 t . . . . . 0 N--CA 1.481 1.083 0 CA-C-O 119.401 -0.333 . . . . 0.0 110.809 . . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 5.5 pm0 -67.5 -32.45 73.27 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 124.388 1.075 . . . . 0.0 111.265 171.904 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 8.5 tt0 -66.41 -38.19 86.92 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 124.24 1.016 . . . . 0.0 111.617 179.726 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 3.3 t -88.79 -16.76 31.3 Favored 'General case' 0 CA--C 1.544 0.719 0 N-CA-C 114.247 1.203 . . . . 0.0 114.247 176.01 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 52.5 t -97.92 -53.53 3.37 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 124.864 1.266 . . . . 0.0 113.633 -175.819 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 38.5 m -77.97 -47.36 18.72 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 125.396 1.478 . . . . 0.0 109.701 -179.245 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 74.7 m -90.47 -152.85 0.28 Allowed 'General case' 0 CA--C 1.551 1.01 0 C-N-CA 123.737 0.815 . . . . 0.0 109.888 158.224 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 28.8 pt -132.13 154.57 40.37 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.99 0 O-C-N 120.485 -1.384 . . . . 0.0 111.902 -176.821 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 1.1 p -149.94 164.89 34.24 Favored 'General case' 0 N--CA 1.468 0.468 0 N-CA-C 112.98 0.733 . . . . 0.0 112.98 168.89 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 2.8 t -111.9 166.41 11.24 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 124.674 1.19 . . . . 0.0 113.521 -177.414 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 71.1 mt -59.15 -34.42 72.05 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 124.359 1.064 . . . . 0.0 111.967 178.107 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 78.1 m-85 -63.97 -28.77 70.04 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 124.276 1.03 . . . . 0.0 113.476 173.671 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 55.8 mt-30 -81.17 -37.76 28.22 Favored 'General case' 0 N--CA 1.467 0.405 0 C-N-CA 123.778 0.831 . . . . 0.0 110.916 173.65 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 45.0 mt -56.02 -44.89 79.16 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 119.132 0.878 . . . . 0.0 111.086 170.524 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -60.84 -30.91 70.4 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 124.117 0.967 . . . . 0.0 112.959 177.448 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 27.2 t30 -80.64 -31.44 36.47 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 124.341 1.056 . . . . 0.0 112.832 174.608 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 19.6 m-30 -68.15 -37.17 80.76 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 123.975 0.91 . . . . 0.0 112.212 173.466 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 72.1 m . . . . . 0 N--CA 1.473 0.717 0 N-CA-C 113.602 0.964 . . . . 0.0 113.602 178.482 . . . . . . . . 0 0 . 1 . 024 nuclear build core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 11.0 m120 . . . . . 0 CA--C 1.542 0.645 0 CA-C-O 121.652 0.739 . . . . 0.0 112.951 . . . . . . . . . 0 0 . 1 . 024 nuclear build core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 27.7 mm-40 -145.15 164.81 30.14 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 125.373 1.469 . . . . 0.0 110.511 178.499 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 90.4 m-70 -83.59 117.21 23.0 Favored 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 107.785 -1.191 . . . . 0.0 107.785 160.832 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 94.3 mt -129.22 131.74 47.12 Favored 'General case' 0 N--CA 1.462 0.164 0 C-N-CA 124.859 1.263 . . . . 0.0 108.532 178.704 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -142.97 153.76 43.34 Favored 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 124.267 1.027 . . . . 0.0 111.517 -173.867 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 48.23 -126.69 15.55 Favored Glycine 0 N--CA 1.471 0.98 0 C-N-CA 125.578 1.561 . . . . 0.0 114.338 170.047 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 16.0 p -59.88 -38.91 83.58 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 124.579 1.152 . . . . 0.0 112.618 179.46 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 26.7 m170 -65.23 -37.87 88.63 Favored 'General case' 0 CA--C 1.544 0.718 0 O-C-N 121.076 -1.015 . . . . 0.0 111.803 177.74 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 56.6 tp -67.9 -44.23 77.44 Favored 'General case' 0 N--CA 1.466 0.37 0 C-N-CA 123.405 0.682 . . . . 0.0 111.117 172.234 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 53.5 t -59.02 -38.8 76.09 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.973 0 CA-C-N 118.836 0.744 . . . . 0.0 111.978 174.92 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -66.3 -45.71 79.44 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 123.87 0.868 . . . . 0.0 111.579 173.815 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.07 -46.37 90.92 Favored 'General case' 0 CA--C 1.543 0.681 0 CA-C-N 119.296 0.953 . . . . 0.0 111.901 176.794 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 32.5 mt -54.76 -50.28 68.82 Favored 'General case' 0 N--CA 1.466 0.333 0 C-N-CA 124.574 1.149 . . . . 0.0 111.436 173.174 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 88.4 t80 -62.36 -36.55 82.59 Favored 'General case' 0 CA--C 1.543 0.706 0 O-C-N 121.2 -0.938 . . . . 0.0 113.331 177.04 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 76.3 mt -73.01 -33.12 65.56 Favored 'General case' 0 N--CA 1.469 0.495 0 O-C-N 121.155 -0.966 . . . . 0.0 113.296 177.677 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 84.5 t -81.21 -37.1 15.49 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.93 0 C-N-CA 123.945 0.898 . . . . 0.0 111.469 176.869 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 44.0 m -124.8 6.03 8.09 Favored 'General case' 0 N--CA 1.473 0.691 0 N-CA-C 115.587 1.699 . . . . 0.0 115.587 -163.05 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . -57.53 -27.16 58.14 Favored Glycine 0 N--CA 1.479 1.533 0 N-CA-C 116.302 1.281 . . . . 0.0 116.302 -166.523 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -81.39 -21.55 38.91 Favored 'General case' 0 CA--C 1.548 0.871 0 N-CA-C 114.13 1.159 . . . . 0.0 114.13 174.709 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 75.9 mtp180 -91.52 -42.36 10.29 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 126.199 1.8 . . . . 0.0 112.23 177.961 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 97.31 136.98 9.35 Favored Glycine 0 CA--C 1.531 1.049 0 C-N-CA 125.651 1.596 . . . . 0.0 110.558 -163.155 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 46.8 p90 -105.1 165.12 11.31 Favored 'General case' 0 CA--C 1.538 0.519 0 N-CA-C 114.198 1.184 . . . . 0.0 114.198 -172.625 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 69.9 t80 . . . . . 0 CA--C 1.536 0.414 0 C-N-CA 126.391 1.876 . . . . 0.0 109.92 175.609 . . . . . . . . 0 0 . 1 . 025 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 45.3 t . . . . . 0 N--CA 1.481 1.084 0 CA-C-O 119.603 -0.237 . . . . 0.0 111.53 . . . . . . . . . 0 0 . 1 . 025 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 24.6 tt0 -78.8 -44.04 24.03 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-O 118.935 -0.555 . . . . 0.0 111.308 174.599 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -58.58 -49.79 76.18 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-N 118.572 0.624 . . . . 0.0 111.455 -177.558 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 16.5 m -60.89 -22.5 64.38 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 124.183 0.993 . . . . 0.0 113.392 176.935 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 49.7 t -96.93 -50.41 4.65 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 124.586 1.155 . . . . 0.0 112.824 -173.677 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 3.1 t -78.39 -35.46 47.16 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.398 1.079 . . . . 0.0 112.054 -179.221 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 30.9 m -107.74 -161.6 0.79 Allowed 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.235 1.414 . . . . 0.0 109.183 165.146 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 26.8 pt -109.49 157.55 9.83 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.734 0 C-N-CA 124.515 1.126 . . . . 0.0 110.878 174.787 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 18.1 p -140.62 160.39 40.13 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-O 121.615 0.721 . . . . 0.0 112.387 171.835 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 4.1 m -96.08 149.36 21.69 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 124.874 1.269 . . . . 0.0 111.896 -169.414 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 55.5 mt -57.27 -33.26 67.44 Favored 'General case' 0 N--CA 1.474 0.73 0 O-C-N 121.09 -1.006 . . . . 0.0 111.833 167.893 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 80.6 t80 -63.71 -30.81 71.86 Favored 'General case' 0 CA--C 1.543 0.682 0 N-CA-C 113.46 0.911 . . . . 0.0 113.46 172.491 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 45.9 mm-40 -80.99 -34.46 32.98 Favored 'General case' 0 CA--C 1.534 0.358 0 O-C-N 121.46 -0.775 . . . . 0.0 111.05 174.099 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 38.4 mt -58.18 -37.2 74.26 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 119.602 1.092 . . . . 0.0 111.296 167.095 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.43 ' HA ' ' SG ' ' A' ' 20' ' ' CYS . 24.7 tt0 -68.97 -35.3 76.58 Favored 'General case' 0 CA--C 1.545 0.768 0 N-CA-C 112.619 0.6 . . . . 0.0 112.619 173.74 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 62.3 t30 -64.74 -22.92 67.09 Favored 'General case' 0 CA--C 1.553 1.072 0 O-C-N 121.009 -1.057 . . . . 0.0 112.257 171.988 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 16.0 m-30 -91.65 -0.16 57.55 Favored 'General case' 0 CA--C 1.551 1.008 0 C-N-CA 125.802 1.641 . . . . 0.0 113.562 177.378 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.43 ' SG ' ' HA ' ' A' ' 17' ' ' GLU . 81.6 m . . . . . 0 N--CA 1.474 0.752 0 O-C-N 121.063 -1.023 . . . . 0.0 113.639 172.572 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 61.6 m-20 . . . . . 0 N--CA 1.47 0.574 0 CA-C-O 120.63 0.252 . . . . 0.0 111.601 . . . . . . . . . 0 0 . 1 . 025 nuclear build core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 38.3 mt-30 -143.26 158.7 43.4 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 124.445 1.098 . . . . 0.0 111.229 -179.257 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 95.8 m-70 -80.28 127.33 32.24 Favored 'General case' 0 CA--C 1.539 0.522 0 N-CA-C 108.639 -0.874 . . . . 0.0 108.639 156.623 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 98.5 mt -140.23 123.0 16.41 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 125.59 1.556 . . . . 0.0 109.242 -175.142 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 57.7 m -130.73 138.81 50.16 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 124.891 1.277 . . . . 0.0 110.727 -174.176 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 54.43 -123.67 28.78 Favored Glycine 0 N--CA 1.473 1.101 0 C-N-CA 124.86 1.219 . . . . 0.0 114.029 166.522 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 17.8 p -59.9 -35.47 74.93 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 124.35 1.06 . . . . 0.0 112.387 179.973 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 24.2 m80 -67.69 -38.27 83.44 Favored 'General case' 0 CA--C 1.541 0.607 0 O-C-N 121.25 -0.906 . . . . 0.0 111.714 177.817 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 60.1 tp -67.5 -44.92 77.32 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 123.639 0.776 . . . . 0.0 111.213 172.206 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 53.1 t -60.45 -38.54 78.25 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.131 0 C-N-CA 123.614 0.766 . . . . 0.0 111.761 177.023 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 33.2 mm-40 -68.62 -43.89 75.41 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 123.855 0.862 . . . . 0.0 111.91 173.258 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.36 -43.62 98.56 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-N 119.278 0.944 . . . . 0.0 112.253 176.746 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 44.5 mt -55.48 -54.57 42.26 Favored 'General case' 0 N--CA 1.467 0.412 0 C-N-CA 124.803 1.241 . . . . 0.0 110.84 171.771 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 81.9 t80 -55.19 -40.75 71.11 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 123.48 0.712 . . . . 0.0 112.884 177.471 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 83.0 mt -75.74 -34.38 60.3 Favored 'General case' 0 CA--C 1.534 0.358 0 N-CA-C 113.645 0.979 . . . . 0.0 113.645 -179.121 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 42.9 t -72.73 -42.35 61.98 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.922 0 CA-C-N 118.666 0.666 . . . . 0.0 110.642 174.29 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 75.5 m -83.43 -35.6 24.88 Favored 'General case' 0 N--CA 1.466 0.37 0 N-CA-C 113.539 0.941 . . . . 0.0 113.539 -173.21 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 62.54 -131.43 44.09 Favored Glycine 0 CA--C 1.532 1.094 0 C-N-CA 123.839 0.733 . . . . 0.0 111.66 -175.973 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -63.28 -18.85 64.02 Favored 'General case' 0 CA--C 1.55 0.96 0 C-N-CA 124.942 1.297 . . . . 0.0 113.512 179.452 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 85.4 mtm180 -66.17 -21.9 66.34 Favored 'General case' 0 N--CA 1.477 0.919 0 N-CA-C 113.924 1.083 . . . . 0.0 113.924 -177.567 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.73 -178.43 39.5 Favored Glycine 0 CA--C 1.534 1.236 0 C-N-CA 124.658 1.123 . . . . 0.0 112.154 -172.934 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 53.4 p90 -159.86 164.57 33.48 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 124.368 1.067 . . . . 0.0 113.421 -177.299 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 93.6 t80 . . . . . 0 CA--C 1.535 0.389 0 C-N-CA 124.776 1.23 . . . . 0.0 110.635 171.744 . . . . . . . . 0 0 . 1 . 026 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 83.5 t . . . . . 0 N--CA 1.481 1.1 0 CA-C-O 119.376 -0.345 . . . . 0.0 111.028 . . . . . . . . . 0 0 . 1 . 026 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 78.5 mm-40 -70.68 -40.8 72.73 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-N 118.465 0.575 . . . . 0.0 111.329 176.597 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 63.9 tp60 -64.77 -38.9 92.56 Favored 'General case' 0 N--CA 1.463 0.222 0 O-C-N 121.83 -0.544 . . . . 0.0 112.052 -179.252 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 88.3 m -83.03 -31.5 27.39 Favored 'General case' 0 CA--C 1.53 0.204 0 N-CA-C 114.268 1.211 . . . . 0.0 114.268 178.607 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 30.5 t -103.46 -48.47 3.97 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 113.153 0.798 . . . . 0.0 113.153 -169.369 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 34.6 m -79.33 -47.12 16.37 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 124.526 1.131 . . . . 0.0 109.536 178.699 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 71.0 m -94.74 -164.32 1.15 Allowed 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 124.625 1.17 . . . . 0.0 111.255 164.112 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 40.4 pt -109.5 149.35 12.66 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 C-N-CA 124.694 1.198 . . . . 0.0 110.885 169.254 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 17.5 p -128.33 158.42 38.27 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 123.567 0.747 . . . . 0.0 112.028 174.149 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 61.5 p -98.67 160.03 14.55 Favored 'General case' 0 N--CA 1.468 0.441 0 N-CA-C 114.003 1.112 . . . . 0.0 114.003 -179.857 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 59.7 mt -60.88 -35.46 76.7 Favored 'General case' 0 CA--C 1.54 0.573 0 O-C-N 121.646 -0.659 . . . . 0.0 111.452 172.107 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 91.6 t80 -62.57 -35.45 79.54 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 124.118 0.967 . . . . 0.0 112.896 172.641 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 84.3 mt-30 -74.16 -35.4 64.03 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 123.866 0.866 . . . . 0.0 111.884 173.349 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 56.8 mt -63.28 -39.02 93.4 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 119.599 1.091 . . . . 0.0 111.923 171.433 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -60.91 -26.73 67.67 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 124.621 1.168 . . . . 0.0 113.319 -178.989 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 26.3 t30 -57.4 -28.69 63.46 Favored 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 124.261 1.024 . . . . 0.0 113.307 175.521 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 98.2 m-85 -95.07 -2.28 50.47 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 125.146 1.378 . . . . 0.0 114.022 -174.174 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 86.3 m . . . . . 0 CA--C 1.541 0.629 0 N-CA-C 113.938 1.088 . . . . 0.0 113.938 178.701 . . . . . . . . 0 0 . 1 . 026 nuclear build core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 51.4 p30 . . . . . 0 CA--C 1.541 0.634 0 N-CA-C 112.864 0.69 . . . . 0.0 112.864 . . . . . . . . . 0 0 . 1 . 026 nuclear build core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 40.9 mt-30 -151.29 162.53 40.74 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 124.922 1.289 . . . . 0.0 111.722 -164.754 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 84.0 m-70 -82.67 130.16 35.08 Favored 'General case' 0 CA--C 1.541 0.633 0 N-CA-C 109.522 -0.548 . . . . 0.0 109.522 154.589 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 78.5 mt -144.07 126.88 16.24 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 126.391 1.876 . . . . 0.0 108.996 -178.5 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 62.3 m -134.74 140.68 46.12 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 124.986 1.315 . . . . 0.0 110.455 -174.754 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 51.7 -118.88 7.6 Favored Glycine 0 N--CA 1.473 1.137 0 C-N-CA 124.88 1.229 . . . . 0.0 114.022 169.147 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 19.3 m -59.48 -33.92 71.92 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 124.475 1.11 . . . . 0.0 112.688 -179.804 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 93.2 m-70 -72.67 -38.83 67.48 Favored 'General case' 0 CA--C 1.539 0.55 0 O-C-N 121.409 -0.807 . . . . 0.0 111.163 178.196 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 55.7 tp -63.81 -45.87 87.7 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 124.053 0.941 . . . . 0.0 111.056 171.827 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 21.8 t -59.59 -43.28 90.67 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.952 0 C-N-CA 124.614 1.166 . . . . 0.0 111.751 176.171 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -65.57 -46.42 79.53 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 123.175 0.59 . . . . 0.0 111.65 175.683 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.07 -44.01 98.02 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 123.533 0.733 . . . . 0.0 112.058 179.961 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 21.4 mt -54.94 -55.51 29.82 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 124.301 1.041 . . . . 0.0 111.132 173.0 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 79.9 t80 -58.15 -34.51 70.36 Favored 'General case' 0 N--CA 1.472 0.666 0 N-CA-C 113.512 0.93 . . . . 0.0 113.512 179.417 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 86.1 mt -74.79 -40.94 60.85 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 124.661 1.184 . . . . 0.0 113.559 175.062 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 38.7 t -64.49 -42.77 96.19 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.021 0 C-N-CA 123.956 0.903 . . . . 0.0 111.052 174.24 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 61.6 m -73.58 -25.7 60.48 Favored 'General case' 0 CA--C 1.538 0.518 0 N-CA-C 112.611 0.597 . . . . 0.0 112.611 179.264 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 83.77 49.29 4.89 Favored Glycine 0 N--CA 1.471 1.008 0 C-N-CA 124.648 1.118 . . . . 0.0 112.184 171.944 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 36.4 mt-10 78.06 -7.93 1.74 Allowed 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 127.997 2.519 . . . . 0.0 113.362 -177.418 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 32.2 mtp180 -66.47 162.48 20.54 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 125.238 1.415 . . . . 0.0 111.927 168.278 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . -63.63 159.42 38.59 Favored Glycine 0 CA--C 1.532 1.145 0 C-N-CA 124.154 0.883 . . . . 0.0 112.939 174.668 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 56.1 p90 -153.8 175.44 13.3 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 125.518 1.527 . . . . 0.0 111.675 -172.288 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 61.0 t80 . . . . . 0 CA--C 1.536 0.429 0 C-N-CA 124.416 1.086 . . . . 0.0 110.884 178.081 . . . . . . . . 0 0 . 1 . 027 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 25.0 t . . . . . 0 N--CA 1.492 1.659 0 N-CA-C 112.135 0.42 . . . . 0.0 112.135 . . . . . . . . . 0 0 . 1 . 027 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -68.74 -16.52 63.83 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.536 1.134 . . . . 0.0 113.391 -179.867 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 36.7 tt0 -91.82 -57.11 2.85 Favored 'General case' 0 C--O 1.225 -0.207 0 C-N-CA 123.633 0.773 . . . . 0.0 109.474 162.73 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 64.0 m -63.28 -29.89 71.13 Favored 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 114.779 1.4 . . . . 0.0 114.779 -165.412 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 26.7 t -96.18 -38.87 9.96 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 123.872 0.869 . . . . 0.0 112.458 -175.513 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 27.3 m -83.08 -39.21 21.45 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 125.536 1.534 . . . . 0.0 111.766 -179.425 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 22.6 t -114.29 -135.7 0.36 Allowed 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 126.953 2.101 . . . . 0.0 108.768 168.291 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 16.0 pt -133.2 151.18 33.45 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.727 0 C-N-CA 125.901 1.681 . . . . 0.0 111.964 -178.507 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 66.9 m -125.41 158.32 34.64 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 125.392 1.477 . . . . 0.0 111.096 170.38 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 10.5 t -109.52 158.36 18.07 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 124.248 1.019 . . . . 0.0 112.49 175.566 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 45.0 mt -58.87 -35.26 72.69 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 125.297 1.439 . . . . 0.0 111.735 178.942 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 76.2 t80 -62.46 -29.9 70.86 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 124.33 1.052 . . . . 0.0 113.188 173.34 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 94.9 mt-30 -81.63 -33.68 31.3 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 124.313 1.045 . . . . 0.0 110.529 176.586 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 44.1 mt -65.56 -37.98 88.24 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 123.546 0.738 . . . . 0.0 112.129 171.76 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 29.1 tt0 -60.04 -24.32 64.43 Favored 'General case' 0 CA--C 1.544 0.73 0 N-CA-C 113.62 0.971 . . . . 0.0 113.62 -178.901 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 17.3 t-20 -58.47 -23.35 57.57 Favored 'General case' 0 CA--C 1.549 0.939 0 N-CA-C 113.637 0.977 . . . . 0.0 113.637 174.774 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 96.5 m-85 -97.92 0.98 47.52 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.479 1.511 . . . . 0.0 114.195 -177.601 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 60.3 m . . . . . 0 N--CA 1.473 0.722 0 N-CA-C 113.226 0.824 . . . . 0.0 113.226 173.29 . . . . . . . . 0 0 . 1 . 027 nuclear build core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 10.6 m120 . . . . . 0 CA--C 1.539 0.541 0 CA-C-O 121.059 0.457 . . . . 0.0 112.063 . . . . . . . . . 0 0 . 1 . 027 nuclear build core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 38.1 mt-30 -144.87 157.34 44.19 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.16 1.384 . . . . 0.0 110.985 -177.985 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 99.2 m-70 -79.57 127.1 31.74 Favored 'General case' 0 CA--C 1.538 0.508 0 N-CA-C 108.61 -0.885 . . . . 0.0 108.61 160.774 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 98.8 mt -143.21 120.76 11.75 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 125.489 1.516 . . . . 0.0 109.914 -173.165 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 58.1 m -127.54 136.94 52.41 Favored 'General case' 0 N--CA 1.467 0.41 0 C-N-CA 125.066 1.346 . . . . 0.0 110.703 -176.878 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 48.43 -116.57 3.21 Favored Glycine 0 CA--C 1.531 1.046 0 C-N-CA 125.208 1.385 . . . . 0.0 114.275 167.556 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 21.1 m -59.31 -34.6 72.52 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 124.39 1.076 . . . . 0.0 112.651 -178.986 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 94.8 m-70 -72.22 -36.74 69.23 Favored 'General case' 0 CA--C 1.542 0.67 0 O-C-N 121.268 -0.895 . . . . 0.0 111.404 177.891 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 58.8 tp -65.77 -45.51 82.24 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 123.69 0.796 . . . . 0.0 110.99 171.963 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 53.6 t -62.65 -37.15 78.25 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.042 0 C-N-CA 124.381 1.073 . . . . 0.0 111.76 176.916 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -66.19 -47.08 75.1 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 123.627 0.771 . . . . 0.0 111.336 172.593 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.57 -43.53 97.18 Favored 'General case' 0 CA--C 1.539 0.539 0 O-C-N 121.521 -0.737 . . . . 0.0 111.996 177.792 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 18.3 mt -53.16 -56.16 18.57 Favored 'General case' 0 N--CA 1.468 0.448 0 C-N-CA 124.673 1.189 . . . . 0.0 111.175 172.037 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 71.5 t80 -55.82 -41.99 75.03 Favored 'General case' 0 CA--C 1.542 0.646 0 N-CA-C 113.151 0.797 . . . . 0.0 113.151 177.41 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 87.6 mt -72.36 -34.72 68.18 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 124.281 1.032 . . . . 0.0 113.134 -179.461 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 28.6 t -66.79 -43.92 89.54 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.909 0 C-N-CA 123.804 0.842 . . . . 0.0 110.624 172.464 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 82.6 m -72.43 -35.98 68.46 Favored 'General case' 0 CA--C 1.539 0.557 0 N-CA-C 112.206 0.447 . . . . 0.0 112.206 -177.85 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 68.51 -109.51 2.94 Favored Glycine 0 CA--C 1.528 0.885 0 C-N-CA 125.136 1.35 . . . . 0.0 112.112 170.512 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -68.85 -27.75 66.1 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 124.362 1.065 . . . . 0.0 112.199 173.575 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 82.6 mtm180 -74.16 154.59 39.03 Favored 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 124.968 1.307 . . . . 0.0 111.019 175.323 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . -80.62 -173.1 46.39 Favored Glycine 0 CA--C 1.527 0.801 0 C-N-CA 123.985 0.802 . . . . 0.0 111.316 168.721 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 15.3 p90 -162.0 165.43 27.39 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 124.7 1.2 . . . . 0.0 112.213 176.161 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 88.2 t80 . . . . . 0 CA--C 1.535 0.378 0 C-N-CA 123.544 0.738 . . . . 0.0 111.696 167.074 . . . . . . . . 0 0 . 1 . 028 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 76.2 t . . . . . 0 N--CA 1.48 1.031 0 N-CA-C 113.406 0.891 . . . . 0.0 113.406 . . . . . . . . . 0 0 . 1 . 028 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 67.3 mm-40 -69.21 -42.58 75.56 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 118.693 0.679 . . . . 0.0 111.389 177.517 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 17.0 tm0? -61.72 -48.45 80.67 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 123.895 0.878 . . . . 0.0 111.346 -174.49 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 5.0 t -75.66 -12.45 60.2 Favored 'General case' 0 N--CA 1.472 0.646 0 N-CA-C 113.642 0.979 . . . . 0.0 113.642 -179.866 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 25.2 t -87.25 -43.47 12.17 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 124.88 1.272 . . . . 0.0 112.519 177.119 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 74.2 p -86.37 -43.26 13.0 Favored 'General case' 0 N--CA 1.478 0.966 0 C-N-CA 124.408 1.083 . . . . 0.0 112.268 177.952 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 17.5 t -104.52 -149.6 0.41 Allowed 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 125.807 1.643 . . . . 0.0 109.75 169.589 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 27.6 pt -125.94 157.03 36.08 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.728 0 C-N-CA 125.577 1.551 . . . . 0.0 112.286 -178.081 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 17.3 p -143.1 159.66 41.86 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 124.307 1.043 . . . . 0.0 112.157 170.779 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 8.5 t -105.76 162.81 13.22 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 124.885 1.274 . . . . 0.0 112.799 -177.646 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 53.0 mt -58.64 -35.59 72.75 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 124.773 1.229 . . . . 0.0 111.882 179.646 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 69.7 t80 -64.17 -28.58 69.85 Favored 'General case' 0 CA--C 1.547 0.829 0 N-CA-C 113.722 1.008 . . . . 0.0 113.722 173.598 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 75.2 mt-30 -83.32 -33.26 25.96 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 124.269 1.028 . . . . 0.0 110.997 175.495 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 83.2 mt -63.32 -38.14 90.01 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-N 118.576 0.626 . . . . 0.0 111.907 168.858 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 28.8 tt0 -62.23 -23.77 66.85 Favored 'General case' 0 CA--C 1.542 0.651 0 N-CA-C 113.566 0.951 . . . . 0.0 113.566 -179.691 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 29.7 t30 -57.25 -25.92 59.92 Favored 'General case' 0 CA--C 1.549 0.918 0 O-C-N 120.969 -1.082 . . . . 0.0 113.309 173.425 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 97.4 m-85 -96.73 0.84 50.18 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 125.411 1.484 . . . . 0.0 113.735 -175.744 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 61.2 m . . . . . 0 N--CA 1.474 0.727 0 CA-C-N 119.252 0.933 . . . . 0.0 113.143 175.69 . . . . . . . . 0 0 . 1 . 028 nuclear build core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 39.4 p30 . . . . . 0 CA--C 1.541 0.612 0 N-CA-C 113.401 0.889 . . . . 0.0 113.401 . . . . . . . . . 0 0 . 1 . 028 nuclear build core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 39.0 mt-30 -147.48 160.35 42.69 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 125.234 1.413 . . . . 0.0 110.947 -170.22 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 99.3 m-70 -82.18 129.11 34.75 Favored 'General case' 0 CA--C 1.539 0.537 0 N-CA-C 108.156 -1.053 . . . . 0.0 108.156 159.51 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 87.0 mt -145.17 134.18 22.59 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 125.025 1.33 . . . . 0.0 109.211 -176.972 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 4.1 t -151.97 153.82 34.83 Favored 'General case' 0 C--O 1.235 0.342 0 C-N-CA 123.02 0.528 . . . . 0.0 111.786 -174.867 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 49.62 -128.66 24.75 Favored Glycine 0 CA--C 1.53 0.97 0 C-N-CA 125.465 1.507 . . . . 0.0 113.799 175.743 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 18.6 m -58.78 -33.45 70.32 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 124.53 1.132 . . . . 0.0 112.824 -179.136 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 80.8 m-70 -76.78 -26.74 54.81 Favored 'General case' 0 CA--C 1.54 0.578 0 O-C-N 121.073 -1.017 . . . . 0.0 112.875 177.857 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 42.6 tp -72.58 -42.26 64.79 Favored 'General case' 0 N--CA 1.468 0.457 0 O-C-N 121.225 -0.922 . . . . 0.0 111.07 168.28 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 55.8 t -59.28 -41.7 84.88 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.003 0 C-N-CA 123.794 0.838 . . . . 0.0 111.378 172.714 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 43.7 tt0 -62.47 -47.35 84.39 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 125.633 1.573 . . . . 0.0 111.823 173.44 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.25 -44.95 95.38 Favored 'General case' 0 CA--C 1.539 0.541 0 O-C-N 121.927 -0.483 . . . . 0.0 112.245 178.276 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 39.6 mt -55.92 -51.48 67.47 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 124.204 1.002 . . . . 0.0 111.092 173.265 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 68.1 t80 -55.32 -43.66 75.1 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 123.619 0.768 . . . . 0.0 113.058 175.262 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 89.8 mt -74.75 -32.86 62.21 Favored 'General case' 0 N--CA 1.471 0.619 0 N-CA-C 113.595 0.961 . . . . 0.0 113.595 -178.478 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 30.4 t -70.91 -43.58 76.67 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 C-N-CA 123.998 0.919 . . . . 0.0 110.466 173.655 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 76.1 m -81.62 -36.55 28.79 Favored 'General case' 0 CA--C 1.533 0.302 0 N-CA-C 113.533 0.938 . . . . 0.0 113.533 -173.855 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . -50.84 131.89 32.04 Favored Glycine 0 CA--C 1.538 1.521 0 C-N-CA 124.324 0.964 . . . . 0.0 113.37 -168.415 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -80.14 -3.59 49.46 Favored 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 128.468 2.707 . . . . 0.0 115.496 10.908 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 75.3 mtm180 -64.2 155.32 32.17 Favored 'General case' 0 N--CA 1.475 0.798 0 CA-C-N 119.567 1.076 . . . . 0.0 110.708 174.628 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . -78.69 -174.08 43.96 Favored Glycine 0 N--CA 1.471 0.972 0 C-N-CA 124.147 0.88 . . . . 0.0 111.519 169.825 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 45.6 p90 -157.02 155.69 31.64 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 123.882 0.873 . . . . 0.0 112.927 -179.075 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 68.3 t80 . . . . . 0 CA--C 1.538 0.491 0 C-N-CA 125.628 1.571 . . . . 0.0 111.205 173.068 . . . . . . . . 0 0 . 1 . 029 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 47.2 t . . . . . 0 N--CA 1.481 1.12 0 N-CA-C 111.343 0.127 . . . . 0.0 111.343 . . . . . . . . . 0 0 . 1 . 029 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -70.75 -54.94 9.82 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 124.114 0.965 . . . . 0.0 110.099 169.956 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 6.7 tt0 -56.91 -49.08 76.68 Favored 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 123.999 0.919 . . . . 0.0 112.117 -174.121 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 63.7 m -62.33 -28.24 69.61 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 114.006 1.113 . . . . 0.0 114.006 -179.094 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 18.6 t -102.1 -36.39 8.57 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 123.806 0.842 . . . . 0.0 112.763 -171.736 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 92.4 m -82.78 -29.51 29.57 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 126.228 1.811 . . . . 0.0 111.713 175.524 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 9.9 t -135.98 -156.26 0.7 Allowed 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 125.616 1.566 . . . . 0.0 110.697 177.124 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 28.1 mm -93.5 147.35 5.55 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.74 0 C-N-CA 125.408 1.483 . . . . 0.0 109.814 172.047 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 19.1 p -132.73 159.01 40.92 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 123.514 0.726 . . . . 0.0 112.486 163.665 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 53.3 p -100.08 162.72 12.8 Favored 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 113.788 1.033 . . . . 0.0 113.788 -175.22 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 78.4 mt -64.22 -33.54 76.03 Favored 'General case' 0 CA--C 1.536 0.421 0 O-C-N 121.344 -0.848 . . . . 0.0 111.5 172.126 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 87.2 t80 -66.78 -34.01 76.89 Favored 'General case' 0 CA--C 1.544 0.713 0 O-C-N 121.459 -0.776 . . . . 0.0 112.845 173.058 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 78.3 mt-30 -71.38 -37.04 71.61 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 123.556 0.742 . . . . 0.0 111.312 173.36 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 95.6 mt -60.98 -42.68 98.82 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-N 119.144 0.884 . . . . 0.0 111.245 167.346 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 56.6 tt0 -64.75 -31.13 72.22 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 123.353 0.661 . . . . 0.0 112.722 178.495 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 18.6 t-20 -64.2 -22.49 66.96 Favored 'General case' 0 CA--C 1.551 0.987 0 O-C-N 121.044 -1.035 . . . . 0.0 112.846 173.129 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 23.5 m-85 -95.73 0.47 52.52 Favored 'General case' 0 CA--C 1.55 0.958 0 C-N-CA 125.686 1.595 . . . . 0.0 113.338 171.661 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 76.4 m . . . . . 0 CA--C 1.542 0.639 0 O-C-N 120.649 -1.282 . . . . 0.0 112.133 165.772 . . . . . . . . 0 0 . 1 . 029 nuclear build core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . 0.316 6.2 p30 . . . . . 0 CA--C 1.543 0.696 0 N-CA-C 114.162 1.171 . . . . 0.0 114.162 . . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 78.1 mt-30 -156.09 168.42 27.33 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 123.734 0.814 . . . . 0.0 113.149 -162.939 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 93.5 m-70 -84.52 134.21 34.43 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 123.628 0.771 . . . . 0.0 109.53 158.173 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 75.4 mt -148.34 131.91 16.78 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 126.277 1.831 . . . . 0.0 109.895 -176.861 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 85.5 m -135.97 144.52 45.44 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 124.992 1.317 . . . . 0.0 110.911 -177.596 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 52.46 -125.21 28.35 Favored Glycine 0 N--CA 1.474 1.199 0 C-N-CA 125.464 1.507 . . . . 0.0 114.248 165.414 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 27.5 m -58.21 -38.46 76.82 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 123.671 0.788 . . . . 0.0 112.296 -179.196 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 17.5 m-70 -72.33 -32.17 66.29 Favored 'General case' 0 CA--C 1.54 0.565 0 O-C-N 121.142 -0.974 . . . . 0.0 112.237 179.253 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 59.2 tp -65.43 -43.6 89.96 Favored 'General case' 0 CA--C 1.534 0.346 0 O-C-N 121.629 -0.669 . . . . 0.0 111.112 168.708 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 55.4 t -62.3 -40.49 88.03 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.942 0 C-N-CA 123.696 0.798 . . . . 0.0 111.661 175.684 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -62.93 -48.14 80.2 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 124.218 1.007 . . . . 0.0 111.613 173.368 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.63 -44.72 96.02 Favored 'General case' 0 CA--C 1.538 0.497 0 O-C-N 121.759 -0.588 . . . . 0.0 112.224 178.709 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 60.7 tp -57.07 -53.37 58.89 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 123.995 0.918 . . . . 0.0 110.571 174.494 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 9.9 m-30 -55.72 -38.62 69.98 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 123.328 0.651 . . . . 0.0 112.514 178.038 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 76.5 mt -71.65 -35.44 70.36 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 124.42 1.088 . . . . 0.0 113.137 177.758 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 55.3 t -70.44 -40.58 77.71 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.055 0 C-N-CA 123.754 0.822 . . . . 0.0 110.972 173.324 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 57.7 m -75.64 -35.52 60.42 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 113.075 0.769 . . . . 0.0 113.075 -178.747 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 59.02 -129.63 49.89 Favored Glycine 0 CA--C 1.532 1.107 0 N-CA-C 111.544 -0.622 . . . . 0.0 111.544 -174.942 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -75.66 -9.92 59.0 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 124.528 1.131 . . . . 0.0 114.035 179.566 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 60.1 mtp180 -65.95 -35.51 80.79 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 123.957 0.903 . . . . 0.0 113.251 -176.009 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 95.46 158.79 32.72 Favored Glycine 0 CA--C 1.532 1.152 0 C-N-CA 125.366 1.46 . . . . 0.0 113.069 -169.714 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 33.0 p90 -122.77 168.12 12.63 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 125.848 1.659 . . . . 0.0 113.117 -173.192 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 80.9 t80 . . . . . 0 CA--C 1.54 0.59 0 C-N-CA 125.823 1.649 . . . . 0.0 109.239 161.057 . . . . . . . . 0 0 . 1 . 030 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 11.0 t . . . . . 0 N--CA 1.479 0.996 0 CA-C-O 120.301 0.096 . . . . 0.0 111.08 . . . . . . . . . 0 0 . 1 . 030 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 29.7 mm-40 -79.15 8.88 5.11 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.963 1.305 . . . . 0.0 112.535 178.402 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -115.71 -53.63 2.57 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 124.729 1.212 . . . . 0.0 109.993 162.314 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 11.7 m -65.85 -28.48 69.0 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 115.392 1.627 . . . . 0.0 115.392 -173.954 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 42.6 t -92.86 -45.41 8.0 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-N 118.667 0.667 . . . . 0.0 111.927 -178.12 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 23.1 p -68.76 -35.98 77.75 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 126.806 2.042 . . . . 0.0 112.601 -179.308 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 65.0 m -132.76 -171.43 2.66 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 126.42 1.888 . . . . 0.0 110.775 179.064 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 30.3 mm -75.88 142.27 14.68 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.793 0 O-C-N 120.565 -1.335 . . . . 0.0 110.767 172.341 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 14.1 p -134.15 160.58 37.39 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 123.547 0.739 . . . . 0.0 112.461 158.758 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 37.4 t -101.99 159.79 15.06 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 124.889 1.276 . . . . 0.0 112.523 -178.225 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 40.2 mt -63.35 -30.41 71.55 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 123.594 0.758 . . . . 0.0 111.518 170.685 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 26.6 m-85 -65.6 -28.74 69.35 Favored 'General case' 0 CA--C 1.544 0.714 0 N-CA-C 113.304 0.853 . . . . 0.0 113.304 171.881 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 79.0 mt-30 -78.78 -38.36 38.67 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-O 118.558 -0.734 . . . . 0.0 110.593 172.598 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 42.6 mt -58.01 -37.96 75.27 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 119.099 0.863 . . . . 0.0 111.549 168.708 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 25.4 tt0 -66.37 -31.99 73.1 Favored 'General case' 0 CA--C 1.546 0.818 0 CA-C-N 118.688 0.676 . . . . 0.0 112.65 175.891 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 32.8 t30 -68.2 -23.97 64.89 Favored 'General case' 0 CA--C 1.548 0.892 0 O-C-N 121.043 -1.035 . . . . 0.0 112.685 171.947 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 10.5 m-30 -86.7 -5.7 59.05 Favored 'General case' 0 CA--C 1.549 0.917 0 C-N-CA 125.326 1.45 . . . . 0.0 113.545 177.455 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 58.2 m . . . . . 0 N--CA 1.472 0.643 0 C-N-CA 123.562 0.745 . . . . 0.0 112.342 169.614 . . . . . . . . 0 0 . 1 . 030 nuclear build core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 4.1 p30 . . . . . 0 CA--C 1.534 0.349 0 CA-C-O 120.823 0.344 . . . . 0.0 110.406 . . . . . . . . . 0 0 . 1 . 030 nuclear build core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 36.2 mt-30 -153.37 166.17 33.48 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 123.821 0.849 . . . . 0.0 112.36 -159.264 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 51.3 m-70 -81.8 132.3 35.28 Favored 'General case' 0 CA--C 1.542 0.664 0 N-CA-C 108.519 -0.919 . . . . 0.0 108.519 156.298 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 72.5 mt -140.73 126.83 19.56 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 125.698 1.599 . . . . 0.0 109.062 -178.263 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 68.7 m -131.14 143.95 51.02 Favored 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 125.053 1.341 . . . . 0.0 110.986 -173.77 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 56.47 -128.42 46.32 Favored Glycine 0 CA--C 1.528 0.866 0 C-N-CA 124.807 1.194 . . . . 0.0 113.927 166.433 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 23.5 p -61.5 -31.79 71.8 Favored 'General case' 0 N--CA 1.467 0.401 0 C-N-CA 124.482 1.113 . . . . 0.0 112.864 179.742 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 26.5 m80 -69.27 -39.99 78.05 Favored 'General case' 0 CA--C 1.54 0.565 0 O-C-N 121.042 -1.037 . . . . 0.0 111.395 175.792 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 50.5 tp -65.13 -45.28 85.71 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 123.379 0.671 . . . . 0.0 111.226 171.917 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 65.8 t -59.55 -43.02 89.93 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.008 0 C-N-CA 123.265 0.626 . . . . 0.0 111.656 176.381 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -65.01 -47.78 76.24 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 123.776 0.83 . . . . 0.0 111.529 177.214 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.92 -46.78 89.32 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 123.022 0.529 . . . . 0.0 111.653 178.632 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 43.8 tp -59.39 -49.99 75.67 Favored 'General case' 0 CA--C 1.533 0.327 0 C-N-CA 124.783 1.233 . . . . 0.0 111.229 176.981 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 63.2 t80 -55.43 -42.56 74.35 Favored 'General case' 0 CA--C 1.54 0.569 0 N-CA-C 113.122 0.786 . . . . 0.0 113.122 174.158 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 88.0 mt -73.88 -31.52 63.18 Favored 'General case' 0 N--CA 1.469 0.517 0 N-CA-C 113.104 0.779 . . . . 0.0 113.104 -179.324 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 41.1 t -68.65 -45.8 80.86 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.763 0 C-N-CA 123.538 0.735 . . . . 0.0 110.618 171.126 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 76.0 m -76.83 -35.15 57.75 Favored 'General case' 0 N--CA 1.469 0.498 0 N-CA-C 113.232 0.827 . . . . 0.0 113.232 -175.207 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 62.62 -130.82 43.53 Favored Glycine 0 CA--C 1.53 1.019 0 C-N-CA 124.284 0.945 . . . . 0.0 111.182 -175.762 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -64.38 -19.75 65.69 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 124.913 1.285 . . . . 0.0 113.57 179.182 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 83.7 mtm180 -64.2 -31.77 73.1 Favored 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 113.661 0.986 . . . . 0.0 113.661 -176.073 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 75.19 178.87 42.9 Favored Glycine 0 CA--C 1.535 1.284 0 C-N-CA 124.412 1.006 . . . . 0.0 112.852 -172.06 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 51.4 p90 -154.78 166.51 33.24 Favored 'General case' 0 CA--C 1.539 0.554 0 N-CA-C 114.179 1.177 . . . . 0.0 114.179 -170.626 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 83.3 t80 . . . . . 0 CA--C 1.54 0.563 0 C-N-CA 125.826 1.65 . . . . 0.0 110.149 167.06 . . . . . . . . 0 0 . 1 . 031 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 21.5 t . . . . . 0 N--CA 1.484 1.239 0 N-CA-C 112.94 0.718 . . . . 0.0 112.94 . . . . . . . . . 0 0 . 1 . 031 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -85.65 -48.26 9.04 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 125.157 1.383 . . . . 0.0 111.405 176.529 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 62.9 tt0 -69.7 -43.68 71.95 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 124.582 1.153 . . . . 0.0 112.193 -172.436 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 74.0 m -74.15 -15.68 61.02 Favored 'General case' 0 N--CA 1.464 0.256 0 N-CA-C 113.595 0.961 . . . . 0.0 113.595 -179.763 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 44.6 t -85.22 -52.62 5.79 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 125.519 1.528 . . . . 0.0 111.783 172.283 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 37.4 p -74.14 -44.32 54.12 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 124.693 1.197 . . . . 0.0 112.476 -176.525 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 50.9 m -101.54 -161.25 0.84 Allowed 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 125.415 1.486 . . . . 0.0 109.737 164.596 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 27.3 pt -112.31 151.38 14.3 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.708 0 O-C-N 120.801 -1.187 . . . . 0.0 111.311 175.309 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 69.6 m -131.1 161.25 32.48 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 124.741 1.216 . . . . 0.0 111.83 172.841 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 47.1 p -97.77 165.19 12.07 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 124.548 1.139 . . . . 0.0 113.385 176.555 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 58.0 mt -63.81 -33.13 74.98 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 123.571 0.748 . . . . 0.0 111.988 171.492 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 88.5 t80 -67.35 -33.66 75.69 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 123.663 0.785 . . . . 0.0 112.891 173.644 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 92.2 mt-30 -73.09 -33.81 65.82 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 123.464 0.705 . . . . 0.0 111.751 173.553 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 90.9 mt -64.94 -39.59 93.73 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 118.766 0.712 . . . . 0.0 111.701 166.555 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 29.8 tt0 -64.2 -30.64 71.69 Favored 'General case' 0 CA--C 1.543 0.698 0 N-CA-C 112.822 0.675 . . . . 0.0 112.822 179.748 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 18.4 t-20 -60.35 -21.62 62.3 Favored 'General case' 0 CA--C 1.551 1.014 0 O-C-N 121.177 -0.952 . . . . 0.0 113.362 172.794 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 27.6 m-85 -99.89 4.97 45.37 Favored 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 126.301 1.84 . . . . 0.0 113.89 177.128 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 74.7 m . . . . . 0 N--CA 1.473 0.682 0 O-C-N 120.65 -1.281 . . . . 0.0 111.877 167.303 . . . . . . . . 0 0 . 1 . 031 nuclear build core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 4.6 m-80 . . . . . 0 CA--C 1.541 0.605 0 CA-C-O 120.66 0.267 . . . . 0.0 111.312 . . . . . . . . . 0 0 . 1 . 031 nuclear build core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 41.9 mt-30 -146.42 157.49 43.77 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 124.549 1.14 . . . . 0.0 111.423 -174.74 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 81.8 m-70 -79.3 125.76 29.91 Favored 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 108.173 -1.047 . . . . 0.0 108.173 157.513 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 93.2 mt -137.93 121.51 17.33 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 125.187 1.395 . . . . 0.0 109.612 -176.086 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 59.0 m -128.48 138.58 52.35 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 125.136 1.375 . . . . 0.0 110.633 -174.402 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 52.64 -121.59 15.69 Favored Glycine 0 N--CA 1.473 1.13 0 C-N-CA 124.773 1.178 . . . . 0.0 113.484 167.369 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 31.7 p -61.96 -31.73 72.1 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 124.799 1.24 . . . . 0.0 113.293 -179.789 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 93.0 m-70 -69.75 -37.53 76.46 Favored 'General case' 0 CA--C 1.54 0.591 0 O-C-N 120.896 -1.128 . . . . 0.0 111.436 174.748 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 6.9 tt -68.0 -43.44 78.88 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-O 118.581 -0.724 . . . . 0.0 110.98 172.035 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 53.2 t -55.86 -45.56 79.8 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.004 0 CA-C-N 118.985 0.811 . . . . 0.0 111.253 173.647 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 7.1 tp10 -63.21 -46.96 84.56 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 123.573 0.749 . . . . 0.0 111.281 178.002 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.64 -48.14 80.67 Favored 'General case' 0 CA--C 1.537 0.481 0 O-C-N 121.609 -0.682 . . . . 0.0 111.808 178.881 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 44.1 tp -60.2 -46.62 89.09 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 125.356 1.462 . . . . 0.0 111.124 178.726 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 67.5 t80 -57.69 -42.67 84.14 Favored 'General case' 0 CA--C 1.539 0.522 0 N-CA-C 113.012 0.745 . . . . 0.0 113.012 173.481 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 83.6 mt -74.45 -32.43 62.6 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 123.771 0.828 . . . . 0.0 112.784 -179.741 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 25.8 t -66.29 -46.91 85.96 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.884 0 C-N-CA 124.268 1.027 . . . . 0.0 110.456 171.471 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 75.8 m -80.44 -32.55 37.26 Favored 'General case' 0 N--CA 1.467 0.398 0 N-CA-C 113.628 0.973 . . . . 0.0 113.628 -174.345 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 64.3 -134.13 39.29 Favored Glycine 0 CA--C 1.529 0.914 0 C-N-CA 124.167 0.889 . . . . 0.0 111.454 -176.397 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -68.84 -12.08 61.16 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 124.497 1.119 . . . . 0.0 113.956 179.448 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 86.5 mtm180 -65.25 -32.27 73.86 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 124.162 0.985 . . . . 0.0 113.058 179.802 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 79.26 -179.98 52.51 Favored Glycine 0 CA--C 1.533 1.16 0 C-N-CA 124.517 1.056 . . . . 0.0 112.626 -171.329 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 48.3 p90 -151.73 161.45 42.65 Favored 'General case' 0 N--CA 1.468 0.449 0 N-CA-C 114.057 1.132 . . . . 0.0 114.057 -174.645 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 82.7 t80 . . . . . 0 CA--C 1.536 0.438 0 C-N-CA 125.807 1.643 . . . . 0.0 109.216 167.627 . . . . . . . . 0 0 . 1 . 032 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 37.9 t . . . . . 0 N--CA 1.477 0.898 0 N-CA-C 111.819 0.303 . . . . 0.0 111.819 . . . . . . . . . 0 0 . 1 . 032 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -77.68 -57.82 3.6 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-N 118.722 0.692 . . . . 0.0 110.201 168.318 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 62.5 tp60 -55.72 -49.83 71.98 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 124.786 1.235 . . . . 0.0 112.76 -174.662 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 89.3 m -62.21 -26.01 68.12 Favored 'General case' 0 N--CA 1.466 0.348 0 C-N-CA 124.644 1.178 . . . . 0.0 113.711 179.295 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 14.0 t -98.4 -39.73 8.64 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 124.278 1.031 . . . . 0.0 112.257 -171.902 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 1.7 t -83.36 -27.61 29.57 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 125.052 1.341 . . . . 0.0 112.828 178.315 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 21.1 t -140.82 -153.23 0.45 Allowed 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 126.277 1.831 . . . . 0.0 108.828 176.583 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 43.6 pt -101.09 156.24 4.4 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.401 0 C-N-CA 123.889 0.876 . . . . 0.0 111.608 175.329 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 18.1 p -140.17 165.95 26.0 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 124.252 1.021 . . . . 0.0 111.898 173.567 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 88.3 p -104.17 155.72 18.48 Favored 'General case' 0 C--O 1.236 0.383 0 C-N-CA 124.291 1.036 . . . . 0.0 112.481 -175.112 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 57.2 mt -59.02 -29.02 66.95 Favored 'General case' 0 CA--C 1.533 0.293 0 O-C-N 121.294 -0.878 . . . . 0.0 112.058 170.557 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 84.4 t80 -67.2 -29.77 69.53 Favored 'General case' 0 CA--C 1.542 0.653 0 N-CA-C 113.648 0.981 . . . . 0.0 113.648 171.648 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 -78.98 -33.0 45.52 Favored 'General case' 0 N--CA 1.468 0.464 0 O-C-N 121.43 -0.794 . . . . 0.0 110.637 174.333 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 10.8 mp -60.89 -44.46 97.08 Favored 'General case' 0 CA--C 1.542 0.658 0 CA-C-N 118.124 0.42 . . . . 0.0 111.076 164.891 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 31.9 tt0 -63.64 -37.17 86.31 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 123.969 0.908 . . . . 0.0 112.492 179.266 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 21.3 t-20 -61.27 -22.85 65.23 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 123.933 0.893 . . . . 0.0 112.955 173.904 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -94.82 -0.94 53.69 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 125.562 1.545 . . . . 0.0 114.01 176.823 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 38.3 m . . . . . 0 N--CA 1.471 0.597 0 O-C-N 120.657 -1.277 . . . . 0.0 110.731 163.447 . . . . . . . . 0 0 . 1 . 032 nuclear build core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 39.9 m-20 . . . . . 0 CA--C 1.543 0.686 0 CA-C-O 120.821 0.343 . . . . 0.0 111.003 . . . . . . . . . 0 0 . 1 . 032 nuclear build core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 45.0 mt-30 -143.89 159.81 41.9 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 123.723 0.809 . . . . 0.0 112.049 -172.254 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 96.4 m-70 -78.3 133.4 37.64 Favored 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 108.936 -0.765 . . . . 0.0 108.936 155.02 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 93.6 mt -150.53 129.91 12.92 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 125.413 1.485 . . . . 0.0 108.259 -174.6 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 4.1 t -156.82 151.82 26.1 Favored 'General case' 0 N--CA 1.469 0.52 0 O-C-N 121.155 -0.966 . . . . 0.0 112.246 -178.677 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 56.94 -132.16 52.3 Favored Glycine 0 CA--C 1.531 1.033 0 C-N-CA 124.708 1.147 . . . . 0.0 112.698 -179.241 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 25.4 m -61.58 -29.32 69.95 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 124.27 1.028 . . . . 0.0 112.146 -177.615 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 14.9 m80 -68.71 -42.4 77.75 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 124.311 1.044 . . . . 0.0 111.008 178.398 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 51.2 tp -68.7 -44.15 74.56 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-O 118.458 -0.782 . . . . 0.0 110.663 172.806 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 53.7 t -58.57 -40.74 79.94 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.895 0 CA-C-N 119.042 0.837 . . . . 0.0 111.72 177.176 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -66.57 -48.58 69.17 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 123.614 0.766 . . . . 0.0 111.459 175.536 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.51 -44.21 97.47 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-O 121.318 0.58 . . . . 0.0 111.809 179.564 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 40.6 tp -60.95 -46.34 91.11 Favored 'General case' 0 C--N 1.333 -0.124 0 C-N-CA 124.905 1.282 . . . . 0.0 111.058 175.9 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 50.7 t80 -64.59 -26.17 68.29 Favored 'General case' 0 CA--C 1.543 0.691 0 N-CA-C 113.69 0.996 . . . . 0.0 113.69 173.814 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 73.7 mt -75.6 -32.44 60.31 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-N 119.71 1.141 . . . . 0.0 113.087 172.341 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 92.6 t -76.85 -38.9 29.91 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.252 0 C-N-CA 124.163 0.985 . . . . 0.0 111.311 173.237 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 63.5 m -105.58 14.68 28.15 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 126.044 1.738 . . . . 0.0 114.158 -172.566 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . -56.98 -36.71 75.0 Favored Glycine 0 N--CA 1.477 1.413 0 CA-C-N 119.275 0.943 . . . . 0.0 114.958 -168.686 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 4.4 mp0 -77.54 -11.75 59.89 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 124.917 1.287 . . . . 0.0 113.494 175.816 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 24.2 mmm180 -111.45 -53.03 2.74 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 126.225 1.81 . . . . 0.0 113.415 -169.467 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 92.18 162.61 37.44 Favored Glycine 0 CA--C 1.536 1.358 0 C-N-CA 124.706 1.146 . . . . 0.0 111.317 -153.641 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 49.5 p90 -142.02 156.58 45.43 Favored 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 114.403 1.26 . . . . 0.0 114.403 -170.94 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 57.3 t80 . . . . . 0 CA--C 1.542 0.636 0 C-N-CA 127.393 2.277 . . . . 0.0 110.008 165.098 . . . . . . . . 0 0 . 1 . 033 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 70.6 t . . . . . 0 N--CA 1.485 1.281 0 N-CA-C 112.166 0.432 . . . . 0.0 112.166 . . . . . . . . . 0 0 . 1 . 033 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 -79.64 -64.52 1.17 Allowed 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 123.594 0.758 . . . . 0.0 109.352 170.347 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 11.1 tt0 -58.69 -47.28 85.06 Favored 'General case' 0 N--CA 1.465 0.29 0 C-N-CA 125.063 1.345 . . . . 0.0 112.442 -168.048 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 87.3 m -64.86 -23.08 67.12 Favored 'General case' 0 C--O 1.234 0.255 0 N-CA-C 113.645 0.98 . . . . 0.0 113.645 -178.526 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 8.4 t -101.98 -31.41 10.68 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 123.49 0.716 . . . . 0.0 112.597 -172.377 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 80.7 p -88.6 -28.16 20.88 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 124.532 1.133 . . . . 0.0 112.9 172.399 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 11.8 t -139.13 -160.05 1.02 Allowed 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 126.492 1.917 . . . . 0.0 109.622 178.495 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 42.6 pt -96.51 156.98 3.3 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.476 0 C-N-CA 124.416 1.086 . . . . 0.0 111.731 176.061 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 18.2 p -147.35 160.55 42.41 Favored 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 124.219 1.008 . . . . 0.0 112.695 175.409 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 50.8 m -109.6 155.41 21.47 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 124.568 1.147 . . . . 0.0 111.774 -174.979 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 33.1 mt -60.41 -31.13 70.09 Favored 'General case' 0 N--CA 1.469 0.48 0 O-C-N 120.949 -1.094 . . . . 0.0 112.078 177.762 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 33.4 m-85 -61.09 -30.16 70.18 Favored 'General case' 0 CA--C 1.542 0.66 0 N-CA-C 113.558 0.947 . . . . 0.0 113.558 171.22 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 96.2 mt-30 -81.78 -34.55 30.28 Favored 'General case' 0 N--CA 1.465 0.294 0 C-N-CA 123.94 0.896 . . . . 0.0 110.298 177.355 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 8.3 mp -62.12 -40.39 95.73 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 118.775 0.716 . . . . 0.0 111.785 166.653 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -59.16 -28.35 66.51 Favored 'General case' 0 CA--C 1.541 0.596 0 C-N-CA 124.587 1.155 . . . . 0.0 113.105 -178.146 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 5.4 m-80 -66.29 -16.33 63.95 Favored 'General case' 0 CA--C 1.546 0.816 0 N-CA-C 113.795 1.035 . . . . 0.0 113.795 175.559 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 72.5 m-85 -102.21 5.2 40.04 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 125.908 1.683 . . . . 0.0 113.458 177.609 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 86.0 m . . . . . 0 N--CA 1.473 0.701 0 O-C-N 121.018 -1.052 . . . . 0.0 112.422 167.735 . . . . . . . . 0 0 . 1 . 033 nuclear build core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 10.4 p30 . . . . . 0 CA--C 1.541 0.629 0 CA-C-O 120.689 0.281 . . . . 0.0 111.569 . . . . . . . . . 0 0 . 1 . 033 nuclear build core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 38.7 mt-30 -150.43 167.42 27.17 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 124.444 1.098 . . . . 0.0 111.479 -166.673 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 92.4 m-70 -86.72 136.74 32.9 Favored 'General case' 0 CA--C 1.542 0.671 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 152.675 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 93.3 mt -148.93 136.03 19.99 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 125.582 1.553 . . . . 0.0 109.412 -176.875 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 73.0 m -140.74 145.29 36.23 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 124.742 1.217 . . . . 0.0 110.526 -179.11 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 52.53 -125.71 29.81 Favored Glycine 0 N--CA 1.473 1.135 0 C-N-CA 124.772 1.177 . . . . 0.0 114.503 165.381 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 23.6 m -60.39 -36.92 79.21 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 124.061 0.944 . . . . 0.0 111.941 -177.656 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 27.5 m170 -68.62 -37.93 80.13 Favored 'General case' 0 CA--C 1.54 0.559 0 O-C-N 121.325 -0.86 . . . . 0.0 111.809 178.25 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 9.6 tt -64.14 -45.94 86.29 Favored 'General case' 0 C--O 1.223 -0.305 0 C-N-CA 123.993 0.917 . . . . 0.0 110.796 170.074 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 41.7 t -61.65 -37.18 77.34 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.963 0 C-N-CA 123.602 0.761 . . . . 0.0 111.836 178.4 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -68.31 -45.43 72.99 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 124.022 0.929 . . . . 0.0 111.804 173.364 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.76 -43.67 97.72 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 119.352 0.978 . . . . 0.0 111.756 175.248 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 51.4 tp -61.15 -48.76 80.12 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 125.222 1.409 . . . . 0.0 111.022 177.109 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 46.9 t80 -54.35 -40.02 67.66 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 123.49 0.716 . . . . 0.0 112.659 172.436 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 82.2 mt -74.9 -33.9 62.1 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 123.961 0.904 . . . . 0.0 113.248 178.703 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 40.0 t -65.85 -44.7 92.7 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.924 0 C-N-CA 124.413 1.085 . . . . 0.0 110.98 172.15 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 58.5 m -83.41 -29.81 27.82 Favored 'General case' 0 N--CA 1.469 0.504 0 N-CA-C 113.676 0.991 . . . . 0.0 113.676 -175.087 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 67.61 -144.89 44.63 Favored Glycine 0 CA--C 1.532 1.129 0 C-N-CA 124.224 0.916 . . . . 0.0 112.012 -174.499 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -68.96 -7.42 35.05 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 124.65 1.18 . . . . 0.0 114.139 -178.953 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 80.0 mtt85 -61.31 -31.88 71.74 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 124.733 1.213 . . . . 0.0 113.389 177.049 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 86.34 179.35 49.55 Favored Glycine 0 CA--C 1.533 1.164 0 C-N-CA 125.112 1.339 . . . . 0.0 112.441 -170.654 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 52.6 p90 -159.65 167.32 28.69 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 124.729 1.212 . . . . 0.0 112.833 -173.274 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 81.7 t80 . . . . . 0 CA--C 1.537 0.472 0 C-N-CA 125.999 1.72 . . . . 0.0 108.314 172.209 . . . . . . . . 0 0 . 1 . 034 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 74.7 t . . . . . 0 N--CA 1.48 1.041 0 N-CA-C 111.396 0.147 . . . . 0.0 111.396 . . . . . . . . . 0 0 . 1 . 034 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 18.8 tt0 -79.17 0.89 26.49 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 123.642 0.777 . . . . 0.0 113.027 -179.519 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 6.7 tp60 -104.54 -63.05 1.25 Allowed 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 124.458 1.103 . . . . 0.0 109.643 166.032 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 64.5 m -66.19 -26.18 67.28 Favored 'General case' 0 N--CA 1.467 0.424 0 N-CA-C 115.151 1.537 . . . . 0.0 115.151 -170.152 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 12.1 t -87.61 -33.36 18.88 Favored 'General case' 0 N--CA 1.471 0.585 0 O-C-N 121.708 -0.62 . . . . 0.0 112.594 -172.117 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 20.7 p -105.69 -35.29 7.44 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 126.29 1.836 . . . . 0.0 112.826 -175.806 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.1 t -112.18 -171.79 1.92 Allowed 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 125.48 1.512 . . . . 0.0 110.31 169.579 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 11.1 tt -92.83 146.72 6.03 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.686 0 C-N-CA 124.807 1.243 . . . . 0.0 110.329 173.624 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 27.2 p -133.56 158.21 43.73 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-O 121.805 0.812 . . . . 0.0 112.448 175.285 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 83.8 p -104.78 158.29 16.62 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 125.006 1.322 . . . . 0.0 111.939 -179.802 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 55.8 mt -60.16 -30.29 69.22 Favored 'General case' 0 N--CA 1.466 0.34 0 O-C-N 121.083 -1.011 . . . . 0.0 111.927 173.87 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 76.9 t80 -65.7 -31.98 73.29 Favored 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 113.398 0.888 . . . . 0.0 113.398 171.249 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 40.5 mt-30 -73.73 -36.84 65.22 Favored 'General case' 0 N--CA 1.468 0.458 0 O-C-N 121.5 -0.75 . . . . 0.0 110.483 173.144 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 7.0 mp -61.59 -40.12 93.64 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-N 118.608 0.64 . . . . 0.0 111.603 168.992 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 27.5 tt0 -68.51 -32.41 72.35 Favored 'General case' 0 CA--C 1.544 0.737 0 N-CA-C 112.786 0.661 . . . . 0.0 112.786 178.83 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 6.3 m-80 -66.21 -15.11 62.89 Favored 'General case' 0 CA--C 1.549 0.936 0 O-C-N 120.914 -1.116 . . . . 0.0 112.976 171.05 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 14.0 m-85 -97.75 1.33 48.32 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 125.889 1.676 . . . . 0.0 113.639 172.381 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 39.4 m . . . . . 0 CA--C 1.546 0.789 0 CA-C-N 119.93 1.241 . . . . 0.0 110.794 162.144 . . . . . . . . 0 0 . 1 . 034 nuclear build core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 65.4 m-20 . . . . . 0 N--CA 1.472 0.65 0 N-CA-C 110.426 -0.213 . . . . 0.0 110.426 . . . . . . . . . 0 0 . 1 . 034 nuclear build core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 41.9 mt-30 -146.03 159.29 43.47 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 123.575 0.75 . . . . 0.0 112.02 -166.908 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 99.0 m-70 -86.13 133.24 33.88 Favored 'General case' 0 CA--C 1.54 0.576 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 154.772 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 96.3 mt -146.66 135.52 22.33 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 125.375 1.47 . . . . 0.0 108.668 -172.007 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 4.2 t -160.45 154.8 23.46 Favored 'General case' 0 N--CA 1.466 0.348 0 O-C-N 121.538 -0.726 . . . . 0.0 111.99 -175.584 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 62.97 -139.61 44.92 Favored Glycine 0 N--CA 1.47 0.943 0 C-N-CA 123.969 0.795 . . . . 0.0 112.691 -178.845 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 23.9 p -61.83 -29.09 69.94 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 124.675 1.19 . . . . 0.0 112.411 179.64 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 15.7 m80 -62.6 -42.09 99.36 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 124.311 1.044 . . . . 0.0 111.939 176.668 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 40.4 tp -71.72 -40.0 69.75 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 123.628 0.771 . . . . 0.0 111.432 175.299 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 88.1 t -58.5 -43.19 86.37 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.202 0 C-N-CA 123.094 0.558 . . . . 0.0 111.406 173.31 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -67.31 -43.41 81.75 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 124.291 1.037 . . . . 0.0 111.752 176.443 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.36 -44.49 97.08 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 122.942 0.497 . . . . 0.0 111.671 177.14 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 34.9 mt -60.43 -46.59 89.48 Favored 'General case' 0 N--CA 1.467 0.407 0 C-N-CA 124.046 0.938 . . . . 0.0 111.084 174.408 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 84.2 t80 -56.56 -39.57 73.68 Favored 'General case' 0 CA--C 1.543 0.705 0 CA-C-N 118.725 0.693 . . . . 0.0 112.75 174.263 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 89.8 mt -77.62 -36.01 52.12 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 124.074 0.949 . . . . 0.0 113.47 179.805 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 41.1 t -69.14 -44.46 80.86 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.921 0 C-N-CA 124.036 0.934 . . . . 0.0 110.741 174.571 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 75.0 m -85.72 -30.75 22.88 Favored 'General case' 0 N--CA 1.47 0.531 0 N-CA-C 113.374 0.879 . . . . 0.0 113.374 -173.205 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 63.49 -132.08 41.42 Favored Glycine 0 CA--C 1.531 1.046 0 C-N-CA 123.975 0.797 . . . . 0.0 111.377 -177.508 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -69.74 -11.72 61.07 Favored 'General case' 0 CA--C 1.547 0.849 0 N-CA-C 113.8 1.037 . . . . 0.0 113.8 179.797 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 83.8 mtm180 -64.73 -37.45 87.65 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-N 119.13 0.877 . . . . 0.0 112.898 -179.459 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 83.07 169.68 45.02 Favored Glycine 0 CA--C 1.534 1.269 0 C-N-CA 124.513 1.054 . . . . 0.0 112.822 -170.356 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 53.5 p90 -153.34 160.61 42.72 Favored 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 114.198 1.184 . . . . 0.0 114.198 -170.398 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 46.0 t80 . . . . . 0 CA--C 1.54 0.581 0 C-N-CA 126.317 1.847 . . . . 0.0 110.219 164.59 . . . . . . . . 0 0 . 1 . 035 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 54.7 t . . . . . 0 N--CA 1.484 1.27 0 N-CA-C 112.553 0.575 . . . . 0.0 112.553 . . . . . . . . . 0 0 . 1 . 035 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -71.42 -33.68 69.63 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 118.187 0.449 . . . . 0.0 111.354 -178.873 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 18.1 tt0 -59.66 -56.89 16.26 Favored 'General case' 0 N--CA 1.466 0.334 0 C-N-CA 123.411 0.684 . . . . 0.0 110.987 177.948 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 2.1 t -73.45 -15.9 61.32 Favored 'General case' 0 N--CA 1.469 0.515 0 N-CA-C 113.547 0.943 . . . . 0.0 113.547 -174.276 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 26.2 t -90.29 -35.41 15.29 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 123.853 0.861 . . . . 0.0 112.999 178.634 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 76.8 p -95.58 -37.03 11.03 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 124.417 1.087 . . . . 0.0 113.097 177.833 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 17.7 t -113.46 -147.54 0.42 Allowed 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 126.923 2.089 . . . . 0.0 108.74 168.075 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 44.5 pt -118.01 168.49 9.86 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 C-N-CA 125.113 1.365 . . . . 0.0 112.616 -179.767 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 20.1 p -147.44 159.09 44.11 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 124.501 1.121 . . . . 0.0 111.661 166.663 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 88.6 p -96.17 162.12 13.67 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 125.142 1.377 . . . . 0.0 112.43 174.822 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 57.5 mt -60.42 -34.2 73.61 Favored 'General case' 0 N--CA 1.468 0.464 0 O-C-N 121.391 -0.818 . . . . 0.0 111.535 173.292 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 79.9 m-85 -65.6 -34.04 77.3 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 123.81 0.844 . . . . 0.0 113.014 173.028 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 45.2 mt-30 -72.28 -35.88 68.82 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-O 118.468 -0.777 . . . . 0.0 111.98 171.718 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 68.5 mt -58.57 -46.4 86.99 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 119.143 0.883 . . . . 0.0 110.949 169.276 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 22.5 tt0 -69.53 -27.34 65.08 Favored 'General case' 0 CA--C 1.541 0.597 0 N-CA-C 113.307 0.855 . . . . 0.0 113.307 -178.251 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.7 m-80 -62.65 -22.42 66.43 Favored 'General case' 0 CA--C 1.546 0.791 0 O-C-N 120.954 -1.091 . . . . 0.0 113.504 176.579 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 62.6 m-85 -99.91 0.81 41.99 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 125.169 1.388 . . . . 0.0 113.709 174.231 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 89.7 m . . . . . 0 CA--C 1.54 0.56 0 C-N-CA 124.197 0.999 . . . . 0.0 113.188 171.838 . . . . . . . . 0 0 . 1 . 035 nuclear build core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 8.1 p-10 . . . . . 0 CA--C 1.537 0.461 0 N-CA-C 112.745 0.646 . . . . 0.0 112.745 . . . . . . . . . 0 0 . 1 . 035 nuclear build core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 41.7 mt-30 -152.14 169.16 23.11 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 125.11 1.364 . . . . 0.0 111.885 -169.29 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 98.4 m-70 -88.17 135.35 33.48 Favored 'General case' 0 CA--C 1.542 0.673 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 150.276 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 86.6 mt -145.09 132.28 20.49 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 125.063 1.345 . . . . 0.0 110.53 -179.055 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 63.6 m -131.51 141.87 49.83 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 125.568 1.547 . . . . 0.0 110.295 178.097 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 51.57 -120.26 9.83 Favored Glycine 0 N--CA 1.475 1.28 0 C-N-CA 124.843 1.211 . . . . 0.0 114.372 165.543 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 29.3 m -60.13 -33.8 72.64 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 124.234 1.014 . . . . 0.0 112.627 -177.742 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 97.1 m-70 -72.16 -38.21 69.21 Favored 'General case' 0 CA--C 1.54 0.574 0 O-C-N 121.324 -0.86 . . . . 0.0 111.324 177.554 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 62.6 tp -65.13 -45.34 85.45 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 123.718 0.807 . . . . 0.0 111.126 172.392 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 27.5 t -60.38 -41.69 88.21 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.898 0 C-N-CA 124.246 1.018 . . . . 0.0 111.771 175.61 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -63.77 -47.41 81.07 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 123.631 0.772 . . . . 0.0 111.423 174.498 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.49 -43.87 97.75 Favored 'General case' 0 CA--C 1.541 0.62 0 O-C-N 121.691 -0.631 . . . . 0.0 112.477 179.549 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 25.5 mt -54.27 -50.93 66.1 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 124.45 1.1 . . . . 0.0 110.913 172.354 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 57.7 t80 -63.75 -33.06 74.82 Favored 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 113.463 0.912 . . . . 0.0 113.463 176.9 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 74.5 mt -74.69 -36.28 62.75 Favored 'General case' 0 N--CA 1.472 0.631 0 O-C-N 121.044 -1.035 . . . . 0.0 113.175 177.394 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 53.2 t -71.72 -43.44 70.18 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.875 0 C-N-CA 123.762 0.825 . . . . 0.0 111.066 175.709 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 65.1 m -104.72 -17.77 14.52 Favored 'General case' 0 N--CA 1.475 0.783 0 N-CA-C 114.467 1.284 . . . . 0.0 114.467 -166.593 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 67.72 -155.57 52.87 Favored Glycine 0 CA--C 1.531 1.081 0 C-N-CA 124.927 1.251 . . . . 0.0 113.18 179.642 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -71.83 -1.75 15.28 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 124.526 1.13 . . . . 0.0 113.297 175.606 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 29.1 ttp180 -60.83 -26.21 67.16 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 125.45 1.5 . . . . 0.0 112.886 176.531 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 111.5 139.52 7.9 Favored Glycine 0 CA--C 1.53 1.001 0 C-N-CA 126.392 1.949 . . . . 0.0 112.863 177.093 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 40.9 p90 -144.07 166.92 23.63 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 125.671 1.589 . . . . 0.0 112.167 -176.647 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 44.5 t80 . . . . . 0 CA--C 1.538 0.499 0 CA-C-O 121.74 0.781 . . . . 0.0 112.564 169.588 . . . . . . . . 0 0 . 1 . 036 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 85.2 t . . . . . 0 N--CA 1.484 1.259 0 CA-C-O 119.927 -0.082 . . . . 0.0 110.909 . . . . . . . . . 0 0 . 1 . 036 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -74.04 -47.81 34.29 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 123.097 0.559 . . . . 0.0 110.102 176.379 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 13.3 tm0? -58.74 -47.07 85.9 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 124.499 1.12 . . . . 0.0 111.693 -177.409 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 12.4 m -59.15 -23.89 62.56 Favored 'General case' 0 N--CA 1.47 0.525 0 N-CA-C 113.727 1.01 . . . . 0.0 113.727 174.988 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 49.4 t -98.13 -49.23 4.81 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 124.97 1.308 . . . . 0.0 113.324 -172.191 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 77.0 p -79.04 -36.11 41.57 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 124.641 1.176 . . . . 0.0 112.087 -179.662 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 13.2 t -106.77 -154.68 0.53 Allowed 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 125.554 1.542 . . . . 0.0 109.319 164.438 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 26.7 pt -117.29 155.6 18.88 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.624 0 C-N-CA 125.704 1.602 . . . . 0.0 111.474 178.036 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 16.1 p -145.87 162.32 38.0 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 124.041 0.936 . . . . 0.0 111.935 171.772 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 32.6 t -101.85 156.27 17.62 Favored 'General case' 0 N--CA 1.465 0.318 0 C-N-CA 124.071 0.948 . . . . 0.0 112.74 -173.383 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 55.5 mt -59.56 -31.95 69.9 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 124.178 0.991 . . . . 0.0 111.461 174.192 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 3.5 m-30 -67.62 -25.26 65.66 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 124.307 1.043 . . . . 0.0 112.727 173.703 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 89.2 mt-30 -88.41 -31.04 19.03 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 124.405 1.082 . . . . 0.0 110.527 178.505 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 10.9 mp -57.28 -52.65 64.48 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 122.964 0.506 . . . . 0.0 110.578 161.694 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 5.6 tm-20 -58.95 -29.51 67.19 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 124.956 1.303 . . . . 0.0 113.413 -173.971 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 22.3 t30 -51.76 -30.01 21.04 Favored 'General case' 0 CA--C 1.549 0.918 0 C-N-CA 124.934 1.293 . . . . 0.0 114.29 175.087 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 95.2 m-85 -94.79 0.45 54.93 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 125.347 1.459 . . . . 0.0 113.993 -177.343 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 75.3 m . . . . . 0 CA--C 1.538 0.484 0 C-N-CA 124.303 1.041 . . . . 0.0 113.409 177.77 . . . . . . . . 0 0 . 1 . 036 nuclear build core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 40.3 m-80 . . . . . 0 CA--C 1.54 0.596 0 N-CA-C 113.331 0.863 . . . . 0.0 113.331 . . . . . . . . . 0 0 . 1 . 036 nuclear build core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 36.9 mt-30 -145.57 164.19 32.45 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 125.69 1.596 . . . . 0.0 110.552 177.656 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 98.9 m-70 -81.45 128.98 34.45 Favored 'General case' 0 CA--C 1.538 0.5 0 N-CA-C 108.711 -0.848 . . . . 0.0 108.711 157.889 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 89.9 mt -142.24 124.69 15.7 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 125.498 1.519 . . . . 0.0 109.169 -176.302 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 61.5 m -127.67 137.55 52.54 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 124.256 1.022 . . . . 0.0 111.251 -173.646 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 45.59 -118.85 3.25 Favored Glycine 0 N--CA 1.472 1.075 0 C-N-CA 126.04 1.781 . . . . 0.0 114.708 165.404 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 19.1 m -60.0 -33.11 71.54 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 124.33 1.052 . . . . 0.0 112.693 -178.655 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 83.0 m-70 -78.77 -29.91 45.34 Favored 'General case' 0 CA--C 1.543 0.686 0 O-C-N 121.083 -1.01 . . . . 0.0 112.659 176.885 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 54.4 tp -65.48 -45.44 83.64 Favored 'General case' 0 N--CA 1.47 0.571 0 O-C-N 121.444 -0.785 . . . . 0.0 110.991 167.909 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 77.1 t -65.89 -35.02 74.12 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.022 0 C-N-CA 123.869 0.868 . . . . 0.0 111.934 175.95 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -63.87 -50.4 68.95 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 124.799 1.239 . . . . 0.0 111.569 171.623 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -58.76 -43.55 90.36 Favored 'General case' 0 CA--C 1.54 0.567 0 O-C-N 121.895 -0.503 . . . . 0.0 111.594 176.564 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 52.9 tp -58.8 -47.74 83.71 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 124.818 1.247 . . . . 0.0 111.677 177.23 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 89.7 t80 -59.27 -40.46 86.12 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 123.613 0.765 . . . . 0.0 112.452 173.119 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 90.0 mt -75.61 -35.22 60.58 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 124.113 0.965 . . . . 0.0 113.314 -178.156 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 41.4 t -65.24 -44.22 95.16 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.958 0 C-N-CA 124.378 1.071 . . . . 0.0 110.303 174.406 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 74.4 m -98.77 -17.72 18.35 Favored 'General case' 0 N--CA 1.471 0.611 0 N-CA-C 115.094 1.516 . . . . 0.0 115.094 -169.838 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 65.14 -138.79 39.42 Favored Glycine 0 CA--C 1.53 1.016 0 C-N-CA 124.81 1.195 . . . . 0.0 113.019 176.79 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -63.07 -19.66 64.61 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 125.524 1.53 . . . . 0.0 113.553 -176.392 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 50.8 mtm180 -61.47 -36.69 81.16 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 124.042 0.937 . . . . 0.0 113.151 -178.584 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.57 -176.45 42.24 Favored Glycine 0 CA--C 1.533 1.212 0 C-N-CA 123.992 0.806 . . . . 0.0 113.565 -178.17 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 37.9 p90 -156.89 169.98 23.54 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 125.332 1.453 . . . . 0.0 113.121 -168.362 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 89.1 t80 . . . . . 0 CA--C 1.538 0.498 0 C-N-CA 125.124 1.37 . . . . 0.0 109.051 161.577 . . . . . . . . 0 0 . 1 . 037 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 55.4 t . . . . . 0 N--CA 1.48 1.056 0 CA-C-O 119.176 -0.44 . . . . 0.0 111.917 . . . . . . . . . 0 0 . 1 . 037 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 78.5 mt-10 -86.66 -48.06 8.62 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-N 118.946 0.794 . . . . 0.0 111.047 168.72 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 61.8 tp60 -60.46 -44.32 95.99 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 123.144 0.578 . . . . 0.0 112.176 -175.162 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -79.59 -19.61 48.91 Favored 'General case' 0 CA--C 1.536 0.408 0 N-CA-C 113.641 0.978 . . . . 0.0 113.641 -177.128 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 48.3 t -100.54 -55.46 2.59 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 124.212 1.005 . . . . 0.0 113.002 -174.706 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 50.7 m -76.17 -42.99 44.78 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 125.45 1.5 . . . . 0.0 110.217 -177.244 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 16.4 t -99.98 -150.92 0.39 Allowed 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 123.725 0.81 . . . . 0.0 109.266 158.468 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 34.9 pt -120.99 158.24 23.66 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.675 0 C-N-CA 125.402 1.481 . . . . 0.0 112.078 179.056 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -148.78 165.8 30.35 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-O 121.974 0.892 . . . . 0.0 113.035 166.411 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 16.6 t -109.81 166.97 10.5 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 123.986 0.914 . . . . 0.0 112.182 -175.717 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 49.1 mt -57.26 -31.85 66.0 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 124.575 1.15 . . . . 0.0 111.705 174.817 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 27.7 m-85 -59.66 -33.54 71.68 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.215 1.006 . . . . 0.0 113.576 171.334 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 20.7 mm100 -82.05 -32.64 30.31 Favored 'General case' 0 N--CA 1.468 0.428 0 C-N-CA 124.483 1.113 . . . . 0.0 111.069 177.472 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 73.4 mt -60.66 -43.13 97.98 Favored 'General case' 0 CA--C 1.542 0.636 0 CA-C-N 118.418 0.554 . . . . 0.0 110.603 167.78 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -65.33 -35.93 82.48 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 123.85 0.86 . . . . 0.0 112.309 174.058 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 21.6 t-20 -63.77 -29.34 70.56 Favored 'General case' 0 CA--C 1.548 0.884 0 O-C-N 120.801 -1.187 . . . . 0.0 113.065 176.964 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 4.9 m-85 -83.01 -0.84 50.74 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 125.074 1.35 . . . . 0.0 113.891 172.349 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 8.1 t . . . . . 0 CA--C 1.54 0.589 0 O-C-N 120.873 -1.142 . . . . 0.0 113.479 175.422 . . . . . . . . 0 0 . 1 . 037 nuclear build core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 60.9 t-20 . . . . . 0 N--CA 1.468 0.449 0 N-CA-C 109.653 -0.499 . . . . 0.0 109.653 . . . . . . . . . 0 0 . 1 . 037 nuclear build core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 26.7 mm-40 -150.83 161.37 42.8 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 124.475 1.11 . . . . 0.0 113.207 -160.897 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 85.5 m-70 -80.47 123.79 28.36 Favored 'General case' 0 CA--C 1.542 0.636 0 N-CA-C 108.786 -0.82 . . . . 0.0 108.786 156.944 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 91.1 mt -138.67 127.46 23.6 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 126.133 1.773 . . . . 0.0 108.878 178.368 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 73.5 m -132.41 143.87 50.11 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 124.961 1.304 . . . . 0.0 111.066 -173.566 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 52.78 -123.77 24.85 Favored Glycine 0 N--CA 1.471 0.997 0 C-N-CA 124.907 1.242 . . . . 0.0 113.776 166.302 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 20.3 m -61.25 -33.01 72.81 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 123.958 0.903 . . . . 0.0 112.702 -179.063 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 99.5 m-70 -73.52 -35.46 65.58 Favored 'General case' 0 CA--C 1.54 0.568 0 O-C-N 121.196 -0.94 . . . . 0.0 111.81 176.65 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 56.5 tp -64.5 -46.97 80.7 Favored 'General case' 0 N--CA 1.466 0.326 0 C-N-CA 123.332 0.653 . . . . 0.0 110.706 170.509 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 76.5 t -60.77 -41.15 87.36 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 C-N-CA 123.296 0.638 . . . . 0.0 111.515 176.063 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 42.9 tt0 -63.34 -48.34 78.39 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 123.575 0.75 . . . . 0.0 111.434 177.253 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.12 -45.75 92.1 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 123.069 0.548 . . . . 0.0 111.887 177.923 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 37.2 tp -60.43 -43.68 96.53 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 125.056 1.343 . . . . 0.0 111.436 178.454 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 68.8 t80 -64.76 -34.05 77.42 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 124.079 0.952 . . . . 0.0 113.328 172.381 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 65.8 mt -74.13 -31.93 62.96 Favored 'General case' 0 N--CA 1.472 0.626 0 O-C-N 121.044 -1.035 . . . . 0.0 113.142 176.317 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 79.4 t -72.96 -44.03 58.12 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.039 0 CA-C-N 118.367 0.531 . . . . 0.0 111.135 172.6 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -148.27 11.05 0.9 Allowed 'General case' 0 N--CA 1.473 0.705 0 N-CA-C 117.065 2.246 . . . . 0.0 117.065 -161.744 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . -63.76 -23.83 67.62 Favored Glycine 0 N--CA 1.476 1.317 0 O-C-N 120.803 -1.186 . . . . 0.0 115.46 -171.86 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -73.96 -22.51 59.62 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-N 118.255 1.028 . . . . 0.0 113.755 173.436 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 29.4 mtp180 -94.09 -37.08 11.8 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 125.486 1.514 . . . . 0.0 111.835 172.99 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 94.13 142.15 11.98 Favored Glycine 0 CA--C 1.527 0.844 0 C-N-CA 126.051 1.786 . . . . 0.0 112.851 176.707 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 25.9 p90 -127.13 159.76 33.26 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 125.115 1.366 . . . . 0.0 114.221 -166.909 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 40.3 t80 . . . . . 0 CA--C 1.542 0.646 0 C-N-CA 126.024 1.73 . . . . 0.0 110.555 164.523 . . . . . . . . 0 0 . 1 . 038 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 20.4 t . . . . . 0 N--CA 1.484 1.262 0 N-CA-C 110.746 -0.094 . . . . 0.0 110.746 . . . . . . . . . 0 0 . 1 . 038 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -71.6 -13.96 61.93 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 123.653 0.781 . . . . 0.0 112.796 -178.476 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 53.6 tp60 -85.63 -77.69 0.29 Allowed 'General case' 0 C--O 1.226 -0.176 0 N-CA-C 108.082 -1.081 . . . . 0.0 108.082 156.193 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 64.3 m -55.3 -27.1 44.55 Favored 'General case' 0 N--CA 1.472 0.66 0 N-CA-C 115.794 1.776 . . . . 0.0 115.794 -159.844 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 11.0 t -90.78 -23.34 20.67 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 123.929 0.891 . . . . 0.0 112.565 -176.84 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 32.3 m -107.11 -28.15 10.16 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 126.702 2.001 . . . . 0.0 112.224 -175.029 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 16.1 t -147.89 168.46 22.17 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 126.094 1.758 . . . . 0.0 110.36 172.222 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 34.6 pt -68.65 150.16 10.9 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.708 0 O-C-N 120.379 -1.451 . . . . 0.0 113.569 -170.582 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 14.8 p -147.31 163.06 37.61 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 124.783 1.233 . . . . 0.0 112.334 174.384 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 48.7 m -120.08 155.05 33.76 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 124.082 0.953 . . . . 0.0 113.089 -171.366 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 46.8 mt -60.99 -33.52 73.37 Favored 'General case' 0 N--CA 1.471 0.594 0 O-C-N 121.256 -0.903 . . . . 0.0 112.137 177.361 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 83.7 t80 -62.44 -27.0 68.81 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 124.09 0.956 . . . . 0.0 113.519 172.643 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 91.6 mt-30 -81.12 -40.61 23.78 Favored 'General case' 0 N--CA 1.467 0.396 0 C-N-CA 124.132 0.973 . . . . 0.0 110.395 172.517 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 41.8 mt -57.72 -33.32 68.3 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-N 118.921 0.782 . . . . 0.0 112.499 174.19 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 8.4 tm-20 -56.3 -34.7 66.74 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 125.086 1.354 . . . . 0.0 113.003 176.332 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 25.1 t30 -63.34 -34.27 77.33 Favored 'General case' 0 CA--C 1.543 0.711 0 O-C-N 121.203 -0.936 . . . . 0.0 112.256 175.443 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 74.5 m-85 -88.57 2.13 53.63 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 125.849 1.659 . . . . 0.0 113.762 -178.129 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 82.5 m . . . . . 0 CA--C 1.543 0.686 0 C-N-CA 126.146 1.778 . . . . 0.0 113.051 168.227 . . . . . . . . 0 0 . 1 . 038 nuclear build core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 24.8 t-20 . . . . . 0 CA--C 1.54 0.562 0 CA-C-O 120.38 0.133 . . . . 0.0 110.74 . . . . . . . . . 0 0 . 1 . 038 nuclear build core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 48.5 mm-40 -156.32 167.41 30.53 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 124.771 1.228 . . . . 0.0 112.15 -167.554 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 16.8 m170 -84.78 138.43 32.6 Favored 'General case' 0 CA--C 1.542 0.636 0 N-CA-C 109.329 -0.619 . . . . 0.0 109.329 150.226 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 72.1 mt -146.41 136.44 23.5 Favored 'General case' 0 N--CA 1.465 0.314 0 C-N-CA 125.067 1.347 . . . . 0.0 109.455 -175.476 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 3.0 t -154.64 153.44 31.36 Favored 'General case' 0 N--CA 1.466 0.327 0 C-N-CA 123.502 0.721 . . . . 0.0 111.451 -176.117 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 47.76 -124.79 10.59 Favored Glycine 0 CA--C 1.529 0.928 0 C-N-CA 125.19 1.376 . . . . 0.0 113.772 176.82 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 24.3 p -60.35 -33.93 73.13 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 125.028 1.331 . . . . 0.0 113.197 179.301 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 98.2 m-70 -70.12 -39.27 75.56 Favored 'General case' 0 CA--C 1.542 0.646 0 O-C-N 121.204 -0.935 . . . . 0.0 111.583 177.025 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 63.5 tp -65.96 -45.14 82.83 Favored 'General case' 0 N--CA 1.471 0.604 0 O-C-N 121.616 -0.678 . . . . 0.0 110.869 172.735 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 24.7 t -59.59 -39.68 80.1 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.936 0 C-N-CA 124.187 0.995 . . . . 0.0 111.806 176.238 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -67.84 -46.61 71.31 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 123.879 0.872 . . . . 0.0 111.601 175.074 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.87 -46.2 90.04 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.158 0.583 . . . . 0.0 111.602 178.2 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 30.6 mt -54.74 -59.2 5.04 Favored 'General case' 0 N--CA 1.466 0.357 0 C-N-CA 124.099 0.96 . . . . 0.0 110.255 171.472 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 69.6 t80 -51.85 -38.71 57.01 Favored 'General case' 0 CA--C 1.543 0.707 0 CA-C-N 119.443 1.02 . . . . 0.0 113.234 -179.495 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 86.7 mt -72.71 -32.2 65.57 Favored 'General case' 0 N--CA 1.471 0.593 0 N-CA-C 113.914 1.079 . . . . 0.0 113.914 177.732 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 68.0 t -78.07 -38.06 23.61 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.01 0 C-N-CA 123.922 0.889 . . . . 0.0 111.316 174.384 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 44.1 m -89.48 -33.43 16.79 Favored 'General case' 0 N--CA 1.466 0.348 0 N-CA-C 114.28 1.215 . . . . 0.0 114.28 -170.633 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 60.79 -131.93 49.15 Favored Glycine 0 CA--C 1.533 1.192 0 N-CA-C 111.391 -0.684 . . . . 0.0 111.391 -172.18 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -72.46 -7.75 51.48 Favored 'General case' 0 CA--C 1.546 0.826 0 N-CA-C 114.364 1.246 . . . . 0.0 114.364 -179.311 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 68.8 mtp180 -62.95 -26.85 69.02 Favored 'General case' 0 N--CA 1.476 0.875 0 CA-C-N 119.336 0.971 . . . . 0.0 113.414 177.938 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 75.38 173.62 33.67 Favored Glycine 0 CA--C 1.531 1.075 0 C-N-CA 124.419 1.009 . . . . 0.0 112.192 -168.629 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 35.6 p90 -150.12 157.73 43.42 Favored 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 114.789 1.403 . . . . 0.0 114.789 -171.619 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 89.5 t80 . . . . . 0 CA--C 1.541 0.634 0 C-N-CA 126.321 1.848 . . . . 0.0 109.617 171.306 . . . . . . . . 0 0 . 1 . 039 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 38.2 t . . . . . 0 N--CA 1.481 1.113 0 CA-C-O 119.069 -0.491 . . . . 0.0 111.535 . . . . . . . . . 0 0 . 1 . 039 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -71.45 -47.39 56.05 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-N 119.169 0.895 . . . . 0.0 110.491 173.906 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 65.3 tp60 -56.84 -46.24 81.84 Favored 'General case' 0 N--CA 1.467 0.393 0 C-N-CA 123.698 0.799 . . . . 0.0 111.963 179.347 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -82.85 -17.11 45.05 Favored 'General case' 0 N--CA 1.469 0.487 0 N-CA-C 114.477 1.288 . . . . 0.0 114.477 -175.056 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 29.3 t -102.89 -43.92 5.4 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 123.986 0.915 . . . . 0.0 112.807 -175.983 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 61.7 m -85.63 -37.17 19.79 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 125.476 1.511 . . . . 0.0 111.118 178.89 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 18.1 t -110.69 -149.55 0.45 Allowed 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 124.15 0.98 . . . . 0.0 109.366 160.944 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 11.9 tt -116.86 157.45 17.81 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.932 0 C-N-CA 126.099 1.759 . . . . 0.0 111.258 177.828 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 1.6 p -143.72 -171.75 3.59 Favored 'General case' 0 N--CA 1.476 0.865 0 O-C-N 121.237 -0.914 . . . . 0.0 111.719 167.663 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 59.5 p -131.72 168.93 16.93 Favored 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 124.478 1.111 . . . . 0.0 112.573 177.534 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 32.9 mt -61.41 -31.65 71.58 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 123.374 0.669 . . . . 0.0 112.103 174.164 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 87.0 t80 -65.1 -33.01 75.01 Favored 'General case' 0 CA--C 1.54 0.569 0 N-CA-C 112.946 0.721 . . . . 0.0 112.946 171.827 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 19.7 mm100 -75.83 -28.02 58.1 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-O 118.699 -0.667 . . . . 0.0 112.274 172.571 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 53.3 mt -68.9 -40.26 79.28 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-N 119.412 1.005 . . . . 0.0 111.639 168.579 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -58.49 -24.72 61.16 Favored 'General case' 0 CA--C 1.547 0.84 0 N-CA-C 113.428 0.899 . . . . 0.0 113.428 -177.414 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 25.0 t30 -54.83 -26.0 32.2 Favored 'General case' 0 CA--C 1.551 0.989 0 C-N-CA 124.567 1.147 . . . . 0.0 113.844 171.727 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 98.6 m-85 -101.83 4.31 40.2 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 126.051 1.74 . . . . 0.0 114.021 -175.468 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 61.2 m . . . . . 0 CA--C 1.543 0.674 0 O-C-N 121.352 -0.843 . . . . 0.0 111.59 166.384 . . . . . . . . 0 0 . 1 . 039 nuclear build core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 11.5 m120 . . . . . 0 CA--C 1.533 0.322 0 CA-C-O 120.954 0.407 . . . . 0.0 111.229 . . . . . . . . . 0 0 . 1 . 039 nuclear build core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 38.2 mt-30 -152.43 154.11 34.91 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 124.948 1.299 . . . . 0.0 110.332 -173.066 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 95.1 m-70 -87.89 123.37 32.57 Favored 'General case' 0 CA--C 1.54 0.57 0 N-CA-C 108.372 -0.973 . . . . 0.0 108.372 162.572 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 72.1 mt -140.75 142.57 34.75 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 125.541 1.536 . . . . 0.0 108.397 -171.621 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -149.15 150.91 33.45 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 123.486 0.715 . . . . 0.0 112.25 -173.609 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 43.95 -125.06 5.41 Favored Glycine 0 N--CA 1.473 1.129 0 C-N-CA 125.754 1.645 . . . . 0.0 114.316 172.427 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 20.1 m -62.13 -31.13 71.56 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 124.653 1.181 . . . . 0.0 112.803 -178.06 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 97.7 m-70 -72.38 -37.1 68.83 Favored 'General case' 0 CA--C 1.539 0.546 0 O-C-N 121.037 -1.039 . . . . 0.0 111.463 177.308 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 8.8 tt -66.27 -44.72 82.83 Favored 'General case' 0 C--N 1.344 0.346 0 O-C-N 121.719 -0.613 . . . . 0.0 110.974 169.941 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 53.9 t -61.75 -36.72 75.33 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.986 0 C-N-CA 123.212 0.605 . . . . 0.0 111.782 177.836 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -65.8 -48.47 71.62 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 123.905 0.882 . . . . 0.0 111.739 172.107 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.8 -44.07 94.15 Favored 'General case' 0 CA--C 1.543 0.678 0 O-C-N 121.633 -0.667 . . . . 0.0 111.704 176.77 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 52.3 tp -58.28 -50.94 71.83 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 125.885 1.674 . . . . 0.0 111.005 176.122 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 52.8 t80 -54.76 -42.21 71.4 Favored 'General case' 0 CA--C 1.541 0.634 0 N-CA-C 113.009 0.744 . . . . 0.0 113.009 173.434 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 89.5 mt -74.04 -33.36 63.7 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 123.925 0.89 . . . . 0.0 113.348 179.957 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 24.4 t -65.11 -47.18 88.74 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.819 0 C-N-CA 124.864 1.266 . . . . 0.0 110.361 171.457 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 84.7 m -75.74 -36.27 59.95 Favored 'General case' 0 N--CA 1.469 0.482 0 N-CA-C 112.753 0.649 . . . . 0.0 112.753 -176.436 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 62.81 -134.35 43.92 Favored Glycine 0 CA--C 1.529 0.927 0 C-N-CA 124.384 0.992 . . . . 0.0 111.412 -178.195 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -61.13 -18.4 57.86 Favored 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 114.681 1.363 . . . . 0.0 114.681 178.714 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 86.0 mtm180 -65.2 -30.45 71.35 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 124.117 0.967 . . . . 0.0 113.212 179.815 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 77.73 177.82 47.56 Favored Glycine 0 CA--C 1.533 1.212 0 C-N-CA 124.507 1.051 . . . . 0.0 112.888 -173.221 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 33.3 p90 -158.55 168.26 27.39 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 124.641 1.176 . . . . 0.0 112.64 -172.134 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 92.0 t80 . . . . . 0 CA--C 1.537 0.454 0 C-N-CA 124.389 1.076 . . . . 0.0 111.83 164.085 . . . . . . . . 0 0 . 1 . 040 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 83.7 t . . . . . 0 N--CA 1.483 1.211 0 CA-C-O 119.388 -0.339 . . . . 0.0 110.412 . . . . . . . . . 0 0 . 1 . 040 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 14.9 pt-20 -61.98 -36.29 81.04 Favored 'General case' 0 CA--C 1.543 0.695 0 CA-C-N 118.722 0.692 . . . . 0.0 112.296 172.566 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 28.5 tt0 -74.0 -43.92 56.37 Favored 'General case' 0 C--O 1.225 -0.223 0 C-N-CA 123.534 0.734 . . . . 0.0 110.365 -179.704 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 92.6 m -72.27 -36.3 68.97 Favored 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 113.746 1.017 . . . . 0.0 113.746 179.098 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 15.8 t -93.46 -45.61 7.69 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 123.601 0.76 . . . . 0.0 112.826 -168.447 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 25.1 m -91.47 -38.33 12.62 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 124.747 1.219 . . . . 0.0 111.488 -177.298 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.7 t -105.09 -152.32 0.46 Allowed 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 124.493 1.117 . . . . 0.0 111.393 171.221 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 24.1 mt -109.87 140.38 29.04 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.791 0 C-N-CA 126.002 1.721 . . . . 0.0 110.092 168.817 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 9.7 p -124.39 -172.9 2.65 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.74 1.216 . . . . 0.0 111.129 167.366 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 8.4 t -148.8 166.66 27.8 Favored 'General case' 0 N--CA 1.469 0.503 0 O-C-N 120.655 -1.278 . . . . 0.0 111.898 179.264 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 34.0 mt -59.86 -33.49 71.88 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 124.628 1.171 . . . . 0.0 112.143 -178.234 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 86.6 t80 -61.42 -29.91 70.23 Favored 'General case' 0 CA--C 1.546 0.792 0 N-CA-C 113.565 0.95 . . . . 0.0 113.565 171.908 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 54.0 mm-40 -80.16 -36.47 35.08 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 123.343 0.657 . . . . 0.0 110.522 174.503 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 32.5 mt -62.27 -37.86 87.09 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 118.523 0.601 . . . . 0.0 111.52 172.193 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -61.31 -32.1 71.96 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 124.878 1.271 . . . . 0.0 112.903 179.004 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 24.1 t30 -62.5 -24.24 67.37 Favored 'General case' 0 CA--C 1.548 0.901 0 O-C-N 121.405 -0.809 . . . . 0.0 112.794 176.424 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 38.8 m-85 -95.51 1.59 54.01 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 125.584 1.553 . . . . 0.0 114.475 179.785 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 70.2 m . . . . . 0 CA--C 1.544 0.74 0 O-C-N 121.002 -1.061 . . . . 0.0 113.234 173.294 . . . . . . . . 0 0 . 1 . 040 nuclear build core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 10.0 p30 . . . . . 0 CA--C 1.543 0.681 0 CA-C-O 121.007 0.432 . . . . 0.0 110.498 . . . . . . . . . 0 0 . 1 . 040 nuclear build core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 30.5 mt-30 -148.3 165.82 29.87 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 124.043 0.937 . . . . 0.0 112.374 -158.888 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 93.8 m-70 -82.37 134.36 35.25 Favored 'General case' 0 CA--C 1.545 0.752 0 N-CA-C 108.968 -0.753 . . . . 0.0 108.968 157.592 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 76.4 mt -147.54 133.92 19.63 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 125.735 1.614 . . . . 0.0 108.619 -177.649 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 3.7 t -158.42 153.17 24.84 Favored 'General case' 0 N--CA 1.469 0.492 0 O-C-N 121.428 -0.795 . . . . 0.0 112.225 -177.38 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 61.01 -134.4 49.11 Favored Glycine 0 CA--C 1.53 0.992 0 C-N-CA 124.719 1.152 . . . . 0.0 113.139 179.171 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 20.3 m -60.9 -30.92 70.46 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 124.467 1.107 . . . . 0.0 112.029 -178.43 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 13.5 m80 -66.52 -41.82 88.19 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 124.543 1.137 . . . . 0.0 111.541 178.046 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 48.8 tp -69.46 -42.7 74.54 Favored 'General case' 0 N--CA 1.466 0.336 0 C-N-CA 124.284 1.033 . . . . 0.0 111.359 174.585 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 48.1 t -60.32 -41.07 85.82 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.038 0 C-N-CA 123.635 0.774 . . . . 0.0 111.349 175.458 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -66.61 -45.17 80.01 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 124.065 0.946 . . . . 0.0 111.829 174.399 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.99 -45.68 91.92 Favored 'General case' 0 CA--C 1.54 0.582 0 O-C-N 121.656 -0.652 . . . . 0.0 112.129 178.096 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 17.6 mt -54.74 -54.19 45.22 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 124.493 1.117 . . . . 0.0 110.974 172.795 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 77.8 t80 -55.45 -41.66 73.19 Favored 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 113.196 0.813 . . . . 0.0 113.196 177.177 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 85.4 mt -73.22 -35.76 66.35 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 123.9 0.88 . . . . 0.0 113.127 179.839 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 43.6 t -67.89 -42.47 85.76 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.845 0 C-N-CA 123.525 0.73 . . . . 0.0 110.903 173.842 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 82.7 m -80.75 -27.28 36.85 Favored 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 113.483 0.92 . . . . 0.0 113.483 -175.658 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 65.65 -111.96 4.59 Favored Glycine 0 CA--C 1.53 0.996 0 C-N-CA 124.298 0.951 . . . . 0.0 111.908 173.565 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -75.47 -18.91 59.72 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 124.395 1.078 . . . . 0.0 113.074 176.131 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 95.6 mtt-85 -76.9 158.16 30.9 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 124.059 0.943 . . . . 0.0 111.678 173.16 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . -74.46 179.37 43.43 Favored Glycine 0 CA--C 1.531 1.058 0 C-N-CA 123.839 0.733 . . . . 0.0 111.668 168.768 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 42.1 p90 -153.73 169.54 23.07 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.542 1.137 . . . . 0.0 112.473 -178.247 . . . . . . . . 1 1 . 1 . 040 nuclear build core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 63.6 t80 . . . . . 0 CA--C 1.54 0.595 0 C-N-CA 124.828 1.251 . . . . 0.0 111.983 179.406 . . . . . . . . 0 0 . 1 . 041 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 85.5 t . . . . . 0 N--CA 1.48 1.048 0 CA-C-O 118.922 -0.561 . . . . 0.0 112.048 . . . . . . . . . 0 0 . 1 . 041 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -59.75 -35.45 74.61 Favored 'General case' 0 N--CA 1.474 0.755 0 CA-C-N 118.958 0.799 . . . . 0.0 112.573 -178.546 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 28.7 tp60 -71.44 -32.8 68.76 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-O 118.663 -0.684 . . . . 0.0 112.02 -178.536 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -95.23 -22.0 18.1 Favored 'General case' 0 CA--C 1.539 0.557 0 N-CA-C 114.161 1.171 . . . . 0.0 114.161 177.172 . . . . . . . . 2 2 . 1 . 041 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 51.1 t -100.52 -56.08 2.43 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 124.764 1.226 . . . . 0.0 112.983 -172.976 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 26.8 m -81.06 -47.35 13.68 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 124.635 1.174 . . . . 0.0 109.894 -178.245 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 13.7 t -84.83 -158.35 0.35 Allowed 'General case' 0 CA--C 1.552 1.035 0 C-N-CA 123.045 0.538 . . . . 0.0 110.283 155.791 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 29.8 pt -128.82 150.4 34.44 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.552 0 C-N-CA 125.181 1.392 . . . . 0.0 111.974 178.842 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -145.12 166.56 25.04 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 123.962 0.905 . . . . 0.0 112.099 170.546 . . . . . . . . 2 2 . 1 . 041 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 3.4 t -118.52 167.11 11.92 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 124.064 0.946 . . . . 0.0 112.703 -173.943 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 47.7 mt -58.02 -35.65 71.58 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 124.713 1.205 . . . . 0.0 111.946 179.959 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 75.2 m-85 -62.06 -30.78 71.22 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 124.463 1.105 . . . . 0.0 113.543 173.287 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 17.6 mm100 -82.96 -33.68 26.63 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 124.328 1.051 . . . . 0.0 110.951 174.57 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 48.4 mt -62.51 -36.33 82.22 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 119.238 0.927 . . . . 0.0 111.418 170.988 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 25.5 tt0 -63.17 -27.75 69.58 Favored 'General case' 0 CA--C 1.544 0.726 0 N-CA-C 113.331 0.863 . . . . 0.0 113.331 178.894 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 30.8 t30 -59.59 -25.65 64.78 Favored 'General case' 0 CA--C 1.547 0.856 0 O-C-N 121.264 -0.897 . . . . 0.0 113.181 174.423 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 59.3 m-85 -94.55 -0.31 54.66 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 125.282 1.433 . . . . 0.0 114.117 -178.728 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 81.2 m . . . . . 0 CA--C 1.544 0.747 0 CA-C-N 119.076 0.853 . . . . 0.0 113.183 175.338 . . . . . . . . 0 0 . 1 . 041 nuclear build core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 40.8 m-80 . . . . . 0 CA--C 1.541 0.598 0 N-CA-C 113.638 0.977 . . . . 0.0 113.638 . . . . . . . . . 0 0 . 1 . 041 nuclear build core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 53.8 mm-40 -140.55 166.55 24.43 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 125.804 1.642 . . . . 0.0 110.442 -179.096 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 92.2 m-70 -84.96 116.7 23.52 Favored 'General case' 0 CA--C 1.541 0.628 0 N-CA-C 108.655 -0.869 . . . . 0.0 108.655 164.219 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 91.8 mt -132.35 126.33 33.0 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 125.743 1.617 . . . . 0.0 108.507 179.169 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 77.7 m -132.2 144.21 50.49 Favored 'General case' 0 N--CA 1.465 0.29 0 C-N-CA 124.839 1.255 . . . . 0.0 111.76 -168.01 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 53.04 -124.7 28.71 Favored Glycine 0 CA--C 1.531 1.081 0 C-N-CA 125.307 1.432 . . . . 0.0 114.271 164.647 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 22.2 p -56.85 -41.39 77.84 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 124.726 1.21 . . . . 0.0 112.238 176.968 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 19.3 m-70 -69.57 -29.89 67.54 Favored 'General case' 0 CA--C 1.541 0.628 0 O-C-N 120.613 -1.305 . . . . 0.0 112.712 177.946 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 48.0 tp -69.06 -43.06 75.4 Favored 'General case' 0 N--CA 1.47 0.564 0 O-C-N 121.544 -0.723 . . . . 0.0 111.275 169.559 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 52.1 t -60.57 -41.33 87.5 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.99 0 C-N-CA 123.927 0.891 . . . . 0.0 111.67 173.535 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -63.7 -46.5 85.17 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 124.372 1.069 . . . . 0.0 111.527 173.58 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.12 -45.06 96.22 Favored 'General case' 0 CA--C 1.544 0.734 0 CA-C-N 118.761 0.71 . . . . 0.0 111.923 178.872 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 22.2 mt -55.33 -54.36 44.54 Favored 'General case' 0 N--CA 1.467 0.416 0 C-N-CA 124.186 0.995 . . . . 0.0 111.056 173.018 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 71.1 t80 -55.61 -42.28 74.66 Favored 'General case' 0 N--CA 1.47 0.544 0 N-CA-C 113.007 0.743 . . . . 0.0 113.007 177.48 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 84.9 mt -74.88 -33.38 62.06 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 124.127 0.971 . . . . 0.0 113.341 -178.6 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 37.7 t -69.26 -44.02 80.86 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.849 0 C-N-CA 123.974 0.909 . . . . 0.0 110.684 172.498 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 72.9 m -76.79 -33.51 58.03 Favored 'General case' 0 CA--C 1.538 0.508 0 N-CA-C 113.074 0.768 . . . . 0.0 113.074 -175.936 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 68.89 -111.68 4.1 Favored Glycine 0 CA--C 1.529 0.91 0 C-N-CA 124.662 1.125 . . . . 0.0 112.044 172.166 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -69.12 -27.14 65.3 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 124.171 0.988 . . . . 0.0 112.131 173.975 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 82.8 mtm180 -72.91 153.99 40.76 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 124.803 1.241 . . . . 0.0 110.758 175.988 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . -76.22 -174.83 38.54 Favored Glycine 0 N--CA 1.474 1.175 0 C-N-CA 123.915 0.769 . . . . 0.0 111.581 168.423 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 52.5 p90 -152.46 148.09 27.01 Favored 'General case' 0 CA--C 1.536 0.442 0 N-CA-C 113.287 0.847 . . . . 0.0 113.287 179.234 . . . . . . . . 1 1 . 1 . 041 nuclear build core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 90.7 t80 . . . . . 0 CA--C 1.538 0.493 0 C-N-CA 125.787 1.635 . . . . 0.0 110.671 169.664 . . . . . . . . 0 0 . 1 . 042 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 53.0 t . . . . . 0 N--CA 1.481 1.121 0 N-CA-C 111.6 0.222 . . . . 0.0 111.6 . . . . . . . . . 0 0 . 1 . 042 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 44.2 mm-40 -79.14 -56.73 4.15 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-O 118.969 -0.539 . . . . 0.0 110.518 168.609 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 23.8 tt0 -61.58 -40.91 96.44 Favored 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 113.865 1.061 . . . . 0.0 113.865 -166.692 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 25.7 m -69.49 -21.69 63.67 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 119.204 0.911 . . . . 0.0 112.766 175.948 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 13.2 t -88.12 -41.52 12.98 Favored 'General case' 0 CA--C 1.538 0.513 0 O-C-N 121.393 -0.817 . . . . 0.0 111.617 179.814 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 72.7 p -82.29 -18.17 43.27 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 125.243 1.417 . . . . 0.0 114.034 179.668 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 71.3 p -148.36 172.42 14.44 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 124.919 1.288 . . . . 0.0 111.905 -179.485 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 64.9 mt -73.9 129.03 36.59 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.679 0 O-C-N 121.238 -0.914 . . . . 0.0 109.774 174.549 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 17.3 p -123.49 159.77 28.36 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 124.866 1.267 . . . . 0.0 111.727 169.629 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 18.8 m -108.97 153.52 23.46 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 124.3 1.04 . . . . 0.0 111.276 -171.667 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 36.6 mt -60.69 -31.15 70.41 Favored 'General case' 0 N--CA 1.472 0.629 0 O-C-N 120.907 -1.121 . . . . 0.0 112.357 179.678 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 86.9 m-85 -64.59 -25.89 68.17 Favored 'General case' 0 CA--C 1.543 0.711 0 N-CA-C 114.096 1.147 . . . . 0.0 114.096 171.684 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 57.5 mm-40 -88.41 -25.93 22.42 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 124.752 1.221 . . . . 0.0 111.38 175.136 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 9.2 mp -62.42 -49.27 76.15 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 119.467 1.03 . . . . 0.0 110.588 162.993 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 37.5 tt0 -59.55 -28.45 67.12 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 124.679 1.191 . . . . 0.0 113.411 -179.874 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 26.2 t30 -54.33 -30.99 53.22 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 124.582 1.153 . . . . 0.0 113.889 179.321 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 99.4 m-85 -95.95 0.44 51.85 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 124.989 1.316 . . . . 0.0 113.865 -177.88 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 83.0 m . . . . . 0 CA--C 1.542 0.638 0 C-N-CA 124.594 1.158 . . . . 0.0 113.655 174.959 . . . . . . . . 0 0 . 1 . 042 nuclear build core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 51.7 p-10 . . . . . 0 CA--C 1.543 0.677 0 CA-C-O 120.872 0.368 . . . . 0.0 111.328 . . . . . . . . . 0 0 . 1 . 042 nuclear build core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 42.5 mt-30 -152.3 164.93 36.44 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 124.46 1.104 . . . . 0.0 111.937 -162.946 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 21.9 m-70 -84.79 135.25 34.19 Favored 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 108.758 -0.831 . . . . 0.0 108.758 153.607 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 81.5 mt -145.09 125.16 13.61 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 126.302 1.841 . . . . 0.0 109.465 -177.671 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 58.1 m -124.74 138.1 54.3 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 125.097 1.359 . . . . 0.0 110.489 -178.141 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 51.05 -117.25 5.27 Favored Glycine 0 N--CA 1.474 1.173 0 C-N-CA 125.091 1.329 . . . . 0.0 113.947 167.352 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 19.9 m -59.84 -32.94 71.14 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 124.495 1.118 . . . . 0.0 112.786 -178.066 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 96.2 m-70 -71.25 -38.66 71.9 Favored 'General case' 0 CA--C 1.539 0.535 0 O-C-N 121.253 -0.904 . . . . 0.0 111.42 176.418 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 56.5 tp -66.68 -42.95 85.7 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 123.508 0.723 . . . . 0.0 111.241 172.913 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 42.5 t -60.61 -43.26 94.32 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.916 0 C-N-CA 124.018 0.927 . . . . 0.0 111.699 175.061 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -64.28 -45.39 88.23 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 123.74 0.816 . . . . 0.0 111.425 175.5 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.46 -46.18 91.15 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 123.068 0.547 . . . . 0.0 112.034 177.309 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 28.7 mt -56.66 -48.38 77.7 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 124.091 0.956 . . . . 0.0 111.444 175.559 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 61.9 t80 -56.84 -41.13 77.33 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 123.773 0.829 . . . . 0.0 113.095 174.774 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 90.8 mt -78.02 -35.03 50.32 Favored 'General case' 0 N--CA 1.47 0.554 0 N-CA-C 113.426 0.898 . . . . 0.0 113.426 -179.455 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 40.8 t -67.23 -44.89 87.31 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 C-N-CA 124.645 1.178 . . . . 0.0 110.415 175.94 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 74.3 m -95.34 -25.84 16.14 Favored 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 113.628 0.973 . . . . 0.0 113.628 -170.758 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 63.08 -109.37 2.67 Favored Glycine 0 CA--C 1.531 1.052 0 C-N-CA 124.361 0.982 . . . . 0.0 112.72 168.509 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 39.1 mm-40 -69.8 -24.93 63.56 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 124.418 1.087 . . . . 0.0 112.86 175.818 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 96.0 mtt-85 -77.48 141.31 39.75 Favored 'General case' 0 N--CA 1.467 0.382 0 C-N-CA 124.046 0.938 . . . . 0.0 110.617 172.768 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . -74.0 152.48 45.58 Favored Glycine 0 N--CA 1.469 0.843 0 C-N-CA 124.652 1.12 . . . . 0.0 111.6 175.192 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 45.3 p90 -131.02 166.2 21.53 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 124.867 1.267 . . . . 0.0 112.508 -173.967 . . . . . . . . 1 1 . 1 . 042 nuclear build core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 50.3 t80 . . . . . 0 CA--C 1.535 0.389 0 C-N-CA 124.215 1.006 . . . . 0.0 111.557 170.441 . . . . . . . . 0 0 . 1 . 043 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 93.4 t . . . . . 0 N--CA 1.483 1.217 0 N-CA-C 111.996 0.369 . . . . 0.0 111.996 . . . . . . . . . 0 0 . 1 . 043 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 33.4 mm-40 -89.38 -54.74 3.95 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 123.149 0.579 . . . . 0.0 110.093 169.034 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 64.4 tt0 -62.75 -44.19 96.83 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 124.77 1.228 . . . . 0.0 112.865 -168.511 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 2.7 t -81.16 -12.43 59.21 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-N 118.847 0.749 . . . . 0.0 112.777 -179.658 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 13.6 t -89.12 -40.04 13.2 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 124.227 1.011 . . . . 0.0 111.684 178.034 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 2.4 t -89.98 -36.15 15.13 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 124.813 1.245 . . . . 0.0 112.804 178.001 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 14.3 t -120.56 -149.95 0.44 Allowed 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 126.034 1.733 . . . . 0.0 109.42 172.349 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 47.7 pt -113.09 159.84 12.89 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.704 0 C-N-CA 125.099 1.36 . . . . 0.0 112.338 179.924 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 17.0 p -142.03 163.02 34.02 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 124.758 1.223 . . . . 0.0 112.166 167.194 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 13.8 m -104.93 152.48 22.61 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 125.056 1.342 . . . . 0.0 111.363 -176.052 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 33.9 mt -60.21 -34.4 73.59 Favored 'General case' 0 N--CA 1.47 0.526 0 O-C-N 120.999 -1.063 . . . . 0.0 111.549 176.42 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 85.4 t80 -60.06 -32.55 71.04 Favored 'General case' 0 CA--C 1.547 0.834 0 N-CA-C 113.213 0.82 . . . . 0.0 113.213 172.658 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 84.4 mt-30 -77.17 -36.75 54.85 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 123.773 0.829 . . . . 0.0 110.767 175.762 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 57.3 mt -60.93 -40.74 94.39 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-N 118.538 0.608 . . . . 0.0 111.729 170.416 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -62.31 -39.15 92.07 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 124.534 1.134 . . . . 0.0 112.03 175.076 . . . . . . . . 2 2 . 1 . 043 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 31.3 t30 -63.41 -26.22 68.64 Favored 'General case' 0 CA--C 1.549 0.918 0 N-CA-C 113.363 0.875 . . . . 0.0 113.363 178.091 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 7.7 m-85 -77.5 -12.39 59.96 Favored 'General case' 0 CA--C 1.545 0.775 0 N-CA-C 114.247 1.203 . . . . 0.0 114.247 173.629 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 74.0 m . . . . . 0 CA--C 1.544 0.746 0 N-CA-C 114.181 1.178 . . . . 0.0 114.181 -178.102 . . . . . . . . 0 0 . 1 . 043 nuclear build core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.541 0.618 0 N-CA-C 111.768 0.285 . . . . 0.0 111.768 . . . . . . . . . 1 1 . 1 . 043 nuclear build core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 42.4 mt-30 -146.9 165.63 29.18 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 124.301 1.04 . . . . 0.0 111.668 -166.89 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 96.6 m-70 -84.2 134.09 34.57 Favored 'General case' 0 CA--C 1.541 0.61 0 N-CA-C 108.948 -0.76 . . . . 0.0 108.948 156.882 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 92.0 mt -150.31 136.69 18.84 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 125.39 1.476 . . . . 0.0 108.995 -175.715 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 3.7 t -155.53 151.86 28.16 Favored 'General case' 0 N--CA 1.467 0.377 0 C-N-CA 123.294 0.638 . . . . 0.0 112.05 -177.241 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 54.62 -127.95 41.33 Favored Glycine 0 CA--C 1.531 1.06 0 C-N-CA 124.868 1.223 . . . . 0.0 113.338 178.851 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 24.8 m -62.58 -29.67 70.76 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 124.434 1.093 . . . . 0.0 111.988 -178.247 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 16.7 m80 -70.53 -39.39 74.08 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 124.065 0.946 . . . . 0.0 111.247 179.485 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 59.6 tp -67.9 -43.47 79.22 Favored 'General case' 0 N--CA 1.467 0.393 0 C-N-CA 123.998 0.919 . . . . 0.0 111.153 172.866 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 44.8 t -62.4 -39.17 83.3 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.941 0 C-N-CA 123.59 0.756 . . . . 0.0 111.812 176.028 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -66.3 -45.99 78.51 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 124.185 0.994 . . . . 0.0 111.541 173.985 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.0 -48.87 80.04 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 122.917 0.487 . . . . 0.0 111.766 177.109 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 23.4 mt -51.39 -53.27 38.21 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 124.882 1.273 . . . . 0.0 111.627 173.058 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 69.6 t80 -58.12 -42.88 86.72 Favored 'General case' 0 CA--C 1.54 0.592 0 N-CA-C 113.359 0.874 . . . . 0.0 113.359 177.846 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 89.5 mt -75.58 -32.07 60.22 Favored 'General case' 0 N--CA 1.47 0.55 0 N-CA-C 113.119 0.785 . . . . 0.0 113.119 -178.276 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 25.3 t -69.25 -44.42 80.6 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.746 0 C-N-CA 124.526 1.13 . . . . 0.0 110.795 174.175 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 80.9 m -94.74 -24.62 17.03 Favored 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 114.333 1.234 . . . . 0.0 114.333 -169.409 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 61.5 -109.11 2.28 Favored Glycine 0 CA--C 1.53 0.995 0 C-N-CA 124.327 0.965 . . . . 0.0 112.433 174.971 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -73.59 -24.19 60.03 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 124.079 0.951 . . . . 0.0 113.099 177.892 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 38.5 mtp85 -73.05 139.33 46.48 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 123.703 0.801 . . . . 0.0 110.496 172.895 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . -84.23 128.53 8.67 Favored Glycine 0 N--CA 1.467 0.743 0 C-N-CA 124.908 1.242 . . . . 0.0 111.269 -174.393 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 53.1 p90 -90.97 166.05 13.23 Favored 'General case' 0 CA--C 1.536 0.416 0 N-CA-C 113.446 0.906 . . . . 0.0 113.446 -177.73 . . . . . . . . 1 1 . 1 . 043 nuclear build core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 70.9 t80 . . . . . 0 CA--C 1.536 0.437 0 C-N-CA 124.987 1.315 . . . . 0.0 110.219 174.59 . . . . . . . . 0 0 . 1 . 044 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 93.1 t . . . . . 0 N--CA 1.476 0.852 0 CA-C-O 119.921 -0.085 . . . . 0.0 110.834 . . . . . . . . . 0 0 . 1 . 044 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -64.36 -43.35 94.82 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-O 119.078 -0.487 . . . . 0.0 111.345 177.902 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 42.9 tt0 -61.35 -52.61 63.92 Favored 'General case' 0 CA--C 1.533 0.302 0 CA-C-N 118.633 0.651 . . . . 0.0 111.076 176.56 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 59.7 m -60.08 -32.76 71.26 Favored 'General case' 0 N--CA 1.467 0.38 0 N-CA-C 112.906 0.706 . . . . 0.0 112.906 -176.383 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 68.8 m -76.42 -57.39 3.89 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 123.78 0.832 . . . . 0.0 111.871 176.517 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 69.7 p -81.62 -20.61 39.36 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 124.641 1.176 . . . . 0.0 113.91 -169.168 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 10.5 t -140.86 -162.58 1.38 Allowed 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 126.73 2.012 . . . . 0.0 109.575 177.891 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 38.6 pt -93.88 147.06 5.82 Favored 'Isoleucine or valine' 0 C--O 1.236 0.362 0 O-C-N 120.932 -1.105 . . . . 0.0 112.034 176.492 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 17.2 p -137.87 165.11 27.3 Favored 'General case' 0 N--CA 1.466 0.355 0 C-N-CA 125.06 1.344 . . . . 0.0 110.231 166.747 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 13.5 t -115.96 161.67 18.5 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-O 121.604 0.716 . . . . 0.0 112.419 -179.076 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 53.0 mt -58.89 -33.39 70.45 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 125.009 1.324 . . . . 0.0 111.558 174.772 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 29.0 m-85 -58.79 -33.79 70.75 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 123.788 0.835 . . . . 0.0 113.223 171.304 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 63.4 mm-40 -83.18 -29.37 28.64 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 124.226 1.01 . . . . 0.0 111.327 177.869 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 41.1 mt -64.65 -39.96 94.6 Favored 'General case' 0 N--CA 1.471 0.608 0 CA-C-N 119.148 0.886 . . . . 0.0 111.046 168.593 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 26.9 tt0 -60.84 -27.16 67.87 Favored 'General case' 0 CA--C 1.545 0.751 0 N-CA-C 113.586 0.958 . . . . 0.0 113.586 -179.561 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 21.8 t30 -58.8 -26.29 63.95 Favored 'General case' 0 CA--C 1.548 0.882 0 O-C-N 121.062 -1.024 . . . . 0.0 113.1 173.656 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 89.7 m-85 -100.8 5.95 43.66 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 125.597 1.559 . . . . 0.0 113.967 -178.046 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 63.8 m . . . . . 0 CA--C 1.542 0.66 0 O-C-N 120.999 -1.063 . . . . 0.0 111.995 166.081 . . . . . . . . 0 0 . 1 . 044 nuclear build core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 8.7 m120 . . . . . 0 CA--C 1.543 0.703 0 N-CA-C 111.696 0.258 . . . . 0.0 111.696 . . . . . . . . . 0 0 . 1 . 044 nuclear build core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 42.7 mt-30 -150.93 161.12 43.32 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 125.45 1.5 . . . . 0.0 111.031 -178.493 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 37.1 m-70 -80.51 136.54 36.31 Favored 'General case' 0 CA--C 1.544 0.74 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 152.122 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 90.1 mt -150.07 127.17 11.24 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 125.86 1.664 . . . . 0.0 107.727 -172.917 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 4.2 t -152.19 156.64 40.17 Favored 'General case' 0 CA--C 1.535 0.404 0 O-C-N 121.44 -0.787 . . . . 0.0 112.586 -172.375 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 61.47 -138.6 47.11 Favored Glycine 0 CA--C 1.528 0.888 0 C-N-CA 125.002 1.287 . . . . 0.0 112.941 177.386 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 23.8 p -57.01 -39.2 74.28 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 123.915 0.886 . . . . 0.0 112.516 174.996 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 17.2 m-70 -65.12 -29.17 70.01 Favored 'General case' 0 CA--C 1.545 0.763 0 O-C-N 121.131 -0.981 . . . . 0.0 113.364 -179.4 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 55.9 tp -69.49 -41.76 75.69 Favored 'General case' 0 N--CA 1.469 0.476 0 O-C-N 121.476 -0.765 . . . . 0.0 111.527 170.115 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 94.6 t -64.25 -38.7 83.19 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.901 0 C-N-CA 123.098 0.559 . . . . 0.0 110.942 175.976 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 49.7 mt-10 -64.02 -48.08 77.72 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 124.485 1.114 . . . . 0.0 111.421 173.02 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.29 -45.51 93.11 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-N 119.158 0.89 . . . . 0.0 111.752 178.233 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 53.2 tp -57.45 -51.87 67.68 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 124.403 1.081 . . . . 0.0 110.933 175.077 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 54.8 t80 -56.67 -40.59 75.81 Favored 'General case' 0 CA--C 1.539 0.548 0 N-CA-C 113.42 0.896 . . . . 0.0 113.42 175.283 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 76.7 mt -73.04 -32.2 64.92 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 124.088 0.955 . . . . 0.0 112.934 179.641 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 37.1 t -68.41 -45.88 81.51 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.752 0 C-N-CA 123.739 0.816 . . . . 0.0 110.739 171.039 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 85.0 m -75.94 -36.07 59.49 Favored 'General case' 0 CA--C 1.535 0.398 0 N-CA-C 113.389 0.885 . . . . 0.0 113.389 -175.575 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 63.64 -134.56 41.39 Favored Glycine 0 CA--C 1.531 1.069 0 C-N-CA 124.433 1.016 . . . . 0.0 111.632 -176.136 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -62.94 -17.59 62.09 Favored 'General case' 0 CA--C 1.543 0.703 0 N-CA-C 114.741 1.385 . . . . 0.0 114.741 179.06 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 84.0 mtm180 -62.96 -32.0 73.23 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 124.418 1.087 . . . . 0.0 113.344 -179.152 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 80.32 -178.9 53.68 Favored Glycine 0 CA--C 1.532 1.148 0 C-N-CA 124.707 1.146 . . . . 0.0 112.431 -171.358 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 51.7 p90 -156.04 164.77 38.02 Favored 'General case' 0 N--CA 1.469 0.493 0 N-CA-C 113.531 0.937 . . . . 0.0 113.531 -172.506 . . . . . . . . 1 1 . 1 . 044 nuclear build core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 40.1 t80 . . . . . 0 CA--C 1.538 0.495 0 C-N-CA 126.139 1.776 . . . . 0.0 109.502 174.5 . . . . . . . . 0 0 . 1 . 045 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 73.0 t . . . . . 0 N--CA 1.482 1.126 0 N-CA-C 112.036 0.384 . . . . 0.0 112.036 . . . . . . . . . 0 0 . 1 . 045 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -84.76 -6.05 59.34 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 125.286 1.434 . . . . 0.0 113.907 179.535 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 64.1 tt0 -106.38 -57.24 2.08 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 124.904 1.282 . . . . 0.0 110.099 -178.891 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 89.7 m -66.22 -28.23 68.59 Favored 'General case' 0 N--CA 1.465 0.322 0 C-N-CA 124.881 1.273 . . . . 0.0 113.931 -178.276 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 8.4 t -80.48 -42.91 21.72 Favored 'General case' 0 CA--C 1.541 0.622 0 O-C-N 121.636 -0.665 . . . . 0.0 110.733 178.526 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 20.1 m -77.02 -33.45 57.46 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 127.386 2.274 . . . . 0.0 112.924 -173.763 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.5 t -146.07 -173.62 4.21 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 124.879 1.272 . . . . 0.0 111.142 -179.305 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 65.0 mt -74.28 134.22 29.98 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.58 0 O-C-N 120.613 -1.304 . . . . 0.0 110.256 175.192 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 8.3 p -128.6 173.1 10.57 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 124.86 1.264 . . . . 0.0 111.142 166.103 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 5.7 m -123.58 149.24 45.54 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 123.728 0.811 . . . . 0.0 110.917 -169.938 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 39.8 mt -59.49 -33.07 70.88 Favored 'General case' 0 N--CA 1.471 0.617 0 O-C-N 120.89 -1.131 . . . . 0.0 111.856 173.345 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 79.9 t80 -60.11 -28.24 67.69 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 124.366 1.066 . . . . 0.0 113.612 171.729 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 58.4 mm-40 -84.32 -36.26 22.7 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 124.131 0.973 . . . . 0.0 110.644 174.402 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 49.7 mt -60.33 -30.93 69.83 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-N 119.723 1.147 . . . . 0.0 112.278 172.13 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -59.26 -27.39 65.76 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 124.376 1.07 . . . . 0.0 113.512 176.18 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 33.3 t30 -65.74 -24.24 66.92 Favored 'General case' 0 CA--C 1.55 0.945 0 O-C-N 121.1 -1.0 . . . . 0.0 113.057 174.129 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 87.6 m-85 -99.7 5.01 45.8 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 126.081 1.752 . . . . 0.0 113.368 -176.154 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 56.5 m . . . . . 0 CA--C 1.544 0.712 0 O-C-N 121.408 -0.807 . . . . 0.0 112.025 163.575 . . . . . . . . 0 0 . 1 . 045 nuclear build core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 30.5 m-20 . . . . . 0 CA--C 1.539 0.547 0 N-CA-C 109.745 -0.465 . . . . 0.0 109.745 . . . . . . . . . 0 0 . 1 . 045 nuclear build core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 44.3 mt-30 -151.51 165.08 35.31 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 124.593 1.157 . . . . 0.0 112.181 -168.564 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 17.5 m-70 -77.07 137.22 38.81 Favored 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 108.631 -0.877 . . . . 0.0 108.631 150.951 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 70.0 mt -146.02 129.26 16.69 Favored 'General case' 0 C--N 1.331 -0.2 0 C-N-CA 125.612 1.565 . . . . 0.0 108.295 -176.565 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 4.2 t -148.67 154.36 39.55 Favored 'General case' 0 N--CA 1.465 0.316 0 C-N-CA 123.238 0.615 . . . . 0.0 111.716 -175.863 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 52.06 -129.46 35.54 Favored Glycine 0 CA--C 1.529 0.923 0 C-N-CA 125.336 1.446 . . . . 0.0 113.056 176.975 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 19.9 m -57.86 -34.62 69.94 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 124.251 1.02 . . . . 0.0 112.737 -179.32 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 75.1 m-70 -75.11 -28.96 60.44 Favored 'General case' 0 CA--C 1.541 0.602 0 O-C-N 121.073 -1.017 . . . . 0.0 113.017 177.797 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 50.1 tp -70.68 -42.63 70.47 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 119.037 0.835 . . . . 0.0 111.058 169.008 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 82.1 t -59.48 -42.45 87.88 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.106 0 CA-C-N 118.477 0.58 . . . . 0.0 111.442 172.548 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -61.83 -48.85 78.72 Favored 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 125.439 1.496 . . . . 0.0 111.843 176.458 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -64.29 -45.26 88.76 Favored 'General case' 0 CA--C 1.54 0.572 0 O-C-N 121.681 -0.637 . . . . 0.0 111.733 179.818 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 45.8 tp -59.76 -46.32 89.52 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 123.868 0.867 . . . . 0.0 110.816 175.994 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 39.1 t80 -58.8 -39.81 82.24 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 123.875 0.87 . . . . 0.0 113.183 172.965 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 68.5 mt -69.59 -31.93 70.37 Favored 'General case' 0 N--CA 1.469 0.516 0 O-C-N 121.482 -0.761 . . . . 0.0 112.952 177.993 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 70.2 t -77.35 -40.04 28.69 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.887 0 C-N-CA 124.238 1.015 . . . . 0.0 111.564 174.693 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 85.4 m -108.34 4.92 25.02 Favored 'General case' 0 N--CA 1.47 0.556 0 N-CA-C 115.246 1.573 . . . . 0.0 115.246 -167.269 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . -60.45 -24.17 61.29 Favored Glycine 0 N--CA 1.478 1.446 0 N-CA-C 116.837 1.495 . . . . 0.0 116.837 -161.469 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -77.06 -27.08 54.22 Favored 'General case' 0 CA--C 1.549 0.94 0 CA-C-N 118.406 1.103 . . . . 0.0 112.834 173.714 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 66.1 mtp180 -100.37 -35.4 9.6 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 126.238 1.815 . . . . 0.0 113.497 -174.695 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 88.88 174.43 46.82 Favored Glycine 0 CA--C 1.533 1.192 0 C-N-CA 124.738 1.161 . . . . 0.0 111.44 -159.953 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 40.4 p90 -151.17 167.76 26.77 Favored 'General case' 0 N--CA 1.475 0.775 0 N-CA-C 114.466 1.284 . . . . 0.0 114.466 -172.37 . . . . . . . . 1 1 . 1 . 045 nuclear build core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 45.1 t80 . . . . . 0 CA--C 1.539 0.547 0 C-N-CA 126.005 1.722 . . . . 0.0 110.401 172.406 . . . . . . . . 0 0 . 1 . 046 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 75.8 t . . . . . 0 N--CA 1.487 1.377 0 N-CA-C 112.981 0.734 . . . . 0.0 112.981 . . . . . . . . . 0 0 . 1 . 046 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 43.3 tt0 -76.98 -50.77 12.42 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-N 118.171 0.441 . . . . 0.0 110.131 169.621 . . . . . . . . 1 1 . 1 . 046 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 61.2 tt0 -61.37 -40.48 94.49 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 113.483 0.92 . . . . 0.0 113.483 -169.587 . . . . . . . . 1 1 . 1 . 046 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 7.5 m -64.99 -23.16 67.14 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 113.634 0.976 . . . . 0.0 113.634 174.388 . . . . . . . . 1 1 . 1 . 046 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 26.6 t -94.03 -39.8 10.43 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 124.12 0.968 . . . . 0.0 112.811 -177.544 . . . . . . . . 1 1 . 1 . 046 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 73.2 p -85.41 -40.7 16.15 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 124.856 1.262 . . . . 0.0 112.57 179.116 . . . . . . . . 1 1 . 1 . 046 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 47.8 m -105.32 -170.23 1.72 Allowed 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 125.597 1.559 . . . . 0.0 110.152 170.515 . . . . . . . . 1 1 . 1 . 046 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 11.7 tt -103.43 146.86 10.52 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.8 0 C-N-CA 124.979 1.312 . . . . 0.0 110.025 175.971 . . . . . . . . 1 1 . 1 . 046 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 14.2 p -142.04 162.04 36.47 Favored 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 113.613 0.968 . . . . 0.0 113.613 -178.304 . . . . . . . . 1 1 . 1 . 046 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 19.4 m -112.96 150.1 32.34 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 124.386 1.075 . . . . 0.0 111.994 -170.234 . . . . . . . . 1 1 . 1 . 046 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 28.2 mt -61.1 -33.37 73.25 Favored 'General case' 0 N--CA 1.473 0.713 0 O-C-N 121.275 -0.891 . . . . 0.0 111.858 177.461 . . . . . . . . 1 1 . 1 . 046 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 57.5 m-85 -62.03 -31.85 72.28 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 124.538 1.135 . . . . 0.0 113.082 173.121 . . . . . . . . 1 1 . 1 . 046 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 22.6 mm100 -81.81 -31.18 31.89 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 124.407 1.083 . . . . 0.0 111.684 174.021 . . . . . . . . 1 1 . 1 . 046 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 53.7 mt -62.07 -38.76 90.03 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-N 119.644 1.111 . . . . 0.0 111.397 168.472 . . . . . . . . 1 1 . 1 . 046 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 28.7 tt0 -61.3 -26.02 67.51 Favored 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 113.45 0.907 . . . . 0.0 113.45 -179.396 . . . . . . . . 1 1 . 1 . 046 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 16.1 t-20 -59.72 -22.96 62.76 Favored 'General case' 0 CA--C 1.551 1.015 0 O-C-N 121.156 -0.965 . . . . 0.0 113.547 173.004 . . . . . . . . 1 1 . 1 . 046 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 96.2 m-85 -97.61 1.22 48.52 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 125.61 1.564 . . . . 0.0 114.033 179.574 . . . . . . . . 1 1 . 1 . 046 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 59.6 m . . . . . 0 CA--C 1.543 0.706 0 O-C-N 121.144 -0.973 . . . . 0.0 111.962 168.402 . . . . . . . . 0 0 . 1 . 046 nuclear build core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 10.1 p30 . . . . . 0 CA--C 1.541 0.6 0 CA-C-O 120.677 0.275 . . . . 0.0 111.712 . . . . . . . . . 0 0 . 1 . 046 nuclear build core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 34.3 mm-40 -150.89 162.12 41.39 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 124.282 1.033 . . . . 0.0 112.32 -162.28 . . . . . . . . 1 1 . 1 . 046 nuclear build core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 98.1 m-70 -85.91 130.07 34.65 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 123.612 0.765 . . . . 0.0 109.046 164.185 . . . . . . . . 1 1 . 1 . 046 nuclear build core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 90.3 mt -142.83 128.51 19.23 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 125.16 1.384 . . . . 0.0 109.445 -172.112 . . . . . . . . 1 1 . 1 . 046 nuclear build core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 62.7 m -131.62 143.2 50.15 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 124.932 1.293 . . . . 0.0 111.046 -176.246 . . . . . . . . 1 1 . 1 . 046 nuclear build core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 54.51 -127.44 39.83 Favored Glycine 0 N--CA 1.475 1.287 0 C-N-CA 124.846 1.212 . . . . 0.0 114.363 165.275 . . . . . . . . 1 1 . 1 . 046 nuclear build core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 20.3 m -61.09 -33.67 73.72 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 124.152 0.981 . . . . 0.0 112.223 -177.749 . . . . . . . . 1 1 . 1 . 046 nuclear build core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 27.2 m170 -70.93 -37.6 72.89 Favored 'General case' 0 CA--C 1.544 0.716 0 O-C-N 121.353 -0.842 . . . . 0.0 111.391 177.83 . . . . . . . . 1 1 . 1 . 046 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 54.7 tp -66.38 -45.78 78.9 Favored 'General case' 0 N--CA 1.466 0.339 0 C-N-CA 123.697 0.799 . . . . 0.0 111.543 171.398 . . . . . . . . 1 1 . 1 . 046 nuclear build core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 62.4 t -63.0 -36.44 75.8 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.785 0 C-N-CA 123.121 0.569 . . . . 0.0 111.465 177.421 . . . . . . . . 1 1 . 1 . 046 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -66.14 -47.34 74.4 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 123.924 0.89 . . . . 0.0 112.046 172.278 . . . . . . . . 1 1 . 1 . 046 nuclear build core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.47 -46.14 89.63 Favored 'General case' 0 CA--C 1.538 0.505 0 O-C-N 121.554 -0.716 . . . . 0.0 111.754 177.007 . . . . . . . . 1 1 . 1 . 046 nuclear build core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 50.8 tp -58.5 -49.93 75.6 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 124.849 1.26 . . . . 0.0 110.997 174.828 . . . . . . . . 1 1 . 1 . 046 nuclear build core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 52.1 t80 -56.17 -41.04 74.85 Favored 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 113.11 0.782 . . . . 0.0 113.11 174.329 . . . . . . . . 1 1 . 1 . 046 nuclear build core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 80.1 mt -72.24 -35.51 68.85 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 123.91 0.884 . . . . 0.0 112.818 179.083 . . . . . . . . 1 1 . 1 . 046 nuclear build core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 37.8 t -64.01 -46.14 94.73 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.912 0 C-N-CA 123.793 0.837 . . . . 0.0 110.827 171.333 . . . . . . . . 1 1 . 1 . 046 nuclear build core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 81.5 m -78.18 -30.96 49.33 Favored 'General case' 0 N--CA 1.469 0.493 0 N-CA-C 113.437 0.902 . . . . 0.0 113.437 -175.743 . . . . . . . . 1 1 . 1 . 046 nuclear build core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 63.92 -137.76 41.53 Favored Glycine 0 CA--C 1.531 1.057 0 C-N-CA 123.843 0.735 . . . . 0.0 111.417 -174.924 . . . . . . . . 1 1 . 1 . 046 nuclear build core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 28.2 tt0 -67.71 -15.22 63.53 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 124.428 1.091 . . . . 0.0 113.907 -178.573 . . . . . . . . 1 1 . 1 . 046 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 81.7 mtm180 -57.69 -41.11 80.96 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 124.126 0.971 . . . . 0.0 112.574 178.441 . . . . . . . . 1 1 . 1 . 046 nuclear build core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 81.71 -178.29 53.75 Favored Glycine 0 CA--C 1.532 1.108 0 C-N-CA 124.133 0.873 . . . . 0.0 112.1 -168.591 . . . . . . . . 1 1 . 1 . 046 nuclear build core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 52.5 p90 -159.71 167.68 27.76 Favored 'General case' 0 CA--C 1.539 0.548 0 N-CA-C 113.76 1.022 . . . . 0.0 113.76 -167.258 . . . . . . . . 1 1 . 1 . 046 nuclear build core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 86.3 t80 . . . . . 0 CA--C 1.541 0.598 0 C-N-CA 126.134 1.773 . . . . 0.0 109.76 166.672 . . . . . . . . 0 0 . 1 . 047 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 44.2 t . . . . . 0 N--CA 1.487 1.385 0 N-CA-C 112.87 0.692 . . . . 0.0 112.87 . . . . . . . . . 0 0 . 1 . 047 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -84.17 -32.04 24.83 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 123.395 0.678 . . . . 0.0 111.465 177.969 . . . . . . . . 1 1 . 1 . 047 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 63.9 tt0 -65.88 -40.21 91.39 Favored 'General case' 0 CA--C 1.537 0.446 0 O-C-N 121.516 -0.74 . . . . 0.0 112.091 179.666 . . . . . . . . 1 1 . 1 . 047 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 13.2 t -77.03 -15.95 59.45 Favored 'General case' 0 CA--C 1.539 0.543 0 N-CA-C 113.405 0.891 . . . . 0.0 113.405 174.872 . . . . . . . . 1 1 . 1 . 047 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 33.8 t -82.14 -40.1 22.33 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 124.715 1.206 . . . . 0.0 112.123 174.128 . . . . . . . . 1 1 . 1 . 047 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 25.8 p -85.84 -49.37 7.95 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 125.991 1.716 . . . . 0.0 112.047 179.817 . . . . . . . . 1 1 . 1 . 047 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 63.3 m -97.73 -139.05 0.29 Allowed 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 125.586 1.555 . . . . 0.0 109.673 166.308 . . . . . . . . 1 1 . 1 . 047 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 32.8 pt -136.06 161.15 38.24 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.783 0 C-N-CA 125.558 1.543 . . . . 0.0 111.643 -177.705 . . . . . . . . 1 1 . 1 . 047 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 14.9 p -154.71 159.18 40.54 Favored 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 124.758 1.223 . . . . 0.0 112.08 170.576 . . . . . . . . 1 1 . 1 . 047 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 2.3 t -106.01 165.58 11.11 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 124.104 0.962 . . . . 0.0 111.938 177.193 . . . . . . . . 1 1 . 1 . 047 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.541 HD22 ' H ' ' A' ' 13' ' ' LEU . 2.0 mm? -59.99 -32.44 70.86 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.958 1.303 . . . . 0.0 111.422 178.161 . . . . . . . . 2 2 . 1 . 047 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 80.3 t80 -63.79 -26.61 68.71 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 124.56 1.144 . . . . 0.0 113.425 172.838 . . . . . . . . 1 1 . 1 . 047 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 72.9 mt-30 -87.82 -31.7 19.43 Favored 'General case' 0 N--CA 1.467 0.386 0 C-N-CA 124.511 1.124 . . . . 0.0 111.17 175.518 . . . . . . . . 1 1 . 1 . 047 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 70.9 mt -59.6 -38.41 81.2 Favored 'General case' 0 N--CA 1.472 0.656 0 CA-C-N 119.322 0.964 . . . . 0.0 111.171 166.018 . . . . . . . . 1 1 . 1 . 047 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 27.2 tt0 -58.1 -25.83 61.83 Favored 'General case' 0 CA--C 1.548 0.885 0 N-CA-C 113.85 1.055 . . . . 0.0 113.85 179.424 . . . . . . . . 1 1 . 1 . 047 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 32.0 t30 -60.78 -26.27 67.13 Favored 'General case' 0 CA--C 1.547 0.86 0 O-C-N 121.024 -1.047 . . . . 0.0 113.205 174.081 . . . . . . . . 1 1 . 1 . 047 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 92.8 m-85 -100.08 5.17 44.97 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 125.75 1.62 . . . . 0.0 114.285 -175.348 . . . . . . . . 1 1 . 1 . 047 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 68.8 m . . . . . 0 N--CA 1.473 0.7 0 N-CA-C 113.583 0.957 . . . . 0.0 113.583 167.818 . . . . . . . . 0 0 . 1 . 047 nuclear build core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . 0.279 0.5 OUTLIER . . . . . 0 N--CA 1.473 0.714 0 N-CA-C 116.259 1.948 . . . . 0.0 116.259 . . . . . . . . . 2 2 . 1 . 047 nuclear build core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 71.3 mm-40 -123.31 168.6 12.28 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 125.242 1.417 . . . . 0.0 111.394 -168.446 . . . . . . . . 1 1 . 1 . 047 nuclear build core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 98.4 m-70 -82.9 125.76 31.73 Favored 'General case' 0 CA--C 1.537 0.462 0 O-C-N 121.296 -0.878 . . . . 0.0 108.667 165.804 . . . . . . . . 1 1 . 1 . 047 nuclear build core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 93.7 mt -142.62 137.08 29.76 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 125.255 1.422 . . . . 0.0 108.118 -179.668 . . . . . . . . 1 1 . 1 . 047 nuclear build core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 4.5 t -143.68 151.83 40.57 Favored 'General case' 0 N--CA 1.466 0.374 0 N-CA-C 112.836 0.68 . . . . 0.0 112.836 -171.797 . . . . . . . . 1 1 . 1 . 047 nuclear build core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 46.14 -128.66 10.13 Favored Glycine 0 CA--C 1.529 0.915 0 C-N-CA 125.985 1.755 . . . . 0.0 114.377 170.378 . . . . . . . . 1 1 . 1 . 047 nuclear build core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 20.0 m -59.48 -33.12 70.93 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 124.777 1.231 . . . . 0.0 112.549 -178.619 . . . . . . . . 1 1 . 1 . 047 nuclear build core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 97.4 m-70 -71.48 -39.81 70.63 Favored 'General case' 0 CA--C 1.541 0.605 0 O-C-N 121.088 -1.008 . . . . 0.0 111.472 178.555 . . . . . . . . 1 1 . 1 . 047 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 8.2 tt -65.57 -44.35 87.0 Favored 'General case' 0 N--CA 1.466 0.329 0 C-N-CA 123.171 0.588 . . . . 0.0 111.003 170.8 . . . . . . . . 1 1 . 1 . 047 nuclear build core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 53.3 t -64.31 -34.34 68.54 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.964 0 CA-C-N 118.406 0.548 . . . . 0.0 111.758 179.012 . . . . . . . . 1 1 . 1 . 047 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -67.53 -48.09 68.02 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 123.95 0.9 . . . . 0.0 111.562 171.864 . . . . . . . . 1 1 . 1 . 047 nuclear build core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -58.99 -44.8 91.65 Favored 'General case' 0 CA--C 1.542 0.668 0 O-C-N 121.736 -0.602 . . . . 0.0 111.775 176.141 . . . . . . . . 1 1 . 1 . 047 nuclear build core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 61.4 tp -56.41 -52.5 64.42 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 125.603 1.561 . . . . 0.0 110.753 173.825 . . . . . . . . 1 1 . 1 . 047 nuclear build core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 48.7 t80 -56.14 -39.78 72.82 Favored 'General case' 0 CA--C 1.543 0.69 0 N-CA-C 113.334 0.864 . . . . 0.0 113.334 174.715 . . . . . . . . 1 1 . 1 . 047 nuclear build core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 82.7 mt -72.75 -32.53 65.72 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 123.87 0.868 . . . . 0.0 113.071 178.613 . . . . . . . . 1 1 . 1 . 047 nuclear build core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 34.2 t -67.76 -44.56 85.64 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.995 0 C-N-CA 124.651 1.18 . . . . 0.0 110.594 171.736 . . . . . . . . 1 1 . 1 . 047 nuclear build core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 62.4 m -83.31 -30.23 27.7 Favored 'General case' 0 N--CA 1.471 0.576 0 N-CA-C 114.375 1.25 . . . . 0.0 114.375 -173.888 . . . . . . . . 1 1 . 1 . 047 nuclear build core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 65.32 -151.29 51.68 Favored Glycine 0 CA--C 1.533 1.203 0 C-N-CA 124.464 1.03 . . . . 0.0 112.355 -173.004 . . . . . . . . 1 1 . 1 . 047 nuclear build core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -61.48 -13.65 22.58 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 125.535 1.534 . . . . 0.0 114.246 -178.286 . . . . . . . . 1 1 . 1 . 047 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 59.1 ttm-85 -63.2 -25.43 68.33 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 125.022 1.329 . . . . 0.0 113.013 175.135 . . . . . . . . 1 1 . 1 . 047 nuclear build core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 78.32 -171.63 55.15 Favored Glycine 0 N--CA 1.471 0.992 0 C-N-CA 124.582 1.087 . . . . 0.0 113.036 -178.785 . . . . . . . . 1 1 . 1 . 047 nuclear build core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 50.3 p90 -162.0 166.67 25.68 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 125.028 1.331 . . . . 0.0 113.143 -170.544 . . . . . . . . 1 1 . 1 . 047 nuclear build core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 83.9 t80 . . . . . 0 CA--C 1.538 0.511 0 C-N-CA 125.63 1.572 . . . . 0.0 109.766 167.81 . . . . . . . . 0 0 . 1 . 048 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 78.1 t . . . . . 0 N--CA 1.485 1.293 0 N-CA-C 111.86 0.319 . . . . 0.0 111.86 . . . . . . . . . 0 0 . 1 . 048 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 -79.09 -56.89 4.04 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 123.267 0.627 . . . . 0.0 109.957 169.632 . . . . . . . . 1 1 . 1 . 048 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 23.0 tt0 -67.28 -40.3 86.12 Favored 'General case' 0 N--CA 1.467 0.409 0 N-CA-C 112.823 0.675 . . . . 0.0 112.823 -164.483 . . . . . . . . 1 1 . 1 . 048 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 64.5 m -66.81 -24.08 66.12 Favored 'General case' 0 CA--C 1.534 0.334 0 N-CA-C 113.666 0.987 . . . . 0.0 113.666 178.635 . . . . . . . . 1 1 . 1 . 048 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 33.3 t -98.66 -37.5 9.48 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 124.015 0.926 . . . . 0.0 112.76 -175.376 . . . . . . . . 1 1 . 1 . 048 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 76.8 p -88.63 -33.51 17.6 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 125.077 1.351 . . . . 0.0 113.108 178.978 . . . . . . . . 1 1 . 1 . 048 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 49.0 m -117.39 -168.45 1.49 Allowed 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 125.883 1.673 . . . . 0.0 109.85 170.446 . . . . . . . . 1 1 . 1 . 048 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 12.0 tt -96.66 148.07 5.73 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.659 0 O-C-N 120.834 -1.166 . . . . 0.0 109.821 171.034 . . . . . . . . 1 1 . 1 . 048 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 11.0 p -138.83 166.79 23.51 Favored 'General case' 0 N--CA 1.475 0.785 0 O-C-N 121.251 -0.906 . . . . 0.0 112.828 177.714 . . . . . . . . 1 1 . 1 . 048 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 22.7 t -108.99 157.89 18.23 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-O 121.786 0.803 . . . . 0.0 112.936 -177.927 . . . . . . . . 1 1 . 1 . 048 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 44.4 mt -60.86 -31.12 70.59 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 123.572 0.749 . . . . 0.0 111.44 169.437 . . . . . . . . 1 1 . 1 . 048 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 85.1 t80 -62.96 -28.99 70.46 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.31 1.044 . . . . 0.0 113.223 172.439 . . . . . . . . 1 1 . 1 . 048 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 64.9 mt-30 -80.28 -38.18 31.31 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 123.494 0.718 . . . . 0.0 110.702 174.164 . . . . . . . . 1 1 . 1 . 048 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 42.1 mt -60.49 -37.24 80.44 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-N 118.639 0.654 . . . . 0.0 112.016 170.75 . . . . . . . . 1 1 . 1 . 048 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -61.31 -30.62 70.61 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 124.329 1.052 . . . . 0.0 112.923 178.881 . . . . . . . . 1 1 . 1 . 048 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 14.5 t-20 -65.14 -20.75 66.61 Favored 'General case' 0 CA--C 1.55 0.963 0 O-C-N 121.461 -0.774 . . . . 0.0 112.931 177.134 . . . . . . . . 1 1 . 1 . 048 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 45.4 m-85 -98.91 0.89 45.03 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 125.699 1.599 . . . . 0.0 113.74 179.964 . . . . . . . . 1 1 . 1 . 048 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 60.3 m . . . . . 0 CA--C 1.544 0.747 0 O-C-N 120.942 -1.099 . . . . 0.0 112.872 172.829 . . . . . . . . 0 0 . 1 . 048 nuclear build core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 8.5 p30 . . . . . 0 CA--C 1.542 0.646 0 N-CA-C 112.516 0.561 . . . . 0.0 112.516 . . . . . . . . . 0 0 . 1 . 048 nuclear build core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 54.0 mm-40 -153.42 161.18 42.55 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 125.412 1.485 . . . . 0.0 111.228 -164.985 . . . . . . . . 1 1 . 1 . 048 nuclear build core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 92.9 m-70 -87.93 129.56 35.2 Favored 'General case' 0 CA--C 1.539 0.55 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 159.871 . . . . . . . . 1 1 . 1 . 048 nuclear build core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 87.3 mt -142.96 123.47 13.98 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 125.304 1.442 . . . . 0.0 109.895 -172.952 . . . . . . . . 1 1 . 1 . 048 nuclear build core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 68.5 m -127.87 142.39 51.29 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 125.449 1.499 . . . . 0.0 110.177 178.164 . . . . . . . . 1 1 . 1 . 048 nuclear build core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 51.78 -117.03 5.46 Favored Glycine 0 N--CA 1.472 1.041 0 C-N-CA 125.221 1.391 . . . . 0.0 113.941 167.031 . . . . . . . . 1 1 . 1 . 048 nuclear build core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 20.2 t -60.05 -37.38 79.66 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 123.769 0.828 . . . . 0.0 112.266 -178.65 . . . . . . . . 1 1 . 1 . 048 nuclear build core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 92.6 m-70 -68.0 -40.37 83.03 Favored 'General case' 0 CA--C 1.541 0.605 0 O-C-N 120.975 -1.078 . . . . 0.0 111.4 177.21 . . . . . . . . 1 1 . 1 . 048 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 52.5 tp -64.4 -46.03 85.03 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 123.763 0.825 . . . . 0.0 110.949 174.09 . . . . . . . . 1 1 . 1 . 048 nuclear build core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 33.1 t -61.05 -38.91 80.6 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.797 0 C-N-CA 124.453 1.101 . . . . 0.0 111.988 176.475 . . . . . . . . 1 1 . 1 . 048 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -64.97 -48.04 75.46 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 123.45 0.7 . . . . 0.0 111.094 174.61 . . . . . . . . 1 1 . 1 . 048 nuclear build core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.17 -43.38 98.96 Favored 'General case' 0 CA--C 1.542 0.646 0 O-C-N 121.638 -0.664 . . . . 0.0 112.116 178.246 . . . . . . . . 1 1 . 1 . 048 nuclear build core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 19.1 mt -56.31 -48.76 76.02 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 124.162 0.985 . . . . 0.0 111.302 172.707 . . . . . . . . 1 1 . 1 . 048 nuclear build core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 64.1 t80 -64.91 -30.71 71.72 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 119.207 0.912 . . . . 0.0 113.095 176.845 . . . . . . . . 1 1 . 1 . 048 nuclear build core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 73.8 mt -72.52 -36.17 68.27 Favored 'General case' 0 N--CA 1.471 0.578 0 O-C-N 121.091 -1.006 . . . . 0.0 112.981 174.799 . . . . . . . . 1 1 . 1 . 048 nuclear build core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 73.3 t -77.14 -39.12 28.52 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.004 0 C-N-CA 123.851 0.86 . . . . 0.0 111.715 176.351 . . . . . . . . 1 1 . 1 . 048 nuclear build core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 66.6 m -111.27 -4.3 15.01 Favored 'General case' 0 N--CA 1.476 0.843 0 N-CA-C 114.993 1.479 . . . . 0.0 114.993 -167.459 . . . . . . . . 1 1 . 1 . 048 nuclear build core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . -74.04 145.67 35.32 Favored Glycine 0 CA--C 1.535 1.325 0 O-C-N 120.776 -1.203 . . . . 0.0 112.258 -177.246 . . . . . . . . 1 1 . 1 . 048 nuclear build core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -86.39 -0.13 55.28 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 128.041 2.537 . . . . 0.0 113.608 0.326 . . . . . . . . 1 1 . 1 . 048 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 35.7 mtp180 -63.32 -34.84 78.56 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 125.044 1.338 . . . . 0.0 113.407 -173.641 . . . . . . . . 1 1 . 1 . 048 nuclear build core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 93.74 -179.48 38.53 Favored Glycine 0 N--CA 1.472 1.094 0 C-N-CA 125.097 1.332 . . . . 0.0 113.437 178.895 . . . . . . . . 1 1 . 1 . 048 nuclear build core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 39.8 p90 -150.97 161.82 42.01 Favored 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 114.012 1.116 . . . . 0.0 114.012 -169.311 . . . . . . . . 1 1 . 1 . 048 nuclear build core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 47.0 m-85 . . . . . 0 CA--C 1.548 0.874 0 C-N-CA 126.684 1.994 . . . . 0.0 113.123 -172.346 . . . . . . . . 0 0 . 1 . 049 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 41.8 t . . . . . 0 N--CA 1.482 1.132 0 N-CA-C 112.443 0.535 . . . . 0.0 112.443 . . . . . . . . . 0 0 . 1 . 049 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -89.71 -49.14 6.82 Favored 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 123.263 0.625 . . . . 0.0 110.376 169.408 . . . . . . . . 1 1 . 1 . 049 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 65.3 tt0 -66.45 -40.49 89.44 Favored 'General case' 0 N--CA 1.464 0.234 0 C-N-CA 124.6 1.16 . . . . 0.0 113.013 -168.013 . . . . . . . . 1 1 . 1 . 049 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 4.3 t -82.08 -15.29 53.99 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 119.096 0.862 . . . . 0.0 112.688 -178.526 . . . . . . . . 1 1 . 1 . 049 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 49.1 t -92.16 -40.71 10.86 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 124.6 1.16 . . . . 0.0 112.363 178.423 . . . . . . . . 1 1 . 1 . 049 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 63.0 p -84.01 -44.67 13.91 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 124.996 1.318 . . . . 0.0 112.007 177.6 . . . . . . . . 1 1 . 1 . 049 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 50.5 m -106.85 -141.73 0.37 Allowed 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 125.473 1.509 . . . . 0.0 109.529 167.028 . . . . . . . . 1 1 . 1 . 049 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 45.0 pt -127.02 165.64 25.24 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.667 0 C-N-CA 125.078 1.351 . . . . 0.0 111.396 179.77 . . . . . . . . 1 1 . 1 . 049 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 16.1 p -147.09 160.61 42.2 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 123.886 0.874 . . . . 0.0 112.543 168.286 . . . . . . . . 1 1 . 1 . 049 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 25.4 t -95.97 160.05 14.66 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 124.826 1.25 . . . . 0.0 112.451 176.802 . . . . . . . . 1 1 . 1 . 049 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 52.7 mt -60.6 -34.57 74.41 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 124.07 0.948 . . . . 0.0 111.101 171.089 . . . . . . . . 1 1 . 1 . 049 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 82.6 t80 -62.63 -26.72 68.77 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 124.596 1.158 . . . . 0.0 113.091 173.197 . . . . . . . . 1 1 . 1 . 049 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 83.0 mt-30 -86.46 -38.01 17.73 Favored 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 123.887 0.875 . . . . 0.0 110.856 175.524 . . . . . . . . 1 1 . 1 . 049 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 79.6 mt -56.64 -36.66 69.76 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-N 119.315 0.961 . . . . 0.0 111.893 170.821 . . . . . . . . 1 1 . 1 . 049 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 30.1 tt0 -57.11 -25.76 59.35 Favored 'General case' 0 CA--C 1.547 0.84 0 N-CA-C 113.618 0.97 . . . . 0.0 113.618 177.908 . . . . . . . . 1 1 . 1 . 049 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 14.5 t-20 -65.65 -24.29 66.99 Favored 'General case' 0 CA--C 1.548 0.895 0 O-C-N 120.947 -1.095 . . . . 0.0 113.319 176.018 . . . . . . . . 1 1 . 1 . 049 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 89.7 m-85 -95.91 -0.32 51.02 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 126.001 1.72 . . . . 0.0 113.369 -177.268 . . . . . . . . 1 1 . 1 . 049 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 60.1 m . . . . . 0 CA--C 1.544 0.723 0 C-N-CA 124.147 0.979 . . . . 0.0 113.127 170.073 . . . . . . . . 0 0 . 1 . 049 nuclear build core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 1.7 p-10 . . . . . 0 CA--C 1.536 0.41 0 CA-C-O 120.649 0.261 . . . . 0.0 111.697 . . . . . . . . . 0 0 . 1 . 049 nuclear build core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 38.6 mt-30 -148.96 163.19 38.22 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 123.858 0.863 . . . . 0.0 111.987 -161.69 . . . . . . . . 1 1 . 1 . 049 nuclear build core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 97.9 m-70 -82.7 131.6 35.2 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 108.914 -0.772 . . . . 0.0 108.914 156.282 . . . . . . . . 1 1 . 1 . 049 nuclear build core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 86.7 mt -145.41 129.02 17.11 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 125.263 1.425 . . . . 0.0 110.042 -178.647 . . . . . . . . 1 1 . 1 . 049 nuclear build core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 68.8 m -130.61 142.3 50.45 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 125.614 1.565 . . . . 0.0 110.099 179.744 . . . . . . . . 1 1 . 1 . 049 nuclear build core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 52.33 -121.05 12.8 Favored Glycine 0 N--CA 1.47 0.929 0 C-N-CA 124.704 1.145 . . . . 0.0 114.087 166.588 . . . . . . . . 1 1 . 1 . 049 nuclear build core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 21.5 m -59.53 -33.49 71.45 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 124.222 1.009 . . . . 0.0 112.558 -178.214 . . . . . . . . 1 1 . 1 . 049 nuclear build core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 94.7 m-70 -71.06 -39.13 72.41 Favored 'General case' 0 CA--C 1.538 0.494 0 O-C-N 121.421 -0.799 . . . . 0.0 111.441 176.768 . . . . . . . . 1 1 . 1 . 049 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 48.1 tp -66.16 -42.53 88.87 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 123.653 0.781 . . . . 0.0 111.235 173.569 . . . . . . . . 1 1 . 1 . 049 nuclear build core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 54.7 t -60.31 -45.0 97.01 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.888 0 C-N-CA 123.784 0.833 . . . . 0.0 111.471 173.714 . . . . . . . . 1 1 . 1 . 049 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -62.67 -46.92 85.95 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 123.869 0.867 . . . . 0.0 111.313 178.074 . . . . . . . . 1 1 . 1 . 049 nuclear build core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.66 -46.66 87.16 Favored 'General case' 0 CA--C 1.54 0.56 0 O-C-N 121.674 -0.641 . . . . 0.0 111.778 178.733 . . . . . . . . 1 1 . 1 . 049 nuclear build core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 49.6 tp -59.6 -49.29 78.33 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 123.94 0.896 . . . . 0.0 111.091 177.526 . . . . . . . . 1 1 . 1 . 049 nuclear build core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 53.9 t80 -52.46 -44.91 65.85 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 123.813 0.845 . . . . 0.0 112.902 173.403 . . . . . . . . 1 1 . 1 . 049 nuclear build core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 82.3 mt -70.57 -32.49 69.91 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 123.813 0.845 . . . . 0.0 113.05 179.896 . . . . . . . . 1 1 . 1 . 049 nuclear build core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 42.2 t -69.51 -43.12 80.87 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.814 0 C-N-CA 124.264 1.026 . . . . 0.0 111.238 172.5 . . . . . . . . 1 1 . 1 . 049 nuclear build core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 64.7 m -83.23 -26.38 30.83 Favored 'General case' 0 N--CA 1.469 0.51 0 N-CA-C 114.392 1.256 . . . . 0.0 114.392 -173.987 . . . . . . . . 1 1 . 1 . 049 nuclear build core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 63.29 -134.73 42.47 Favored Glycine 0 CA--C 1.532 1.108 0 C-N-CA 124.283 0.944 . . . . 0.0 112.252 -177.912 . . . . . . . . 1 1 . 1 . 049 nuclear build core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 32.4 mm-40 -66.92 -15.21 63.52 Favored 'General case' 0 CA--C 1.545 0.762 0 N-CA-C 114.06 1.133 . . . . 0.0 114.06 -176.913 . . . . . . . . 1 1 . 1 . 049 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 86.3 mtt-85 -61.25 -41.73 97.41 Favored 'General case' 0 N--CA 1.473 0.712 0 N-CA-C 113.571 0.952 . . . . 0.0 113.571 -178.768 . . . . . . . . 1 1 . 1 . 049 nuclear build core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 79.0 -175.48 55.09 Favored Glycine 0 CA--C 1.534 1.28 0 C-N-CA 123.248 0.452 . . . . 0.0 111.997 -160.697 . . . . . . . . 1 1 . 1 . 049 nuclear build core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 33.9 p90 -160.46 165.79 30.35 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 124.662 1.185 . . . . 0.0 113.18 -166.452 . . . . . . . . 1 1 . 1 . 049 nuclear build core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 50.2 m-85 . . . . . 0 CA--C 1.542 0.635 0 C-N-CA 125.403 1.481 . . . . 0.0 113.336 -177.108 . . . . . . . . 0 0 . 1 . 050 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 85.3 t . . . . . 0 N--CA 1.479 1.009 0 CA-C-O 119.451 -0.309 . . . . 0.0 111.693 . . . . . . . . . 0 0 . 1 . 050 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 21.0 mm-40 -74.61 -46.24 39.79 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-N 118.315 0.507 . . . . 0.0 111.015 173.117 . . . . . . . . 1 1 . 1 . 050 nuclear build core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 73.4 tp60 -59.48 -44.8 92.97 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 123.662 0.785 . . . . 0.0 111.653 -178.673 . . . . . . . . 1 1 . 1 . 050 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 62.5 m -70.44 -25.92 63.42 Favored 'General case' 0 N--CA 1.466 0.366 0 N-CA-C 114.758 1.392 . . . . 0.0 114.758 179.715 . . . . . . . . 1 1 . 1 . 050 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 17.3 t -106.74 -36.61 6.65 Favored 'General case' 0 CA--C 1.541 0.611 0 N-CA-C 113.701 1.001 . . . . 0.0 113.701 -168.937 . . . . . . . . 1 1 . 1 . 050 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 46.7 p -85.43 -33.02 22.02 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 124.637 1.175 . . . . 0.0 112.055 175.51 . . . . . . . . 1 1 . 1 . 050 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 65.6 m -121.42 -161.62 0.92 Allowed 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 126.68 1.992 . . . . 0.0 109.63 171.303 . . . . . . . . 1 1 . 1 . 050 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 48.4 pt -97.06 157.9 3.26 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.518 0 O-C-N 121.203 -0.935 . . . . 0.0 111.243 168.038 . . . . . . . . 1 1 . 1 . 050 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 21.4 p -137.55 163.83 30.23 Favored 'General case' 0 N--CA 1.466 0.359 0 C-N-CA 124.235 1.014 . . . . 0.0 111.498 170.431 . . . . . . . . 1 1 . 1 . 050 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 32.2 m -104.86 149.18 25.89 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 123.932 0.893 . . . . 0.0 111.215 -177.353 . . . . . . . . 1 1 . 1 . 050 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 56.3 mt -58.71 -32.12 68.89 Favored 'General case' 0 N--CA 1.471 0.611 0 O-C-N 121.358 -0.839 . . . . 0.0 111.686 174.876 . . . . . . . . 1 1 . 1 . 050 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 72.7 t80 -62.22 -27.98 69.37 Favored 'General case' 0 CA--C 1.542 0.646 0 N-CA-C 113.817 1.043 . . . . 0.0 113.817 171.649 . . . . . . . . 1 1 . 1 . 050 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 20.9 mm100 -83.5 -34.2 25.39 Favored 'General case' 0 N--CA 1.465 0.301 0 C-N-CA 124.124 0.97 . . . . 0.0 111.088 175.911 . . . . . . . . 1 1 . 1 . 050 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 10.9 mp -56.1 -49.14 74.68 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-N 118.692 0.678 . . . . 0.0 110.385 165.961 . . . . . . . . 1 1 . 1 . 050 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 4.0 tm-20 -61.99 -39.65 92.93 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 124.898 1.279 . . . . 0.0 112.39 178.694 . . . . . . . . 1 1 . 1 . 050 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 21.6 t30 -64.93 -35.12 80.15 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 123.989 0.916 . . . . 0.0 113.239 175.605 . . . . . . . . 1 1 . 1 . 050 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -74.37 -20.86 59.92 Favored 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 114.116 1.154 . . . . 0.0 114.116 178.969 . . . . . . . . 1 1 . 1 . 050 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 77.2 m . . . . . 0 CA--C 1.54 0.596 0 N-CA-C 114.407 1.262 . . . . 0.0 114.407 178.13 . . . . . . . . 0 0 . 1 . 050 nuclear build core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.536 0.432 0 N-CA-C 112.345 0.498 . . . . 0.0 112.345 . . . . . . . . . 1 1 . 1 . 050 nuclear build core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 27.7 mm-40 -148.88 164.22 35.14 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 124.968 1.307 . . . . 0.0 111.19 -165.438 . . . . . . . . 1 1 . 1 . 050 nuclear build core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 94.7 m-70 -85.59 132.17 34.22 Favored 'General case' 0 CA--C 1.538 0.516 0 N-CA-C 108.991 -0.744 . . . . 0.0 108.991 155.407 . . . . . . . . 1 1 . 1 . 050 nuclear build core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 97.3 mt -144.55 130.6 19.44 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 125.706 1.603 . . . . 0.0 109.154 -178.216 . . . . . . . . 1 1 . 1 . 050 nuclear build core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 86.0 m -137.67 147.51 44.94 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 125.06 1.344 . . . . 0.0 110.389 -176.436 . . . . . . . . 1 1 . 1 . 050 nuclear build core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 55.66 -131.53 49.43 Favored Glycine 0 N--CA 1.472 1.052 0 C-N-CA 124.278 0.942 . . . . 0.0 113.658 166.178 . . . . . . . . 1 1 . 1 . 050 nuclear build core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 21.1 m -61.28 -31.07 70.89 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 124.603 1.161 . . . . 0.0 112.524 -178.415 . . . . . . . . 1 1 . 1 . 050 nuclear build core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 94.2 m-70 -70.09 -39.33 75.62 Favored 'General case' 0 CA--C 1.539 0.547 0 O-C-N 121.365 -0.835 . . . . 0.0 111.359 176.854 . . . . . . . . 1 1 . 1 . 050 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 51.4 tp -65.94 -44.4 85.19 Favored 'General case' 0 C--N 1.343 0.317 0 CA-C-O 118.594 -0.717 . . . . 0.0 111.043 170.964 . . . . . . . . 1 1 . 1 . 050 nuclear build core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 71.3 t -57.96 -44.94 87.8 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.102 0 CA-C-N 118.884 0.766 . . . . 0.0 111.624 176.171 . . . . . . . . 1 1 . 1 . 050 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -63.55 -47.58 80.98 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 123.702 0.801 . . . . 0.0 111.248 177.664 . . . . . . . . 1 1 . 1 . 050 nuclear build core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.71 -48.44 81.78 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 123.3 0.64 . . . . 0.0 111.409 178.524 . . . . . . . . 1 1 . 1 . 050 nuclear build core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 50.1 tp -58.49 -47.41 84.17 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 125.683 1.593 . . . . 0.0 111.622 179.24 . . . . . . . . 1 1 . 1 . 050 nuclear build core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 82.0 t80 -59.16 -42.18 90.15 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 123.948 0.899 . . . . 0.0 113.2 174.032 . . . . . . . . 1 1 . 1 . 050 nuclear build core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 89.4 mt -75.89 -33.04 59.93 Favored 'General case' 0 N--CA 1.471 0.614 0 N-CA-C 113.191 0.812 . . . . 0.0 113.191 -179.743 . . . . . . . . 1 1 . 1 . 050 nuclear build core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 23.7 t -65.38 -45.54 92.86 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.734 0 C-N-CA 124.619 1.168 . . . . 0.0 110.598 173.792 . . . . . . . . 1 1 . 1 . 050 nuclear build core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 71.5 m -90.72 -27.36 19.01 Favored 'General case' 0 N--CA 1.47 0.542 0 N-CA-C 114.349 1.241 . . . . 0.0 114.349 -172.467 . . . . . . . . 1 1 . 1 . 050 nuclear build core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . -53.31 133.68 42.14 Favored Glycine 0 CA--C 1.536 1.379 0 C-N-CA 124.193 0.902 . . . . 0.0 112.851 -171.977 . . . . . . . . 1 1 . 1 . 050 nuclear build core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -77.71 -11.48 59.88 Favored 'General case' 0 CA--C 1.551 0.996 0 C-N-CA 128.501 2.72 . . . . 0.0 115.006 10.843 . . . . . . . . 1 1 . 1 . 050 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 55.0 ttp85 -65.67 140.9 58.52 Favored 'General case' 0 N--CA 1.473 0.708 0 O-C-N 120.826 -1.171 . . . . 0.0 111.87 178.669 . . . . . . . . 1 1 . 1 . 050 nuclear build core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . -80.94 151.01 31.38 Favored Glycine 0 N--CA 1.47 0.931 0 C-N-CA 125.342 1.449 . . . . 0.0 112.648 -173.877 . . . . . . . . 1 1 . 1 . 050 nuclear build core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 45.3 p90 -105.83 166.92 10.13 Favored 'General case' 0 CA--C 1.536 0.439 0 N-CA-C 114.57 1.322 . . . . 0.0 114.57 -173.393 . . . . . . . . 1 1 . 1 . 050 nuclear build core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 45.1 t80 . . . . . 0 CA--C 1.537 0.477 0 C-N-CA 126.35 1.86 . . . . 0.0 109.206 171.553 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.563 0 N-CA-C 111.247 -0.741 . . . . 0.0 111.247 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 49.6 pt -68.92 -25.07 29.29 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.989 0 O-C-N 121.052 -1.264 . . . . 0.0 114.195 -170.317 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 44.6 t -61.47 -21.36 25.07 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.119 0 CA-C-N 119.229 0.922 . . . . 0.0 112.315 171.449 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -95.19 -52.95 3.97 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-N 119.478 1.035 . . . . 0.0 111.702 164.399 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 68.9 tp60 -64.18 -33.81 76.65 Favored 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 113.087 0.773 . . . . 0.0 113.087 -169.268 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 98.2 m -85.78 -28.17 24.72 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 119.5 1.045 . . . . 0.0 113.387 176.46 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 45.4 t -97.38 -60.1 1.65 Allowed 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 123.385 0.674 . . . . 0.0 112.65 -171.382 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 35.6 m -73.49 -41.71 62.75 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 125.748 1.619 . . . . 0.0 110.141 -179.157 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.4 t -102.49 -163.39 1.0 Allowed 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 124.045 0.938 . . . . 0.0 111.189 165.328 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 35.0 mt -108.25 145.1 15.73 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.743 0 C-N-CA 125.8 1.64 . . . . 0.0 110.499 175.916 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 10.2 p -133.32 163.83 28.45 Favored 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 112.957 0.725 . . . . 0.0 112.957 169.186 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 65.6 p -101.52 161.97 13.24 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 124.514 1.126 . . . . 0.0 113.703 176.519 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 52.5 mt -62.56 -34.37 76.81 Favored 'General case' 0 CA--C 1.539 0.532 0 O-C-N 121.308 -0.87 . . . . 0.0 111.696 171.0 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 91.2 t80 -63.61 -32.84 74.44 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 124.056 0.942 . . . . 0.0 112.748 173.356 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 91.6 mt-30 -73.62 -39.82 64.25 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-O 118.293 -0.861 . . . . 0.0 111.682 171.673 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 84.7 mt -59.82 -34.08 72.61 Favored 'General case' 0 N--CA 1.476 0.857 0 CA-C-N 119.825 1.193 . . . . 0.0 112.175 173.448 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 26.5 tt0 -60.56 -24.29 65.3 Favored 'General case' 0 CA--C 1.548 0.892 0 N-CA-C 113.326 0.861 . . . . 0.0 113.326 178.854 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 30.7 t30 -65.59 -25.65 67.5 Favored 'General case' 0 CA--C 1.546 0.799 0 O-C-N 121.046 -1.034 . . . . 0.0 113.058 173.837 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 97.0 m-85 -99.11 2.5 46.06 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 125.404 1.482 . . . . 0.0 113.899 -174.515 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 57.6 m -64.8 157.31 28.01 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 123.871 0.868 . . . . 0.0 112.768 165.358 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 25.1 t-20 . . . . . 0 C--O 1.25 1.114 0 C-N-CA 124.723 1.209 . . . . 0.0 113.079 177.765 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 31.1 p90 . . . . . 0 N--CA 1.489 1.477 0 CA-C-O 119.808 -0.139 . . . . 0.0 111.135 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 35.9 m -124.72 169.76 15.69 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.164 0 C-N-CA 125.587 1.555 . . . . 0.0 112.14 178.334 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 2.9 p-10 -142.23 145.11 33.73 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 125.698 1.599 . . . . 0.0 112.548 -179.138 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 30.2 mm-40 -153.79 168.58 25.82 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 125.084 1.354 . . . . 0.0 112.007 -168.147 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 80.0 m-70 -82.61 129.06 34.87 Favored 'General case' 0 CA--C 1.545 0.765 0 N-CA-C 109.241 -0.652 . . . . 0.0 109.241 155.289 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 79.7 mt -142.37 125.19 16.03 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 126.74 2.016 . . . . 0.0 108.977 -177.355 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 79.0 m -132.43 143.98 50.17 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 124.943 1.297 . . . . 0.0 111.392 -174.222 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 55.42 -122.52 26.77 Favored Glycine 0 N--CA 1.474 1.218 0 C-N-CA 124.923 1.249 . . . . 0.0 113.861 168.037 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 22.2 m -61.73 -33.43 74.02 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 123.747 0.819 . . . . 0.0 111.554 -179.644 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 20.9 m80 -72.69 -37.65 67.78 Favored 'General case' 0 CA--C 1.538 0.502 0 O-C-N 121.249 -0.907 . . . . 0.0 111.279 178.826 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 51.9 tp -63.12 -48.37 78.81 Favored 'General case' 0 N--CA 1.467 0.416 0 C-N-CA 124.056 0.943 . . . . 0.0 111.003 170.801 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 55.4 t -63.49 -37.74 80.38 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.87 0 C-N-CA 123.473 0.709 . . . . 0.0 111.946 178.743 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -66.5 -47.77 71.92 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 124.169 0.987 . . . . 0.0 111.839 174.207 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.69 -44.71 96.19 Favored 'General case' 0 CA--C 1.536 0.436 0 O-C-N 121.772 -0.58 . . . . 0.0 111.892 178.077 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 48.6 tp -58.55 -50.88 72.18 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 124.408 1.083 . . . . 0.0 110.858 174.932 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 50.8 t80 -56.92 -39.02 73.69 Favored 'General case' 0 CA--C 1.544 0.725 0 N-CA-C 113.286 0.847 . . . . 0.0 113.286 174.652 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 77.1 mt -71.12 -33.58 70.25 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 123.725 0.81 . . . . 0.0 112.878 177.94 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 42.5 t -68.31 -43.13 84.65 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.967 0 C-N-CA 124.067 0.947 . . . . 0.0 111.093 172.144 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 66.6 m -83.9 -29.31 27.27 Favored 'General case' 0 N--CA 1.471 0.625 0 N-CA-C 114.304 1.224 . . . . 0.0 114.304 -174.063 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 70.47 -159.23 53.63 Favored Glycine 0 CA--C 1.532 1.114 0 C-N-CA 124.653 1.12 . . . . 0.0 112.281 -170.721 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -64.1 -10.63 23.65 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 124.851 1.261 . . . . 0.0 114.185 -179.506 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 23.1 ttp85 -58.26 -31.62 67.6 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 125.287 1.435 . . . . 0.0 112.993 173.105 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 86.29 -176.65 48.59 Favored Glycine 0 CA--C 1.532 1.147 0 C-N-CA 124.412 1.006 . . . . 0.0 114.148 -179.671 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 49.5 p90 -163.91 172.67 13.65 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 124.654 1.181 . . . . 0.0 112.938 -164.091 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 91.5 t80 -150.27 112.98 4.75 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 125.417 1.487 . . . . 0.0 110.048 166.219 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 52.3 p90 -77.54 145.32 37.0 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 123.887 0.875 . . . . 0.0 112.747 176.919 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 24.0 p -93.46 142.11 24.79 Favored Pre-proline 0 C--O 1.24 0.58 0 C-N-CA 124.485 1.114 . . . . 0.0 111.379 173.574 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -74.41 -170.95 0.81 Allowed 'Trans proline' 0 C--N 1.352 0.722 0 C-N-CA 124.795 3.663 . . . . 0.0 111.911 -173.81 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 40.9 ttmt -52.73 -55.29 23.85 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 124.092 0.957 . . . . 0.0 112.141 -176.52 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 29.0 m . . . . . 0 C--O 1.251 1.18 0 C-N-CA 125.668 1.587 . . . . 0.0 110.988 175.896 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.606 0 N-CA-C 112.123 -0.391 . . . . 0.0 112.123 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 49.4 pt -59.83 -31.14 46.71 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.182 0 C-N-CA 124.158 0.983 . . . . 0.0 113.305 -173.368 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' VAL . . . . . 0.508 HG13 ' H ' ' B' ' 8' ' ' GLY . 78.3 t -59.81 -38.18 74.97 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.907 0 C-N-CA 123.153 0.581 . . . . 0.0 111.454 177.499 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -67.42 -48.57 66.92 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 118.343 0.519 . . . . 0.0 110.222 -178.886 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 22.2 tt0 -61.16 -55.84 27.64 Favored 'General case' 0 N--CA 1.466 0.357 0 C-N-CA 124.775 1.23 . . . . 0.0 111.284 -179.716 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 78.1 m -68.76 -19.76 64.34 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 114.271 1.211 . . . . 0.0 114.271 -175.129 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 17.9 t -90.44 -41.24 11.56 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 124.398 1.079 . . . . 0.0 112.893 176.946 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 1.4 t -79.61 -37.68 35.6 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 123.632 0.773 . . . . 0.0 112.413 179.15 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 10.3 t -107.63 -149.96 0.44 Allowed 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 125.907 1.683 . . . . 0.0 109.637 169.098 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 27.1 pt -123.08 149.35 26.81 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.444 0 C-N-CA 125.61 1.564 . . . . 0.0 111.481 177.092 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 58.2 m -128.18 162.86 25.96 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 125.399 1.48 . . . . 0.0 111.005 172.453 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 99.5 p -114.47 165.29 12.89 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 124.748 1.219 . . . . 0.0 112.698 -178.415 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 61.1 mt -62.0 -33.41 74.27 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 123.245 0.618 . . . . 0.0 111.756 173.522 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 88.7 t80 -67.26 -34.46 77.47 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 123.566 0.746 . . . . 0.0 113.0 172.806 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 38.9 mt-30 -72.19 -38.17 69.14 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-O 118.768 -0.634 . . . . 0.0 111.052 173.321 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 85.9 mt -60.58 -40.82 93.1 Favored 'General case' 0 CA--C 1.538 0.498 0 CA-C-N 119.128 0.877 . . . . 0.0 111.476 169.03 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 25.7 tt0 -65.45 -33.62 76.36 Favored 'General case' 0 CA--C 1.543 0.709 0 CA-C-N 118.517 0.598 . . . . 0.0 112.406 177.844 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 34.3 t30 -65.15 -22.94 66.99 Favored 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 123.755 0.822 . . . . 0.0 113.032 173.228 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 13.9 m-85 -87.41 -6.59 58.38 Favored 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 124.908 1.283 . . . . 0.0 113.636 176.069 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 70.2 m -65.76 159.18 25.74 Favored 'General case' 0 N--CA 1.473 0.71 0 O-C-N 120.914 -1.116 . . . . 0.0 113.518 177.302 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.254 1.304 0 C-N-CA 127.5 2.32 . . . . 0.0 111.808 178.973 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 87.4 m-85 . . . . . 0 N--CA 1.487 1.421 0 CA-C-O 119.735 -0.174 . . . . 0.0 111.027 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 8.2 p -69.67 139.74 19.81 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.918 0 O-C-N 121.742 -0.599 . . . . 0.0 110.785 175.07 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 7.4 m-80 -117.67 146.89 43.39 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 125.602 1.561 . . . . 0.0 111.536 177.909 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 38.3 mt-30 -145.58 158.71 43.81 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 125.565 1.546 . . . . 0.0 110.617 -173.877 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 99.5 m-70 -82.34 130.19 35.04 Favored 'General case' 0 CA--C 1.539 0.535 0 N-CA-C 108.289 -1.004 . . . . 0.0 108.289 158.305 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 85.2 mt -138.02 121.53 17.25 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 124.582 1.153 . . . . 0.0 109.732 -173.8 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 33.5 m -131.22 135.19 47.16 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.741 1.216 . . . . 0.0 110.476 -172.91 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 8' ' ' GLY . . . . . 0.508 ' H ' HG13 ' A' ' 3' ' ' VAL . . . 50.42 -120.7 8.92 Favored Glycine 0 CA--C 1.529 0.914 0 C-N-CA 125.163 1.363 . . . . 0.0 114.526 168.54 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 25.2 p -62.02 -32.52 73.02 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 124.484 1.114 . . . . 0.0 113.063 -179.686 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 94.0 m-70 -68.98 -38.62 79.45 Favored 'General case' 0 CA--C 1.538 0.519 0 O-C-N 121.172 -0.955 . . . . 0.0 111.385 175.269 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 8.7 tt -64.0 -48.98 74.25 Favored 'General case' 0 C--N 1.344 0.355 0 CA-C-O 118.875 -0.583 . . . . 0.0 110.552 171.459 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 53.9 t -59.85 -40.5 82.91 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.994 0 C-N-CA 123.234 0.614 . . . . 0.0 111.841 179.864 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -63.4 -49.9 71.96 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 123.676 0.79 . . . . 0.0 111.807 175.404 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.01 -45.98 91.23 Favored 'General case' 0 CA--C 1.539 0.523 0 O-C-N 121.79 -0.569 . . . . 0.0 111.564 178.957 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 40.4 tp -58.26 -51.53 69.4 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 125.619 1.567 . . . . 0.0 111.395 177.857 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 68.7 t80 -55.44 -42.59 74.41 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 123.762 0.825 . . . . 0.0 112.652 174.454 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 87.7 mt -73.7 -32.19 63.8 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 123.951 0.9 . . . . 0.0 113.179 -179.31 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 34.5 t -69.1 -45.25 80.17 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.885 0 C-N-CA 124.025 0.93 . . . . 0.0 110.341 171.883 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 74.0 m -77.06 -35.39 56.71 Favored 'General case' 0 N--CA 1.468 0.44 0 N-CA-C 113.385 0.883 . . . . 0.0 113.385 -175.181 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 62.58 -129.79 42.61 Favored Glycine 0 CA--C 1.532 1.094 0 C-N-CA 123.982 0.801 . . . . 0.0 111.254 -175.986 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -66.57 -14.36 62.26 Favored 'General case' 0 CA--C 1.546 0.802 0 N-CA-C 114.073 1.138 . . . . 0.0 114.073 179.344 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 84.5 mtm180 -69.09 -24.64 64.16 Favored 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 113.672 0.989 . . . . 0.0 113.672 -177.457 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 69.09 -175.48 31.86 Favored Glycine 0 N--CA 1.472 1.064 0 C-N-CA 124.027 0.822 . . . . 0.0 112.446 -170.697 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 44.2 p90 -154.11 157.66 39.26 Favored 'General case' 0 CA--C 1.539 0.545 0 N-CA-C 115.187 1.551 . . . . 0.0 115.187 -174.367 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 91.6 t80 -91.98 147.44 22.96 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 126.476 1.911 . . . . 0.0 109.981 161.514 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 26.2 t80 -156.53 141.11 16.85 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 124.523 1.129 . . . . 0.0 112.105 -173.075 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 15.9 p -141.32 122.68 8.97 Favored Pre-proline 0 CA--C 1.54 0.582 0 C-N-CA 125.31 1.444 . . . . 0.0 111.489 178.567 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -83.83 -163.09 0.19 Allowed 'Trans proline' 0 CA--C 1.546 1.087 0 C-N-CA 124.328 3.352 . . . . 0.0 110.455 169.986 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 24.9 ttmm -66.14 -30.86 71.43 Favored 'General case' 0 CA--C 1.549 0.941 0 O-C-N 121.32 -0.862 . . . . 0.0 113.264 170.365 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 8.7 m . . . . . 0 C--O 1.253 1.279 0 C-N-CA 126.608 1.963 . . . . 0.0 112.937 -176.714 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.617 0 N-CA-C 112.36 -0.296 . . . . 0.0 112.36 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 41.0 pt -64.37 -24.67 36.2 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.127 0 O-C-N 121.103 -1.234 . . . . 0.0 113.45 -177.83 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 70.5 t -58.82 -30.04 41.69 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.016 0 C-N-CA 123.774 0.829 . . . . 0.0 111.781 171.222 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -83.18 -50.23 8.66 Favored 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 123.779 0.832 . . . . 0.0 110.898 171.357 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 31.7 tt0 -64.7 -45.93 84.53 Favored 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 123.6 0.76 . . . . 0.0 112.298 -169.386 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 11.6 m -67.36 -17.89 64.93 Favored 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 113.501 0.926 . . . . 0.0 113.501 175.983 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 28.1 t -95.21 -42.56 8.5 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 124.396 1.078 . . . . 0.0 112.293 -176.506 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 54.3 p -87.2 -33.21 19.42 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 126.002 1.721 . . . . 0.0 112.571 -178.823 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 7.8 t -109.79 -170.25 1.62 Allowed 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 124.805 1.242 . . . . 0.0 110.103 165.797 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 11.8 tt -101.76 147.04 9.01 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.629 0 C-N-CA 125.28 1.432 . . . . 0.0 110.093 173.614 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 16.7 p -140.61 157.91 44.76 Favored 'General case' 0 N--CA 1.474 0.772 0 N-CA-C 112.974 0.731 . . . . 0.0 112.974 176.985 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 83.8 p -104.29 157.57 17.05 Favored 'General case' 0 N--CA 1.469 0.492 0 N-CA-C 114.361 1.245 . . . . 0.0 114.361 -173.916 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 62.5 mt -58.26 -32.53 68.46 Favored 'General case' 0 N--CA 1.47 0.526 0 O-C-N 121.633 -0.667 . . . . 0.0 111.675 173.203 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 84.6 t80 -66.21 -29.68 70.0 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 124.379 1.072 . . . . 0.0 113.685 172.754 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 89.0 mt-30 -81.23 -32.25 33.49 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 124.08 0.952 . . . . 0.0 111.07 174.636 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 8.4 mp -62.88 -42.67 99.85 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 123.437 0.695 . . . . 0.0 111.491 167.75 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 29.4 tt0 -62.64 -25.02 67.91 Favored 'General case' 0 CA--C 1.545 0.766 0 N-CA-C 113.532 0.938 . . . . 0.0 113.532 -177.357 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 24.8 t30 -55.03 -27.51 45.05 Favored 'General case' 0 CA--C 1.547 0.827 0 C-N-CA 124.281 1.032 . . . . 0.0 113.22 173.805 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 97.8 m-85 -97.58 0.87 48.14 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 125.443 1.497 . . . . 0.0 114.487 -176.458 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 65.2 m -66.61 154.69 39.85 Favored 'General case' 0 N--CA 1.474 0.726 0 O-C-N 121.369 -0.832 . . . . 0.0 112.818 174.261 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 20.8 t-20 . . . . . 0 C--O 1.25 1.115 0 C-N-CA 125.747 1.619 . . . . 0.0 112.77 -177.876 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 2.8 p90 . . . . . 0 N--CA 1.485 1.324 0 N-CA-C 111.285 0.106 . . . . 0.0 111.285 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 95.7 t -87.29 145.93 6.94 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.076 0 C-N-CA 125.278 1.431 . . . . 0.0 109.748 176.867 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 52.3 p-10 -131.04 148.68 52.78 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 125.437 1.495 . . . . 0.0 112.975 172.856 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 41.3 mt-30 -151.05 161.34 42.91 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 125.532 1.533 . . . . 0.0 110.845 -167.018 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 98.4 m-70 -89.85 128.72 36.23 Favored 'General case' 0 CA--C 1.54 0.57 0 N-CA-C 109.297 -0.631 . . . . 0.0 109.297 159.691 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 90.8 mt -141.1 126.6 18.82 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 125.246 1.418 . . . . 0.0 109.577 -172.653 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 39.9 m -128.65 135.9 49.93 Favored 'General case' 0 N--CA 1.466 0.334 0 C-N-CA 124.516 1.126 . . . . 0.0 110.967 -175.218 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 49.68 -117.02 4.19 Favored Glycine 0 CA--C 1.529 0.916 0 C-N-CA 125.415 1.484 . . . . 0.0 113.694 168.365 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 22.3 m -59.56 -32.92 70.79 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 124.609 1.164 . . . . 0.0 112.931 -179.389 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 94.0 m-70 -72.26 -37.64 69.04 Favored 'General case' 0 CA--C 1.539 0.547 0 O-C-N 121.23 -0.919 . . . . 0.0 111.423 177.129 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 59.8 tp -67.11 -43.12 83.26 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 123.155 0.582 . . . . 0.0 110.99 171.981 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 40.4 t -60.17 -42.76 91.32 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.907 0 C-N-CA 124.335 1.054 . . . . 0.0 111.915 175.589 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -63.42 -47.31 82.5 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 123.65 0.78 . . . . 0.0 111.337 173.717 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.6 -42.83 99.42 Favored 'General case' 0 CA--C 1.541 0.606 0 O-C-N 121.303 -0.873 . . . . 0.0 112.446 178.439 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 28.7 mt -57.75 -50.56 72.83 Favored 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 124.124 0.969 . . . . 0.0 110.931 174.453 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 80.5 t80 -55.94 -41.16 74.21 Favored 'General case' 0 CA--C 1.541 0.632 0 N-CA-C 112.997 0.74 . . . . 0.0 112.997 175.007 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 88.2 mt -73.8 -35.97 64.97 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 123.834 0.854 . . . . 0.0 113.234 179.73 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 26.1 t -66.96 -44.29 88.67 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.948 0 C-N-CA 124.687 1.195 . . . . 0.0 110.542 173.84 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 71.0 m -77.62 -32.15 53.3 Favored 'General case' 0 CA--C 1.537 0.449 0 N-CA-C 112.803 0.668 . . . . 0.0 112.803 -176.235 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 68.62 -113.88 5.57 Favored Glycine 0 CA--C 1.529 0.926 0 C-N-CA 124.406 1.003 . . . . 0.0 111.814 173.055 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 37.6 mm-40 -71.09 -21.55 62.21 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 123.853 0.861 . . . . 0.0 112.711 174.882 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 83.6 mtm180 -75.18 155.49 36.86 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 124.923 1.289 . . . . 0.0 111.215 174.534 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . -74.89 179.63 44.37 Favored Glycine 0 CA--C 1.53 1.017 0 C-N-CA 124.246 0.927 . . . . 0.0 111.253 168.087 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 32.2 p90 -154.42 171.24 19.65 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 124.416 1.086 . . . . 0.0 112.61 -177.255 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 76.9 t80 -155.63 152.07 28.26 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 125.348 1.459 . . . . 0.0 111.582 178.59 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 36.5 p90 -139.24 140.07 37.61 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 126.243 1.817 . . . . 0.0 111.997 176.926 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 18.3 p -90.73 122.32 67.1 Favored Pre-proline 0 C--O 1.24 0.58 0 C-N-CA 124.234 1.014 . . . . 0.0 109.97 171.002 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_endo -82.34 -174.33 2.06 Favored 'Trans proline' 0 CA--C 1.539 0.74 0 C-N-CA 124.157 3.238 . . . . 0.0 111.386 179.728 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 50.6 tttp -75.44 -21.44 58.15 Favored 'General case' 0 CA--C 1.548 0.885 0 N-CA-C 113.233 0.827 . . . . 0.0 113.233 168.952 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 9.5 m . . . . . 0 C--O 1.254 1.308 0 C-N-CA 126.945 2.098 . . . . 0.0 112.915 -176.971 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.653 0 N-CA-C 111.901 -0.479 . . . . 0.0 111.901 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 2.6 pp -66.3 -28.24 42.96 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.249 0 N-CA-C 113.887 1.069 . . . . 0.0 113.887 -169.45 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 54.8 t -65.48 -45.84 91.64 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.066 0 CA-C-N 118.754 0.707 . . . . 0.0 110.782 171.352 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -62.77 -43.99 97.35 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 118.705 0.684 . . . . 0.0 110.572 178.925 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 16.9 tt0 -56.78 -55.68 31.24 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 123.961 0.904 . . . . 0.0 111.25 175.44 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -80.03 -16.92 54.08 Favored 'General case' 0 CA--C 1.541 0.608 0 N-CA-C 114.558 1.318 . . . . 0.0 114.558 -172.209 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 38.4 t -99.33 -50.47 4.11 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 124.127 0.971 . . . . 0.0 112.513 -176.817 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 29.8 m -78.99 -39.83 33.16 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 124.611 1.164 . . . . 0.0 110.726 -178.059 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 10.5 t -104.24 -154.54 0.51 Allowed 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 124.236 1.014 . . . . 0.0 109.908 159.419 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 29.8 pt -112.4 161.47 11.17 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.651 0 C-N-CA 126.117 1.767 . . . . 0.0 111.595 175.953 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 1.6 p -147.08 169.34 19.46 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 123.457 0.703 . . . . 0.0 112.477 165.015 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 70.5 m -112.32 154.19 26.07 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 124.048 0.939 . . . . 0.0 112.956 -170.104 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 62.2 mt -59.09 -29.95 67.73 Favored 'General case' 0 N--CA 1.468 0.456 0 O-C-N 121.197 -0.94 . . . . 0.0 112.189 176.757 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 79.2 t80 -67.48 -26.37 66.33 Favored 'General case' 0 CA--C 1.545 0.77 0 N-CA-C 113.889 1.07 . . . . 0.0 113.889 171.97 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 59.9 mt-30 -77.85 -40.43 40.23 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 123.517 0.727 . . . . 0.0 109.655 171.719 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 9.2 mp -57.47 -39.93 77.45 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 118.401 0.546 . . . . 0.0 111.459 169.571 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -64.7 -37.35 87.31 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 124.307 1.043 . . . . 0.0 112.34 175.854 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 21.8 t30 -66.76 -27.63 67.75 Favored 'General case' 0 CA--C 1.545 0.762 0 O-C-N 121.213 -0.929 . . . . 0.0 112.732 172.721 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 18.9 m-85 -85.31 -4.02 59.02 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 125.14 1.376 . . . . 0.0 113.638 177.699 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 79.2 m -62.94 147.39 50.57 Favored 'General case' 0 CA--C 1.541 0.619 0 O-C-N 120.8 -1.188 . . . . 0.0 112.718 172.596 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 33.6 t30 . . . . . 0 C--O 1.251 1.145 0 C-N-CA 125.437 1.495 . . . . 0.0 112.329 177.525 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 52.6 m-85 . . . . . 0 N--CA 1.487 1.423 0 CA-C-O 119.528 -0.272 . . . . 0.0 110.98 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 99.0 t -79.91 129.95 36.77 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.941 0 CA-C-N 118.962 0.801 . . . . 0.0 109.239 174.278 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 5.4 p-10 -118.97 145.36 45.87 Favored 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 125.975 1.71 . . . . 0.0 111.618 177.387 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 38.9 mt-30 -149.25 163.63 37.1 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 124.429 1.091 . . . . 0.0 111.045 -171.625 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 96.0 m-70 -88.49 126.38 35.22 Favored 'General case' 0 CA--C 1.542 0.641 0 N-CA-C 107.991 -1.114 . . . . 0.0 107.991 154.411 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 85.1 mt -136.64 129.21 30.38 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 125.383 1.473 . . . . 0.0 109.008 -179.979 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 60.2 m -131.67 137.09 48.17 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 124.434 1.094 . . . . 0.0 110.788 -173.614 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 49.37 -120.23 7.21 Favored Glycine 0 N--CA 1.47 0.935 0 C-N-CA 125.06 1.315 . . . . 0.0 113.897 169.648 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 26.9 m -59.28 -31.3 68.99 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 124.81 1.244 . . . . 0.0 112.668 -178.167 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 96.8 m-70 -73.35 -35.96 66.07 Favored 'General case' 0 CA--C 1.541 0.603 0 O-C-N 121.317 -0.864 . . . . 0.0 111.561 177.697 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 32.9 tp -70.3 -40.8 74.04 Favored 'General case' 0 CA--C 1.536 0.44 0 O-C-N 121.667 -0.646 . . . . 0.0 111.392 171.237 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 56.1 t -58.61 -43.48 87.46 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.159 0 C-N-CA 123.569 0.748 . . . . 0.0 111.546 173.093 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -64.41 -45.92 85.48 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 123.703 0.801 . . . . 0.0 111.572 175.194 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.06 -44.31 96.95 Favored 'General case' 0 CA--C 1.541 0.606 0 O-C-N 121.592 -0.693 . . . . 0.0 112.141 178.438 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 34.5 mt -58.51 -48.13 81.82 Favored 'General case' 0 N--CA 1.464 0.253 0 C-N-CA 124.264 1.025 . . . . 0.0 110.876 174.257 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 90.7 t80 -57.63 -38.9 75.78 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-N 118.821 0.737 . . . . 0.0 112.495 175.465 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 84.6 mt -75.78 -36.75 59.71 Favored 'General case' 0 CA--C 1.538 0.483 0 N-CA-C 113.405 0.891 . . . . 0.0 113.405 179.573 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 55.2 t -70.74 -40.4 76.8 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.007 0 C-N-CA 123.695 0.798 . . . . 0.0 110.954 175.796 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 63.3 m -92.95 -23.81 18.6 Favored 'General case' 0 N--CA 1.471 0.604 0 N-CA-C 114.465 1.283 . . . . 0.0 114.465 -172.911 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 63.15 -142.26 47.25 Favored Glycine 0 CA--C 1.531 1.087 0 C-N-CA 124.118 0.866 . . . . 0.0 112.365 -175.829 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -63.52 -12.9 35.97 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 125.626 1.57 . . . . 0.0 114.46 -177.459 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 75.2 mtp180 -59.57 -38.81 82.13 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 124.28 1.032 . . . . 0.0 113.128 178.752 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 82.1 -179.62 53.19 Favored Glycine 0 CA--C 1.536 1.358 0 C-N-CA 124.484 1.04 . . . . 0.0 112.193 -161.994 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 34.9 p90 -157.74 157.92 34.33 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 124.339 1.056 . . . . 0.0 113.653 -169.945 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 81.5 t80 -79.49 144.61 33.83 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 126.084 1.754 . . . . 0.0 110.84 166.187 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 71.4 t80 -158.07 146.09 18.63 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 125.831 1.653 . . . . 0.0 111.039 -179.726 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 10.0 t -160.95 134.47 4.86 Favored Pre-proline 0 N--CA 1.474 0.746 0 C-N-CA 124.794 1.237 . . . . 0.0 111.584 175.045 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 91.5 Cg_endo -76.78 -26.37 8.24 Favored 'Trans proline' 0 C--N 1.353 0.798 0 C-N-CA 123.576 2.85 . . . . 0.0 113.177 -179.968 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 40.0 tttp -166.35 141.11 4.4 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 124.748 1.219 . . . . 0.0 112.364 -174.539 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 40.2 p . . . . . 0 C--O 1.252 1.222 0 C-N-CA 126.07 1.748 . . . . 0.0 112.802 176.153 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.634 0 N-CA-C 111.639 -0.584 . . . . 0.0 111.639 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 11.2 tp -66.74 -38.34 81.34 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.0 0 CA-C-N 118.758 1.279 . . . . 0.0 112.824 -170.112 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 60.0 t -69.05 -38.5 78.39 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.823 0 CA-C-N 118.561 0.619 . . . . 0.0 111.05 -174.746 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 35.7 mm-40 -71.94 -44.75 63.09 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-O 118.684 -0.674 . . . . 0.0 111.041 173.281 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 5.5 tt0 -59.43 -53.6 56.33 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 119.253 0.933 . . . . 0.0 111.281 -178.914 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 57.2 m -60.17 -27.6 67.24 Favored 'General case' 0 CA--C 1.535 0.395 0 N-CA-C 113.793 1.035 . . . . 0.0 113.793 -177.571 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 24.9 t -102.37 -41.0 6.48 Favored 'General case' 0 CA--C 1.538 0.508 0 N-CA-C 113.622 0.971 . . . . 0.0 113.622 -170.772 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 59.4 p -84.62 -25.55 28.49 Favored 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 124.166 0.986 . . . . 0.0 112.683 176.989 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 79.8 p -126.06 -139.54 0.27 Allowed 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 125.669 1.588 . . . . 0.0 109.194 166.369 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 38.4 pt -123.46 161.4 25.56 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.524 0 C-N-CA 125.017 1.327 . . . . 0.0 110.844 177.184 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 29.0 p -141.54 156.04 45.74 Favored 'General case' 0 C--O 1.237 0.422 0 C-N-CA 123.354 0.662 . . . . 0.0 112.67 172.421 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 58.5 p -96.42 160.55 14.35 Favored 'General case' 0 N--CA 1.467 0.377 0 N-CA-C 113.343 0.868 . . . . 0.0 113.343 -176.314 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 65.7 mt -61.76 -33.38 73.96 Favored 'General case' 0 CA--C 1.539 0.522 0 O-C-N 121.366 -0.834 . . . . 0.0 111.843 173.066 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 89.5 t80 -66.68 -32.12 73.22 Favored 'General case' 0 CA--C 1.543 0.702 0 N-CA-C 113.066 0.765 . . . . 0.0 113.066 172.665 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 80.4 mt-30 -73.12 -37.76 66.55 Favored 'General case' 0 N--CA 1.466 0.352 0 O-C-N 121.442 -0.786 . . . . 0.0 111.186 171.671 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 46.5 mt -60.4 -40.01 89.4 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 119.413 1.006 . . . . 0.0 111.227 169.824 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -63.98 -40.12 95.68 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 124.285 1.034 . . . . 0.0 112.316 176.16 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 18.5 t30 -60.98 -28.57 69.1 Favored 'General case' 0 CA--C 1.548 0.873 0 O-C-N 121.226 -0.921 . . . . 0.0 112.797 174.538 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 22.4 m-85 -92.38 4.15 53.99 Favored 'General case' 0 CA--C 1.547 0.827 0 C-N-CA 125.063 1.345 . . . . 0.0 114.316 177.438 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 83.4 m -68.76 155.28 40.44 Favored 'General case' 0 N--CA 1.471 0.617 0 O-C-N 120.737 -1.227 . . . . 0.0 112.526 166.327 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 95.7 m-20 . . . . . 0 C--O 1.25 1.111 0 C-N-CA 124.133 0.973 . . . . 0.0 112.079 170.503 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 78.1 m-85 . . . . . 0 N--CA 1.487 1.423 0 N-CA-C 111.237 0.088 . . . . 0.0 111.237 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 2.0 t 62.75 27.55 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.535 0 C-N-CA 125.889 1.675 . . . . 0.0 113.018 171.72 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 12.7 m-80 -142.34 149.34 39.32 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 126.9 2.08 . . . . 0.0 111.638 -175.566 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 41.0 mt-30 -147.15 160.35 42.54 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 124.834 1.254 . . . . 0.0 111.283 -178.528 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 92.8 m-70 -79.97 130.1 35.01 Favored 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 108.399 -0.963 . . . . 0.0 108.399 153.139 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 88.4 mt -143.36 126.21 16.17 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 125.213 1.405 . . . . 0.0 109.661 -176.892 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 66.4 m -135.41 144.15 46.36 Favored 'General case' 0 N--CA 1.468 0.428 0 C-N-CA 125.337 1.455 . . . . 0.0 110.35 -178.034 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 55.4 -124.55 33.59 Favored Glycine 0 N--CA 1.473 1.102 0 C-N-CA 124.495 1.045 . . . . 0.0 113.953 165.843 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 22.5 p -59.02 -37.12 76.19 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 124.765 1.226 . . . . 0.0 112.755 179.064 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 26.3 m80 -67.36 -38.77 85.31 Favored 'General case' 0 CA--C 1.54 0.576 0 O-C-N 121.171 -0.956 . . . . 0.0 111.577 177.219 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 51.5 tp -68.92 -43.24 75.54 Favored 'General case' 0 N--CA 1.465 0.325 0 O-C-N 121.667 -0.646 . . . . 0.0 111.388 173.387 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 6.4 t -56.88 -43.74 80.86 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.908 0 C-N-CA 124.463 1.105 . . . . 0.0 111.393 174.369 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 30.2 mm-40 -66.75 -44.56 81.15 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 124.1 0.96 . . . . 0.0 111.979 175.169 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -63.43 -45.1 92.49 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-N 118.969 0.804 . . . . 0.0 112.32 179.652 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 40.8 mt -57.44 -52.33 65.83 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 124.145 0.978 . . . . 0.0 110.408 172.058 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 87.9 t80 -55.8 -38.76 70.38 Favored 'General case' 0 CA--C 1.546 0.813 0 CA-C-N 119.321 0.964 . . . . 0.0 113.268 176.989 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 74.2 mt -72.2 -36.14 69.11 Favored 'General case' 0 N--CA 1.47 0.545 0 N-CA-C 113.224 0.824 . . . . 0.0 113.224 178.085 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 58.3 t -74.01 -38.73 49.93 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.133 0 C-N-CA 123.365 0.666 . . . . 0.0 111.53 175.307 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 60.8 m -90.34 -22.75 21.37 Favored 'General case' 0 N--CA 1.473 0.689 0 N-CA-C 114.666 1.358 . . . . 0.0 114.666 -172.906 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 65.99 -145.2 47.65 Favored Glycine 0 CA--C 1.532 1.129 0 C-N-CA 124.171 0.891 . . . . 0.0 112.202 -173.66 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -67.21 -12.37 59.88 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 124.602 1.161 . . . . 0.0 114.044 -178.642 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 76.2 mtp85 -63.85 -33.87 76.67 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 124.17 0.988 . . . . 0.0 113.235 178.832 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 77.01 -170.42 55.13 Favored Glycine 0 CA--C 1.531 1.033 0 C-N-CA 124.476 1.036 . . . . 0.0 113.096 -170.747 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 45.9 p90 -154.66 170.66 21.02 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 125.079 1.352 . . . . 0.0 112.729 -169.109 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 43.3 p90 -117.93 157.98 25.72 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 125.263 1.425 . . . . 0.0 111.042 169.011 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 49.4 t80 -146.78 63.42 1.19 Allowed 'General case' 0 N--CA 1.475 0.808 0 CA-C-O 121.958 0.885 . . . . 0.0 111.781 -148.478 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 49.1 p -72.35 133.24 83.32 Favored Pre-proline 0 N--CA 1.475 0.82 0 C-N-CA 124.377 1.071 . . . . 0.0 112.356 -172.681 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_endo -79.6 -124.74 0.01 OUTLIER 'Trans proline' 0 C--N 1.355 0.892 0 C-N-CA 125.239 3.96 . . . . 0.0 109.343 176.152 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 19.9 ttpp -71.67 137.87 48.17 Favored 'General case' 0 CA--C 1.545 0.754 0 O-C-N 120.918 -1.114 . . . . 0.0 111.276 173.589 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 26.4 m . . . . . 0 C--O 1.253 1.243 0 C-N-CA 125.203 1.401 . . . . 0.0 111.452 171.494 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.463 0 N-CA-C 112.276 -0.329 . . . . 0.0 112.276 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 46.4 pt -89.11 -31.25 5.38 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.115 0 N-CA-C 113.842 1.053 . . . . 0.0 113.842 -176.594 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 38.3 t -59.04 -38.24 72.73 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.067 0 CA-C-N 119.409 1.004 . . . . 0.0 111.793 -176.401 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -68.72 -8.65 44.71 Favored 'General case' 0 CA--C 1.545 0.764 0 N-CA-C 114.5 1.296 . . . . 0.0 114.5 178.379 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 71.5 tp60 -101.46 -55.74 2.46 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 124.191 0.996 . . . . 0.0 110.101 168.695 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 72.5 m -68.66 -28.69 67.1 Favored 'General case' 0 N--CA 1.468 0.436 0 N-CA-C 115.084 1.513 . . . . 0.0 115.084 -171.483 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 22.1 t -90.34 -45.2 9.18 Favored 'General case' 0 N--CA 1.476 0.839 0 N-CA-C 112.989 0.737 . . . . 0.0 112.989 -167.055 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 18.2 p -89.07 -53.97 4.33 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 126.001 1.721 . . . . 0.0 110.986 -177.785 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.9 t -87.69 -160.6 0.63 Allowed 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 124.65 1.18 . . . . 0.0 110.535 164.523 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 2.1 pp -105.03 167.81 2.79 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.535 0 C-N-CA 124.728 1.211 . . . . 0.0 111.98 175.494 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 20.5 p -147.99 160.09 43.2 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 123.71 0.804 . . . . 0.0 112.198 166.576 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 12.5 m -106.57 154.57 20.7 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 124.419 1.088 . . . . 0.0 111.988 -171.488 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 30.4 mt -61.32 -33.45 73.63 Favored 'General case' 0 N--CA 1.47 0.531 0 O-C-N 121.346 -0.846 . . . . 0.0 112.026 178.896 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 59.3 m-85 -60.73 -32.45 71.72 Favored 'General case' 0 CA--C 1.541 0.609 0 N-CA-C 113.565 0.95 . . . . 0.0 113.565 171.976 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 21.3 mm100 -81.6 -31.79 32.34 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 124.373 1.069 . . . . 0.0 110.992 176.707 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 64.1 mt -64.85 -37.73 88.62 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-N 119.23 0.923 . . . . 0.0 111.692 169.186 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 26.7 tt0 -63.07 -27.05 69.13 Favored 'General case' 0 CA--C 1.546 0.825 0 N-CA-C 113.194 0.813 . . . . 0.0 113.194 179.245 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 25.1 t30 -58.73 -24.88 62.32 Favored 'General case' 0 CA--C 1.547 0.841 0 O-C-N 121.103 -0.998 . . . . 0.0 112.91 172.963 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 85.7 m-85 -102.7 9.36 39.23 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 126.074 1.749 . . . . 0.0 113.464 -178.726 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 69.1 m -65.19 146.92 54.34 Favored 'General case' 0 CA--C 1.539 0.551 0 O-C-N 120.916 -1.115 . . . . 0.0 111.558 164.337 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 6.0 t30 . . . . . 0 C--O 1.25 1.109 0 C-N-CA 125.663 1.585 . . . . 0.0 112.739 175.814 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 32.5 t80 . . . . . 0 N--CA 1.485 1.295 0 CA-C-O 118.73 -0.653 . . . . 0.0 110.396 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 43.9 t 85.2 127.17 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 C-N-CA 129.023 2.929 . . . . 0.0 111.01 174.198 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 7.3 p30 -141.68 139.22 32.91 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 125.417 1.487 . . . . 0.0 110.773 169.612 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 49.4 mm-40 -153.72 163.56 39.81 Favored 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 123.842 0.857 . . . . 0.0 111.882 -162.787 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 99.2 m-70 -78.86 129.28 34.39 Favored 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 109.088 -0.708 . . . . 0.0 109.088 161.823 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 79.6 mt -144.97 132.64 20.99 Favored 'General case' 0 N--CA 1.465 0.294 0 C-N-CA 125.743 1.617 . . . . 0.0 109.079 -174.674 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 2.7 t -153.16 152.96 31.84 Favored 'General case' 0 N--CA 1.467 0.382 0 O-C-N 121.488 -0.757 . . . . 0.0 111.893 -176.898 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 49.69 -126.05 19.89 Favored Glycine 0 N--CA 1.47 0.954 0 C-N-CA 124.794 1.188 . . . . 0.0 113.596 177.751 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 15.1 m -60.28 -31.53 70.32 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 124.765 1.226 . . . . 0.0 112.761 -179.637 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 98.2 m-70 -73.87 -35.53 64.74 Favored 'General case' 0 CA--C 1.539 0.537 0 O-C-N 120.994 -1.066 . . . . 0.0 111.667 178.18 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 33.9 tp -68.81 -43.26 75.96 Favored 'General case' 0 N--CA 1.467 0.405 0 O-C-N 121.485 -0.759 . . . . 0.0 110.753 171.844 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 50.6 t -58.54 -41.38 81.76 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.018 0 C-N-CA 123.81 0.844 . . . . 0.0 111.595 173.249 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -66.26 -44.4 83.73 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 123.885 0.874 . . . . 0.0 112.295 175.336 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.66 -44.72 96.42 Favored 'General case' 0 CA--C 1.54 0.578 0 O-C-N 121.614 -0.679 . . . . 0.0 112.088 177.171 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 30.3 mt -56.16 -50.89 69.88 Favored 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 124.204 1.002 . . . . 0.0 111.169 172.177 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 67.5 t80 -56.24 -40.53 74.28 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 113.081 0.771 . . . . 0.0 113.081 176.017 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 89.7 mt -76.99 -33.5 57.58 Favored 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 113.546 0.943 . . . . 0.0 113.546 -179.408 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 38.7 t -69.95 -44.74 78.34 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.879 0 C-N-CA 124.189 0.995 . . . . 0.0 110.828 173.033 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 76.2 m -85.25 -33.18 22.24 Favored 'General case' 0 N--CA 1.466 0.371 0 N-CA-C 113.4 0.889 . . . . 0.0 113.4 -172.76 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 64.44 -135.25 39.06 Favored Glycine 0 CA--C 1.531 1.071 0 C-N-CA 124.229 0.919 . . . . 0.0 111.659 -177.928 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 30.0 tt0 -64.5 -16.81 63.16 Favored 'General case' 0 CA--C 1.549 0.906 0 C-N-CA 124.9 1.28 . . . . 0.0 113.503 -179.511 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 82.6 mtm180 -61.06 -32.51 72.15 Favored 'General case' 0 N--CA 1.473 0.69 0 N-CA-C 113.642 0.979 . . . . 0.0 113.642 179.965 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 85.39 173.36 49.64 Favored Glycine 0 CA--C 1.533 1.175 0 C-N-CA 124.748 1.166 . . . . 0.0 112.21 -169.388 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 51.1 p90 -159.0 166.81 30.92 Favored 'General case' 0 N--CA 1.47 0.545 0 N-CA-C 113.886 1.069 . . . . 0.0 113.886 -170.432 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 31.3 m-85 -121.93 153.53 38.35 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 127.078 2.151 . . . . 0.0 110.711 178.467 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 41.1 t80 -143.33 138.38 29.45 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.406 1.482 . . . . 0.0 110.906 -177.423 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 21.2 p -141.75 128.71 11.43 Favored Pre-proline 0 N--CA 1.475 0.819 0 C-N-CA 124.85 1.26 . . . . 0.0 112.11 -178.689 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 75.4 Cg_exo -59.27 -163.02 0.02 OUTLIER 'Trans proline' 0 CA--C 1.541 0.845 1 C-N-CA 125.324 4.016 . . . . 0.0 114.458 168.422 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 65.3 pttt -70.4 12.02 0.28 Allowed 'General case' 0 CA--C 1.556 1.191 0 N-CA-C 114.644 1.35 . . . . 0.0 114.644 170.112 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 10.8 p . . . . . 0 C--O 1.25 1.129 0 C-N-CA 127.367 2.267 . . . . 0.0 113.729 -179.708 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.552 0 N-CA-C 111.101 -0.799 . . . . 0.0 111.101 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 13.1 tt -55.07 -22.96 12.12 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.367 0 N-CA-C 115.876 1.806 . . . . 0.0 115.876 -160.594 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 4.5 t -51.1 -36.44 16.22 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.059 0 C-N-CA 124.923 1.289 . . . . 0.0 112.252 172.465 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -74.3 -11.05 60.16 Favored 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 113.856 1.058 . . . . 0.0 113.856 -179.69 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 60.5 tp60 -98.74 -53.61 3.25 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 123.811 0.844 . . . . 0.0 109.8 166.268 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 32.9 m -61.37 -33.54 73.82 Favored 'General case' 0 N--CA 1.466 0.333 0 N-CA-C 114.542 1.312 . . . . 0.0 114.542 -171.242 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 23.6 t -91.98 -41.92 10.29 Favored 'General case' 0 CA--C 1.537 0.448 0 O-C-N 121.955 -0.465 . . . . 0.0 111.681 -176.632 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 21.4 m -69.27 -34.77 75.26 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 126.409 1.884 . . . . 0.0 112.532 179.942 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 11.6 t -145.14 -162.56 1.53 Allowed 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 125.525 1.53 . . . . 0.0 110.593 -178.287 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 82.1 mt -80.76 135.93 24.24 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.614 0 O-C-N 120.691 -1.255 . . . . 0.0 109.958 172.38 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 21.0 p -119.13 157.2 28.37 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-O 121.718 0.77 . . . . 0.0 111.255 161.641 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 62.2 m -102.97 153.9 19.76 Favored 'General case' 0 N--CA 1.466 0.36 0 C-N-CA 123.659 0.784 . . . . 0.0 112.726 -173.86 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 57.1 mt -59.96 -32.73 71.08 Favored 'General case' 0 N--CA 1.467 0.416 0 O-C-N 121.388 -0.82 . . . . 0.0 112.034 178.995 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 84.6 m-85 -67.55 -29.08 68.37 Favored 'General case' 0 CA--C 1.54 0.594 0 N-CA-C 113.909 1.077 . . . . 0.0 113.909 172.962 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 92.6 mt-30 -75.87 -39.87 55.64 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 123.707 0.803 . . . . 0.0 110.292 172.829 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 94.2 mt -58.54 -41.31 85.24 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-N 118.454 0.57 . . . . 0.0 110.964 170.127 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -65.28 -40.48 93.91 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 124.575 1.15 . . . . 0.0 112.174 177.27 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 35.1 t30 -63.72 -23.88 67.55 Favored 'General case' 0 CA--C 1.548 0.903 0 O-C-N 121.246 -0.909 . . . . 0.0 112.69 172.949 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -90.05 3.95 51.74 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 125.587 1.555 . . . . 0.0 114.658 175.976 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 83.1 m -71.53 151.09 44.18 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 123.533 0.733 . . . . 0.0 112.807 169.718 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 18.7 t-20 . . . . . 0 C--O 1.249 1.055 0 C-N-CA 127.046 2.138 . . . . 0.0 109.4 169.394 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 60.9 t80 . . . . . 0 N--CA 1.488 1.446 0 CA-C-O 119.877 -0.106 . . . . 0.0 111.054 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 34.0 m -69.76 151.69 9.59 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.064 0 C-N-CA 124.588 1.155 . . . . 0.0 112.637 -177.974 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 15.2 m-20 72.63 123.76 0.04 OUTLIER 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 128.062 2.545 . . . . 0.0 111.983 177.146 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 68.4 mm-40 -152.19 166.87 30.38 Favored 'General case' 0 N--CA 1.471 0.604 0 O-C-N 121.232 -0.918 . . . . 0.0 113.068 -158.462 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 17.5 m-70 -78.6 133.46 37.29 Favored 'General case' 0 CA--C 1.544 0.741 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 154.915 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 77.7 mt -145.83 127.39 15.11 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 126.743 2.017 . . . . 0.0 109.137 -176.009 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 84.2 m -132.74 147.41 52.32 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 124.629 1.172 . . . . 0.0 110.696 -177.683 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 55.39 -128.26 43.93 Favored Glycine 0 N--CA 1.469 0.876 0 C-N-CA 124.832 1.206 . . . . 0.0 113.965 165.474 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 14.3 m -58.42 -34.22 70.54 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 124.395 1.078 . . . . 0.0 112.641 179.916 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 79.2 m-70 -77.44 -27.06 52.04 Favored 'General case' 0 CA--C 1.54 0.562 0 O-C-N 121.292 -0.88 . . . . 0.0 112.918 177.566 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 38.9 tp -71.85 -43.4 65.57 Favored 'General case' 0 N--CA 1.47 0.567 0 O-C-N 121.135 -0.978 . . . . 0.0 111.124 167.386 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 42.1 t -57.8 -41.64 80.19 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.992 0 C-N-CA 123.556 0.743 . . . . 0.0 111.603 172.971 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 44.2 tt0 -62.33 -49.32 76.07 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 125.395 1.478 . . . . 0.0 111.822 173.324 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -63.46 -45.19 91.96 Favored 'General case' 0 CA--C 1.541 0.606 0 O-C-N 121.681 -0.637 . . . . 0.0 112.391 -179.269 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 52.0 mt -54.45 -56.37 19.4 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 124.135 0.974 . . . . 0.0 110.392 171.95 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 74.0 t80 -52.9 -41.38 64.34 Favored 'General case' 0 CA--C 1.542 0.669 0 N-CA-C 113.371 0.878 . . . . 0.0 113.371 177.38 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 86.3 mt -73.46 -34.53 65.43 Favored 'General case' 0 CA--C 1.537 0.479 0 N-CA-C 113.884 1.068 . . . . 0.0 113.884 179.569 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 54.2 t -72.25 -39.97 64.94 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.049 0 CA-C-N 118.7 0.682 . . . . 0.0 110.834 173.417 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 73.4 m -79.85 -28.68 40.03 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 124.38 1.072 . . . . 0.0 113.72 -176.089 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 65.1 -111.43 4.18 Favored Glycine 0 CA--C 1.528 0.899 0 C-N-CA 124.472 1.035 . . . . 0.0 112.082 175.504 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -71.93 -21.0 61.67 Favored 'General case' 0 CA--C 1.544 0.73 0 N-CA-C 113.82 1.045 . . . . 0.0 113.82 175.101 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 84.6 mtp180 -78.63 157.79 28.59 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 124.752 1.221 . . . . 0.0 111.272 175.449 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . -81.83 -167.23 38.85 Favored Glycine 0 CA--C 1.529 0.921 0 C-N-CA 124.092 0.853 . . . . 0.0 111.778 170.676 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 43.7 p90 -156.64 152.17 26.82 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 125.384 1.474 . . . . 0.0 112.162 178.067 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 58.9 m-85 -91.59 -28.24 17.65 Favored 'General case' 0 CA--C 1.543 0.698 0 N-CA-C 114.313 1.227 . . . . 0.0 114.313 -172.414 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 57.8 t80 54.58 -96.47 0.06 Allowed 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 125.601 1.56 . . . . 0.0 113.122 179.215 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 88.3 m 63.88 90.13 0.09 OUTLIER Pre-proline 0 N--CA 1.483 1.191 0 C-N-CA 127.621 2.368 . . . . 0.0 113.072 169.446 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 93.8 Cg_endo -74.28 179.79 5.49 Favored 'Trans proline' 0 CA--C 1.54 0.8 0 C-N-CA 123.454 2.769 . . . . 0.0 110.971 164.909 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 28.9 mtpp -79.0 -5.73 54.6 Favored 'General case' 0 CA--C 1.548 0.901 0 N-CA-C 115.134 1.531 . . . . 0.0 115.134 -174.496 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 32.4 p . . . . . 0 C--O 1.252 1.237 0 C-N-CA 125.406 1.482 . . . . 0.0 113.724 -176.612 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.771 0 N-CA-C 111.419 -0.673 . . . . 0.0 111.419 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 10.1 tp -61.11 -36.76 74.77 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.959 0 N-CA-C 114.096 1.147 . . . . 0.0 114.096 -166.94 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 61.4 t -69.46 -33.93 59.62 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.07 0 CA-C-N 119.472 1.033 . . . . 0.0 111.562 -178.981 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -72.49 -45.49 59.19 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 118.499 0.591 . . . . 0.0 110.311 173.404 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 70.6 tp60 -59.88 -47.76 84.43 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 123.127 0.571 . . . . 0.0 111.745 178.979 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 73.1 m -72.0 -30.86 65.67 Favored 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 114.794 1.405 . . . . 0.0 114.794 -177.778 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 22.3 t -103.46 -41.77 5.89 Favored 'General case' 0 N--CA 1.47 0.574 0 N-CA-C 113.711 1.004 . . . . 0.0 113.711 -169.638 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 33.8 m -81.93 -38.01 25.9 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 124.127 0.971 . . . . 0.0 110.911 177.591 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 11.0 t -111.35 -152.58 0.5 Allowed 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 125.055 1.342 . . . . 0.0 110.422 166.073 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 45.3 pt -108.81 158.43 8.64 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.543 0 C-N-CA 125.474 1.51 . . . . 0.0 111.104 170.388 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 21.1 p -137.86 156.09 48.28 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 123.791 0.836 . . . . 0.0 112.588 171.233 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 59.7 p -93.56 165.41 12.75 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 124.456 1.103 . . . . 0.0 112.979 173.942 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 72.7 mt -63.61 -34.05 76.96 Favored 'General case' 0 CA--C 1.537 0.454 0 O-C-N 121.369 -0.832 . . . . 0.0 111.798 171.976 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 91.4 t80 -64.07 -34.97 79.24 Favored 'General case' 0 CA--C 1.544 0.721 0 O-C-N 121.598 -0.689 . . . . 0.0 112.687 171.893 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 91.4 mt-30 -73.77 -32.91 64.04 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-O 118.537 -0.744 . . . . 0.0 112.218 174.022 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 92.4 mt -57.96 -48.84 78.75 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-N 119.612 1.096 . . . . 0.0 110.283 165.989 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 29.3 tt0 -63.75 -30.83 71.88 Favored 'General case' 0 CA--C 1.544 0.74 0 N-CA-C 113.338 0.866 . . . . 0.0 113.338 179.904 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 18.0 t30 -60.29 -27.76 67.55 Favored 'General case' 0 CA--C 1.544 0.74 0 O-C-N 121.131 -0.981 . . . . 0.0 113.231 178.346 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 40.8 m-85 -93.96 8.04 42.83 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 125.604 1.561 . . . . 0.0 113.223 176.071 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 56.2 m -106.16 175.84 5.37 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 125.51 1.524 . . . . 0.0 112.619 174.713 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.254 1.314 0 C-N-CA 123.8 0.84 . . . . 0.0 111.792 171.93 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 45.1 t80 . . . . . 0 N--CA 1.49 1.533 0 CA-C-O 119.442 -0.313 . . . . 0.0 110.8 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 37.9 t 78.81 127.3 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.481 1.083 0 C-N-CA 128.482 2.713 . . . . 0.0 111.162 178.591 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -147.64 130.18 15.87 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 125.227 1.411 . . . . 0.0 111.394 171.097 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 21.5 mm100 -146.28 163.94 33.92 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 124.542 1.137 . . . . 0.0 111.244 -159.81 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 96.7 m-70 -80.79 131.75 35.44 Favored 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 108.885 -0.783 . . . . 0.0 108.885 157.743 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 77.0 mt -144.37 128.58 17.73 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 125.878 1.671 . . . . 0.0 108.895 -178.937 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 85.4 m -137.08 148.0 46.45 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 125.067 1.347 . . . . 0.0 110.569 -177.614 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 56.03 -128.54 45.78 Favored Glycine 0 CA--C 1.531 1.047 0 C-N-CA 124.762 1.172 . . . . 0.0 114.245 165.095 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 25.5 p -56.54 -42.78 79.08 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 124.524 1.129 . . . . 0.0 112.599 179.935 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 73.4 m-70 -70.57 -29.61 66.1 Favored 'General case' 0 CA--C 1.541 0.616 0 O-C-N 121.142 -0.974 . . . . 0.0 113.304 176.473 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 55.0 tp -67.7 -47.14 70.25 Favored 'General case' 0 N--CA 1.469 0.507 0 O-C-N 121.299 -0.876 . . . . 0.0 111.215 169.265 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 76.4 t -60.25 -39.62 81.26 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.016 0 C-N-CA 123.248 0.619 . . . . 0.0 111.211 175.931 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 44.3 tt0 -62.02 -50.06 73.57 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 125.464 1.506 . . . . 0.0 111.594 174.759 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -63.94 -45.36 89.53 Favored 'General case' 0 N--CA 1.469 0.501 0 O-C-N 121.628 -0.67 . . . . 0.0 112.066 178.985 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 33.5 tp -60.12 -44.56 94.78 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 124.722 1.209 . . . . 0.0 111.234 177.133 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 74.4 t80 -61.65 -37.36 83.72 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 124.126 0.97 . . . . 0.0 113.011 171.359 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 65.5 mt -71.11 -28.38 64.26 Favored 'General case' 0 N--CA 1.471 0.602 0 O-C-N 120.754 -1.216 . . . . 0.0 113.1 177.396 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 96.7 t -80.6 -39.74 18.7 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.152 0 C-N-CA 123.703 0.801 . . . . 0.0 111.478 173.283 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 72.6 m -124.06 -1.02 8.31 Favored 'General case' 0 N--CA 1.479 0.987 0 N-CA-C 116.281 1.956 . . . . 0.0 116.281 -162.216 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . -63.0 -22.15 64.45 Favored Glycine 0 N--CA 1.476 1.308 0 CA-C-N 119.707 1.14 . . . . 0.0 115.837 -165.167 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 35.2 mm-40 -74.47 -23.91 58.96 Favored 'General case' 0 CA--C 1.547 0.837 0 CA-C-N 118.416 1.108 . . . . 0.0 112.897 172.574 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 74.3 mtt180 -102.48 -39.36 7.16 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 125.857 1.663 . . . . 0.0 113.132 -177.503 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 99.97 148.49 22.72 Favored Glycine 0 CA--C 1.534 1.278 0 C-N-CA 125.775 1.655 . . . . 0.0 112.159 -166.694 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 39.8 p90 -133.49 167.88 19.64 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 125.288 1.435 . . . . 0.0 113.238 -175.053 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 98.1 m-85 -124.37 144.81 49.82 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 125.89 1.676 . . . . 0.0 110.713 173.734 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 59.9 t80 -133.7 123.26 24.66 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 125.146 1.379 . . . . 0.0 110.806 -169.018 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 8.8 t -167.64 143.77 3.42 Favored Pre-proline 0 N--CA 1.48 1.047 0 C-N-CA 125.322 1.449 . . . . 0.0 112.099 -175.052 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 87.0 Cg_endo -79.18 -29.37 3.21 Favored 'Trans proline' 0 C--N 1.348 0.53 0 C-N-CA 122.905 2.404 . . . . 0.0 112.21 167.705 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 40.8 pttt 164.21 148.32 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 129.793 3.237 . . . . 0.0 111.191 -172.251 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 17.5 p . . . . . 0 C--O 1.255 1.391 0 C-N-CA 125.874 1.67 . . . . 0.0 113.858 178.845 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 1.321 0 N-CA-C 110.655 -0.978 . . . . 0.0 110.655 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 14.5 tt -104.38 4.52 10.51 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.492 0 C-N-CA 130.119 3.368 . . . . 0.0 113.644 6.834 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 27.2 t -51.49 -44.09 32.45 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.166 0 C-N-CA 125.57 1.548 . . . . 0.0 112.449 -172.552 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 3.5 pm0 -72.15 -5.17 33.65 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 125.37 1.468 . . . . 0.0 113.957 -177.789 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 57.1 tp60 -104.18 -53.93 2.64 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 124.508 1.123 . . . . 0.0 110.076 165.849 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 1.8 t -81.12 -17.73 48.9 Favored 'General case' 0 N--CA 1.469 0.477 0 N-CA-C 114.67 1.359 . . . . 0.0 114.67 -165.457 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 27.4 t -87.93 -37.48 16.39 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 123.231 0.612 . . . . 0.0 112.139 -179.947 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 16.7 p -88.94 -52.65 4.98 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 126.71 2.004 . . . . 0.0 111.363 -178.916 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 14.2 t -102.37 -149.91 0.4 Allowed 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 125.778 1.631 . . . . 0.0 109.889 168.044 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 48.0 pt -113.12 160.89 12.44 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.659 0 C-N-CA 125.165 1.386 . . . . 0.0 111.882 178.995 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 15.5 p -139.48 163.2 33.15 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 123.99 0.916 . . . . 0.0 112.108 164.358 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 6.9 t -108.25 162.02 14.47 Favored 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 124.214 1.006 . . . . 0.0 112.925 179.852 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 6.7 mp -61.69 -32.3 72.49 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 124.412 1.085 . . . . 0.0 110.783 176.542 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 86.1 m-85 -65.3 -25.85 67.81 Favored 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 113.45 0.907 . . . . 0.0 113.45 173.932 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 75.2 mt-30 -82.32 -38.79 23.77 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 124.408 1.083 . . . . 0.0 110.921 172.887 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 85.3 mt -59.75 -38.07 80.72 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 119.257 0.935 . . . . 0.0 111.364 170.349 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 -64.95 -21.47 66.84 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 124.778 1.231 . . . . 0.0 113.022 173.184 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 21.9 t30 -82.91 -28.47 29.93 Favored 'General case' 0 CA--C 1.547 0.843 0 O-C-N 121.06 -1.025 . . . . 0.0 112.995 172.419 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 23.5 m-85 -78.36 -23.31 46.98 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 124.133 0.973 . . . . 0.0 113.198 171.234 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 14.0 t -62.0 145.82 51.94 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 124.537 1.135 . . . . 0.0 111.434 160.529 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.251 1.136 0 N-CA-C 113.019 0.748 . . . . 0.0 113.019 172.103 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 81.0 m-85 . . . . . 0 N--CA 1.489 1.475 0 CA-C-O 119.734 -0.174 . . . . 0.0 111.195 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 25.6 m -144.03 164.46 14.43 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.087 0 C-N-CA 125.448 1.499 . . . . 0.0 111.604 179.552 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -65.48 141.77 58.38 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 124.596 1.159 . . . . 0.0 112.228 169.23 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 39.9 mt-30 -145.42 161.52 39.48 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 123.747 0.819 . . . . 0.0 111.769 -163.43 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 97.8 m-70 -81.29 130.57 35.09 Favored 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 108.45 -0.944 . . . . 0.0 108.45 157.235 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 89.8 mt -147.37 138.42 23.69 Favored 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 125.133 1.373 . . . . 0.0 108.501 -177.604 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 3.6 t -149.64 154.85 39.27 Favored 'General case' 0 C--O 1.236 0.351 0 O-C-N 121.575 -0.703 . . . . 0.0 112.25 -178.462 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 54.11 -129.81 43.23 Favored Glycine 0 CA--C 1.53 0.986 0 C-N-CA 125.711 1.624 . . . . 0.0 113.668 174.334 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 33.4 p -57.75 -40.19 79.13 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 124.41 1.084 . . . . 0.0 112.821 -179.621 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 73.7 m-70 -71.57 -28.99 64.22 Favored 'General case' 0 CA--C 1.54 0.585 0 O-C-N 120.951 -1.093 . . . . 0.0 113.108 178.308 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 45.7 tp -70.22 -44.73 67.98 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 119.037 0.835 . . . . 0.0 111.449 169.9 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 76.3 t -62.55 -37.99 80.29 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.056 0 C-N-CA 122.961 0.504 . . . . 0.0 111.558 174.932 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -62.37 -51.0 69.33 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 125.593 1.557 . . . . 0.0 111.149 173.95 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.88 -45.44 93.76 Favored 'General case' 0 CA--C 1.542 0.635 0 O-C-N 121.809 -0.557 . . . . 0.0 111.74 179.264 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 31.0 tp -59.44 -47.48 85.31 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 124.835 1.254 . . . . 0.0 111.228 176.762 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 56.2 t80 -58.24 -43.04 87.62 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 123.978 0.911 . . . . 0.0 113.109 172.304 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 77.1 mt -70.65 -34.45 72.05 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 113.154 0.798 . . . . 0.0 113.154 -179.502 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 41.2 t -70.27 -43.27 78.69 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.011 0 C-N-CA 123.787 0.835 . . . . 0.0 111.146 172.099 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 44.6 t -81.0 -30.23 35.01 Favored 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 114.394 1.257 . . . . 0.0 114.394 -173.157 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 67.93 -147.1 47.52 Favored Glycine 0 CA--C 1.533 1.173 0 C-N-CA 124.604 1.097 . . . . 0.0 112.348 -172.992 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -69.7 -13.57 62.36 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 124.879 1.271 . . . . 0.0 113.616 -177.744 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 40.6 mtp85 -59.05 -37.24 76.54 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 124.773 1.229 . . . . 0.0 113.948 -173.67 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 90.98 150.4 24.87 Favored Glycine 0 CA--C 1.536 1.365 0 C-N-CA 124.94 1.257 . . . . 0.0 113.515 -176.141 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 35.2 p90 -137.46 159.94 40.53 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 125.086 1.354 . . . . 0.0 112.605 -171.448 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 69.5 t80 -88.66 145.99 25.34 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 124.811 1.245 . . . . 0.0 110.125 165.791 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 70.6 t80 -161.66 127.69 3.71 Favored 'General case' 0 C--O 1.239 0.55 0 C-N-CA 124.806 1.242 . . . . 0.0 111.845 179.775 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 27.9 p -144.35 146.11 31.75 Favored Pre-proline 0 N--CA 1.471 0.613 0 C-N-CA 126.183 1.793 . . . . 0.0 111.533 172.739 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 48.4 Cg_endo -79.02 178.34 7.64 Favored 'Trans proline' 0 CA--C 1.539 0.75 0 C-N-CA 123.925 3.083 . . . . 0.0 111.022 167.908 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 25.7 tptp -61.98 135.92 57.75 Favored 'General case' 0 CA--C 1.547 0.835 0 O-C-N 121.592 -0.693 . . . . 0.0 111.991 171.577 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 14.3 p . . . . . 0 C--O 1.249 1.078 0 C-N-CA 125.972 1.709 . . . . 0.0 114.326 175.981 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.451 0 N-CA-C 112.473 -0.251 . . . . 0.0 112.473 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 9.0 tp -66.5 -37.84 80.44 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 C-N-CA 123.946 0.898 . . . . 0.0 113.018 -171.258 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 98.5 t -70.3 -38.13 73.34 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.905 0 CA-C-N 119.204 0.911 . . . . 0.0 111.425 175.015 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -57.86 -46.54 84.67 Favored 'General case' 0 N--CA 1.472 0.674 0 CA-C-N 119.894 1.225 . . . . 0.0 110.398 174.546 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 8.3 tp-100 -64.2 -56.31 15.6 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 124.051 0.94 . . . . 0.0 111.04 178.96 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 4.2 t -79.62 -15.12 58.19 Favored 'General case' 0 N--CA 1.469 0.518 0 N-CA-C 114.777 1.399 . . . . 0.0 114.777 -169.027 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 14.0 t -92.99 -31.09 15.01 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 123.602 0.761 . . . . 0.0 112.606 178.347 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 56.4 p -94.44 -43.2 8.48 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 124.076 0.95 . . . . 0.0 112.144 175.856 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 60.4 m -108.64 -140.69 0.38 Allowed 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 126.203 1.801 . . . . 0.0 109.162 167.486 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 30.2 pt -127.81 163.04 32.38 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.974 0 C-N-CA 124.945 1.298 . . . . 0.0 112.508 -174.96 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 18.7 p -145.76 165.71 28.02 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 125.399 1.479 . . . . 0.0 110.88 167.297 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 95.3 p -111.56 164.1 13.35 Favored 'General case' 0 N--CA 1.467 0.416 0 C-N-CA 124.474 1.11 . . . . 0.0 112.093 177.461 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 70.7 mt -59.64 -32.49 70.49 Favored 'General case' 0 CA--C 1.537 0.447 0 O-C-N 121.576 -0.703 . . . . 0.0 111.489 170.56 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 62.2 m-85 -69.69 -29.09 66.43 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 125.21 1.404 . . . . 0.0 113.047 175.541 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 16.8 mm100 -75.6 -39.65 57.64 Favored 'General case' 0 N--CA 1.467 0.419 0 O-C-N 121.703 -0.623 . . . . 0.0 111.339 168.873 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 87.5 mt -62.15 -34.63 76.75 Favored 'General case' 0 N--CA 1.473 0.702 0 CA-C-N 119.492 1.042 . . . . 0.0 111.693 172.558 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -61.19 -30.11 70.21 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 124.199 0.999 . . . . 0.0 112.335 174.6 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 13.8 t-20 -72.7 -22.56 60.88 Favored 'General case' 0 CA--C 1.548 0.892 0 O-C-N 121.401 -0.812 . . . . 0.0 112.857 175.394 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 27.8 m-85 -85.25 -9.56 57.58 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 124.833 1.253 . . . . 0.0 113.736 173.188 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 61.3 m -65.82 149.4 50.23 Favored 'General case' 0 CA--C 1.543 0.699 0 CA-C-N 119.543 1.065 . . . . 0.0 112.409 172.186 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.253 1.238 0 C-N-CA 125.62 1.568 . . . . 0.0 112.267 178.311 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 95.9 m-85 . . . . . 0 N--CA 1.488 1.432 0 CA-C-O 119.66 -0.209 . . . . 0.0 111.097 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 12.5 p -160.94 142.18 3.67 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.982 0 C-N-CA 125.198 1.399 . . . . 0.0 110.514 176.443 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 11.4 p30 -135.54 152.22 51.09 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 125.594 1.558 . . . . 0.0 111.709 179.949 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 40.4 mt-30 -150.25 164.58 35.37 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.615 1.166 . . . . 0.0 111.09 -165.712 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 98.7 m-70 -86.78 132.54 33.82 Favored 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 108.462 -0.94 . . . . 0.0 108.462 153.527 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 89.2 mt -145.82 143.16 29.47 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 125.566 1.546 . . . . 0.0 108.767 -179.211 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 2.0 t -148.3 149.51 31.97 Favored 'General case' 0 N--CA 1.466 0.344 0 N-CA-C 112.608 0.595 . . . . 0.0 112.608 -173.185 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 44.2 -125.9 5.99 Favored Glycine 0 N--CA 1.471 1.006 0 C-N-CA 126.271 1.891 . . . . 0.0 114.349 173.641 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 19.8 m -60.13 -30.75 69.49 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 124.549 1.139 . . . . 0.0 113.021 -178.249 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 78.7 m-70 -78.63 -28.11 45.53 Favored 'General case' 0 CA--C 1.538 0.516 0 O-C-N 120.891 -1.131 . . . . 0.0 112.661 176.631 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 6.8 tt -68.21 -45.24 73.88 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 119.445 1.02 . . . . 0.0 110.644 165.884 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 73.3 t -57.56 -41.31 78.76 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.007 0 C-N-CA 123.631 0.772 . . . . 0.0 111.749 174.985 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 45.4 tt0 -61.56 -51.08 70.05 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 125.236 1.414 . . . . 0.0 111.279 174.293 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.43 -46.44 90.08 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 123.275 0.63 . . . . 0.0 111.547 179.09 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 51.5 tp -57.48 -53.52 57.19 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 126.185 1.794 . . . . 0.0 111.118 177.246 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 52.4 t80 -53.91 -43.56 69.81 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 123.656 0.783 . . . . 0.0 112.531 174.166 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 81.7 mt -70.24 -35.03 73.55 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 124.002 0.921 . . . . 0.0 113.065 179.726 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 37.1 t -65.09 -44.64 95.65 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.908 0 C-N-CA 124.369 1.068 . . . . 0.0 110.669 170.987 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 64.3 m -75.52 -28.61 59.18 Favored 'General case' 0 CA--C 1.541 0.607 0 N-CA-C 113.539 0.94 . . . . 0.0 113.539 -177.226 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 68.69 -116.5 7.43 Favored Glycine 0 CA--C 1.528 0.888 0 C-N-CA 124.646 1.117 . . . . 0.0 111.792 175.793 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 1.7 pm0 -73.21 -20.28 60.91 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 124.2 1.0 . . . . 0.0 113.474 174.196 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 76.9 mtp180 -74.32 147.27 42.42 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 124.227 1.011 . . . . 0.0 110.346 173.974 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . -76.78 -173.81 38.46 Favored Glycine 0 CA--C 1.53 1.013 0 C-N-CA 123.496 0.57 . . . . 0.0 111.937 167.607 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 42.8 p90 -149.01 153.74 38.32 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.192 0.997 . . . . 0.0 113.651 178.752 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 61.3 t80 -88.64 156.91 18.76 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 125.394 1.478 . . . . 0.0 109.645 159.699 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 65.9 t80 -157.33 144.95 18.82 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 124.022 0.929 . . . . 0.0 112.841 -171.237 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 2.2 p -137.72 119.75 10.95 Favored Pre-proline 0 N--CA 1.473 0.682 0 C-N-CA 125.699 1.599 . . . . 0.0 110.389 175.91 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 65.8 Cg_endo -79.16 -178.03 4.33 Favored 'Trans proline' 0 C--N 1.353 0.774 0 C-N-CA 124.603 3.535 . . . . 0.0 112.261 -174.742 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 52.0 tttt -69.79 -15.85 63.19 Favored 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 124.163 0.985 . . . . 0.0 113.593 178.259 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 11.5 m . . . . . 0 C--O 1.252 1.185 0 C-N-CA 127.363 2.265 . . . . 0.0 113.2 -174.404 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.192 0 N-CA-C 110.508 -1.037 . . . . 0.0 110.508 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 43.0 pt -107.74 -25.16 3.74 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.045 0 N-CA-C 113.872 1.064 . . . . 0.0 113.872 170.065 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 53.1 t -66.03 -34.48 70.52 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.036 0 C-N-CA 123.936 0.894 . . . . 0.0 112.608 -173.258 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -88.47 -43.45 11.44 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 118.568 0.622 . . . . 0.0 111.3 169.419 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 43.3 tp60 -63.91 -40.72 97.14 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 123.354 0.662 . . . . 0.0 112.725 -171.022 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 11.9 t -77.87 -13.39 59.9 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 118.953 0.797 . . . . 0.0 112.982 175.527 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 17.1 t -84.77 -40.08 17.67 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.05 0.94 . . . . 0.0 112.25 175.059 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 47.1 p -87.25 -48.41 8.04 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 124.937 1.295 . . . . 0.0 111.928 178.194 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 10.3 t -97.92 -146.89 0.31 Allowed 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 125.55 1.54 . . . . 0.0 109.996 166.753 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 31.0 pt -124.31 164.27 22.92 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.865 0 C-N-CA 125.915 1.686 . . . . 0.0 112.488 -177.522 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 19.7 p -149.26 173.33 13.6 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 125.264 1.425 . . . . 0.0 110.993 166.05 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 2.8 m -131.14 164.11 26.2 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 124.225 1.01 . . . . 0.0 111.473 -170.929 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 30.4 mt -62.33 -39.44 93.08 Favored 'General case' 0 N--CA 1.468 0.458 0 O-C-N 121.292 -0.88 . . . . 0.0 111.755 -175.521 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 20.2 p90 -65.68 -31.26 72.17 Favored 'General case' 0 N--CA 1.471 0.581 0 O-C-N 121.277 -0.889 . . . . 0.0 113.27 173.685 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 49.4 mt-30 -76.48 -31.16 57.6 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 123.475 0.71 . . . . 0.0 111.516 176.617 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 80.5 mt -66.52 -43.7 84.52 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 123.996 0.918 . . . . 0.0 111.062 168.459 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 31.8 tt0 -61.3 -23.64 65.84 Favored 'General case' 0 CA--C 1.547 0.83 0 N-CA-C 113.536 0.939 . . . . 0.0 113.536 -178.22 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 22.1 t30 -55.14 -28.43 52.68 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 124.404 1.082 . . . . 0.0 113.539 171.867 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 97.8 m-85 -93.35 5.71 50.63 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.819 1.648 . . . . 0.0 113.646 -178.404 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 68.7 m -105.51 164.35 11.95 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 125.862 1.665 . . . . 0.0 113.886 178.724 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.253 1.244 0 C-N-CA 124.744 1.218 . . . . 0.0 112.513 178.563 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 62.3 m-85 . . . . . 0 N--CA 1.487 1.386 0 CA-C-O 120.207 0.051 . . . . 0.0 110.982 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 14.6 p -150.33 144.39 17.29 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.981 0 C-N-CA 125.548 1.539 . . . . 0.0 110.649 177.914 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 5.9 p-10 -107.05 152.29 24.21 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 125.568 1.547 . . . . 0.0 112.611 177.644 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 43.2 mt-30 -148.2 165.26 31.45 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 125.45 1.5 . . . . 0.0 110.77 -177.578 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 96.1 m-70 -89.02 128.31 35.71 Favored 'General case' 0 CA--C 1.542 0.655 0 N-CA-C 108.178 -1.045 . . . . 0.0 108.178 156.236 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 74.5 mt -140.53 131.49 26.11 Favored 'General case' 0 N--CA 1.466 0.356 0 C-N-CA 124.738 1.215 . . . . 0.0 109.414 -176.884 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 57.0 m -125.94 136.82 53.46 Favored 'General case' 0 N--CA 1.467 0.4 0 C-N-CA 124.72 1.208 . . . . 0.0 110.726 -175.667 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 47.3 -118.02 3.67 Favored Glycine 0 N--CA 1.473 1.145 0 C-N-CA 125.404 1.478 . . . . 0.0 114.564 164.976 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 21.0 p -57.95 -35.9 71.78 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 124.563 1.145 . . . . 0.0 113.254 178.932 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 86.6 m-70 -76.33 -27.93 56.71 Favored 'General case' 0 CA--C 1.542 0.645 0 O-C-N 120.756 -1.215 . . . . 0.0 112.775 176.353 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 8.2 tt -67.03 -46.1 75.47 Favored 'General case' 0 N--CA 1.468 0.434 0 O-C-N 121.24 -0.912 . . . . 0.0 110.78 166.385 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 55.0 t -62.95 -36.39 75.5 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.142 0 C-N-CA 123.622 0.769 . . . . 0.0 111.638 177.543 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 44.2 tt0 -62.48 -51.03 69.07 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 125.503 1.521 . . . . 0.0 111.217 172.548 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.94 -46.42 90.77 Favored 'General case' 0 CA--C 1.539 0.542 0 O-C-N 121.777 -0.577 . . . . 0.0 111.797 177.543 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 53.8 tp -56.29 -49.25 74.78 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 125.688 1.595 . . . . 0.0 111.432 177.069 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 44.6 t80 -58.61 -42.55 88.41 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 123.628 0.771 . . . . 0.0 113.003 173.436 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 83.1 mt -74.6 -31.4 62.02 Favored 'General case' 0 N--CA 1.473 0.682 0 N-CA-C 113.208 0.818 . . . . 0.0 113.208 -177.845 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 41.4 t -67.27 -46.85 83.06 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.877 0 C-N-CA 124.333 1.053 . . . . 0.0 110.474 171.913 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 72.1 m -93.31 -24.96 17.95 Favored 'General case' 0 N--CA 1.469 0.497 0 N-CA-C 114.587 1.329 . . . . 0.0 114.587 -168.147 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 64.65 -136.46 38.87 Favored Glycine 0 CA--C 1.532 1.147 0 C-N-CA 124.478 1.037 . . . . 0.0 112.696 177.444 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -63.3 -17.47 62.56 Favored 'General case' 0 CA--C 1.544 0.728 0 N-CA-C 114.659 1.355 . . . . 0.0 114.659 -177.727 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 83.3 mtm180 -61.71 -31.52 71.68 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 124.506 1.122 . . . . 0.0 113.301 -177.952 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 79.41 166.87 33.01 Favored Glycine 0 CA--C 1.533 1.205 0 C-N-CA 124.403 1.002 . . . . 0.0 113.515 -177.03 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 47.7 p90 -152.7 165.47 35.18 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 124.584 1.154 . . . . 0.0 113.694 -168.15 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 87.4 t80 -152.94 104.82 2.87 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 125.15 1.38 . . . . 0.0 110.287 166.543 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 50.8 p90 -73.98 157.88 35.37 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 125.326 1.451 . . . . 0.0 113.149 177.493 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 34.4 m -93.0 120.33 67.12 Favored Pre-proline 0 N--CA 1.477 0.894 0 CA-C-O 118.173 -0.917 . . . . 0.0 109.382 166.921 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 79.9 Cg_endo -74.57 -170.97 0.82 Allowed 'Trans proline' 0 CA--C 1.538 0.701 0 C-N-CA 124.108 3.205 . . . . 0.0 111.45 -177.775 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 20.1 ptpt -61.73 137.02 58.21 Favored 'General case' 0 CA--C 1.548 0.866 0 O-C-N 121.544 -0.722 . . . . 0.0 112.891 175.433 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 34.8 p . . . . . 0 N--CA 1.485 1.279 0 C-N-CA 124.877 1.271 . . . . 0.0 112.928 -176.823 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.514 0 N-CA-C 111.809 -0.516 . . . . 0.0 111.809 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 43.4 pt -66.4 -24.4 33.25 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.098 0 N-CA-C 114.321 1.23 . . . . 0.0 114.321 -171.6 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 84.5 t -63.11 -32.55 56.67 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.114 0 CA-C-N 118.652 0.66 . . . . 0.0 111.539 174.371 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 44.1 tt0 -83.99 -53.7 5.38 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 118.431 0.559 . . . . 0.0 110.262 168.429 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 31.7 tt0 -64.81 -41.38 95.83 Favored 'General case' 0 CA--C 1.535 0.367 0 N-CA-C 113.275 0.842 . . . . 0.0 113.275 -165.448 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 4.5 t -85.24 -10.37 56.62 Favored 'General case' 0 N--CA 1.476 0.851 0 CA-C-N 119.907 1.231 . . . . 0.0 113.298 179.768 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 21.7 t -89.98 -34.55 15.95 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 124.863 1.265 . . . . 0.0 111.907 176.243 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 46.2 p -95.94 -45.33 6.98 Favored 'General case' 0 N--CA 1.478 0.925 0 C-N-CA 126.106 1.762 . . . . 0.0 112.518 179.151 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.6 t -104.42 -161.11 0.8 Allowed 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 125.177 1.391 . . . . 0.0 110.029 166.394 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 7.8 tt -113.45 154.06 14.9 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.903 0 C-N-CA 125.685 1.594 . . . . 0.0 111.289 -177.63 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 14.8 p -141.6 162.33 35.75 Favored 'General case' 0 N--CA 1.475 0.779 0 O-C-N 121.259 -0.9 . . . . 0.0 113.154 173.436 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 83.3 p -104.87 166.91 10.06 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 125.429 1.492 . . . . 0.0 113.1 -177.846 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 62.2 mt -63.83 -37.99 89.45 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 123.72 0.808 . . . . 0.0 111.87 174.419 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 20.8 p90 -68.4 -32.56 72.71 Favored 'General case' 0 N--CA 1.469 0.499 0 N-CA-C 113.296 0.85 . . . . 0.0 113.296 175.048 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 16.7 mm100 -70.57 -35.06 72.85 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-O 119.069 -0.491 . . . . 0.0 111.885 172.314 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 88.9 mt -66.94 -37.07 83.63 Favored 'General case' 0 N--CA 1.472 0.674 0 CA-C-N 119.15 0.886 . . . . 0.0 112.226 170.926 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -62.69 -25.6 68.24 Favored 'General case' 0 CA--C 1.543 0.694 0 N-CA-C 113.335 0.865 . . . . 0.0 113.335 -178.73 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 25.9 t30 -53.93 -28.5 37.38 Favored 'General case' 0 CA--C 1.548 0.877 0 C-N-CA 124.287 1.035 . . . . 0.0 113.347 171.74 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 98.7 m-85 -96.77 2.89 52.44 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 125.8 1.64 . . . . 0.0 114.19 -175.43 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 70.0 m -69.98 157.49 37.38 Favored 'General case' 0 CA--C 1.544 0.748 0 N-CA-C 113.418 0.895 . . . . 0.0 113.418 174.194 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.254 1.293 0 C-N-CA 126.367 1.867 . . . . 0.0 110.795 -179.72 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 79.1 m-85 . . . . . 0 N--CA 1.487 1.422 0 N-CA-C 111.373 0.138 . . . . 0.0 111.373 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 30.1 m -133.98 160.36 41.91 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.088 0 C-N-CA 126.127 1.771 . . . . 0.0 110.735 174.727 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 3.3 m120 -122.45 144.75 48.86 Favored 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 125.508 1.523 . . . . 0.0 111.654 -179.057 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 90.4 mt-30 -146.15 157.92 43.85 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 124.921 1.288 . . . . 0.0 110.569 -177.767 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 96.8 m-70 -86.26 131.08 34.31 Favored 'General case' 0 CA--C 1.541 0.615 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 162.67 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 83.5 mt -145.53 134.2 22.21 Favored 'General case' 0 N--CA 1.464 0.244 0 C-N-CA 124.899 1.28 . . . . 0.0 109.493 -168.652 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 2.0 t -151.12 153.31 34.77 Favored 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 123.857 0.863 . . . . 0.0 111.517 -176.601 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 48.14 -126.11 14.02 Favored Glycine 0 CA--C 1.532 1.116 0 C-N-CA 125.115 1.341 . . . . 0.0 113.707 176.137 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 19.4 m -60.19 -31.49 70.18 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 124.359 1.064 . . . . 0.0 112.938 -179.001 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 99.2 m-70 -74.41 -35.46 63.42 Favored 'General case' 0 CA--C 1.54 0.589 0 O-C-N 121.157 -0.964 . . . . 0.0 111.918 178.021 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 60.0 tp -67.32 -43.03 82.62 Favored 'General case' 0 N--CA 1.47 0.551 0 O-C-N 121.749 -0.594 . . . . 0.0 111.23 170.43 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 42.7 t -59.91 -42.16 88.38 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.951 0 C-N-CA 124.151 0.98 . . . . 0.0 111.583 174.448 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -64.66 -46.1 83.9 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 124.215 1.006 . . . . 0.0 111.828 174.596 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.3 -46.27 90.45 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 123.27 0.628 . . . . 0.0 112.319 177.641 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 42.3 mt -56.55 -51.95 66.63 Favored 'General case' 0 N--CA 1.466 0.34 0 C-N-CA 124.003 0.921 . . . . 0.0 111.191 173.584 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 59.1 t80 -54.25 -43.18 70.69 Favored 'General case' 0 CA--C 1.542 0.658 0 N-CA-C 112.767 0.655 . . . . 0.0 112.767 176.298 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 91.2 mt -74.05 -36.66 64.39 Favored 'General case' 0 N--CA 1.469 0.494 0 N-CA-C 113.516 0.932 . . . . 0.0 113.516 -179.664 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 33.4 t -66.65 -43.96 90.02 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.958 0 C-N-CA 124.358 1.063 . . . . 0.0 110.637 174.206 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 79.1 m -79.78 -30.61 40.71 Favored 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 113.262 0.838 . . . . 0.0 113.262 -175.291 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 69.21 -113.32 5.08 Favored Glycine 0 CA--C 1.53 0.989 0 C-N-CA 124.489 1.042 . . . . 0.0 111.836 173.041 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 39.7 mm-40 -71.54 -22.38 61.77 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 123.884 0.874 . . . . 0.0 112.819 174.882 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 84.0 mtm180 -75.27 154.25 37.54 Favored 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 124.749 1.22 . . . . 0.0 110.954 175.137 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . -77.72 -174.21 41.71 Favored Glycine 0 N--CA 1.472 1.047 0 C-N-CA 123.814 0.721 . . . . 0.0 111.692 169.321 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 55.1 p90 -157.73 165.5 35.23 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 124.835 1.254 . . . . 0.0 112.7 178.912 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 88.6 t80 -145.68 124.08 12.36 Favored 'General case' 0 N--CA 1.466 0.333 0 C-N-CA 124.867 1.267 . . . . 0.0 111.504 170.25 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 18.1 p90 -85.58 119.26 25.73 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 125.135 1.374 . . . . 0.0 111.335 175.981 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 22.3 p -78.45 129.46 74.55 Favored Pre-proline 0 N--CA 1.473 0.717 0 CA-C-O 118.378 -0.82 . . . . 0.0 110.38 177.477 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 26.7 Cg_endo -85.33 -135.41 0.02 OUTLIER 'Trans proline' 0 CA--C 1.543 0.926 0 C-N-CA 124.36 3.373 . . . . 0.0 111.032 -170.417 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 55.8 tptt -62.82 -26.72 68.88 Favored 'General case' 0 CA--C 1.55 0.947 0 C-N-CA 125.205 1.402 . . . . 0.0 113.366 175.966 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 19.4 m . . . . . 0 C--O 1.251 1.177 0 C-N-CA 127.4 2.28 . . . . 0.0 113.211 179.947 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.784 0 N-CA-C 112.261 -0.336 . . . . 0.0 112.261 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 9.4 tp -59.59 -39.57 79.8 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.069 0 N-CA-C 113.806 1.039 . . . . 0.0 113.806 -172.065 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 91.0 t -65.63 -48.56 82.15 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.986 0 CA-C-N 119.164 0.893 . . . . 0.0 109.73 -179.296 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 59.8 tt0 -55.8 -47.9 76.33 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 123.976 0.91 . . . . 0.0 111.355 174.831 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 20.6 tt0 -62.75 -48.33 79.63 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 123.01 0.524 . . . . 0.0 111.492 -179.238 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 65.9 m -63.63 -34.37 77.68 Favored 'General case' 0 N--CA 1.466 0.373 0 N-CA-C 113.766 1.024 . . . . 0.0 113.766 178.643 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 74.7 m -77.25 -38.61 50.7 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.753 0.821 . . . . 0.0 112.277 -179.013 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 78.9 p -95.97 -23.08 17.01 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 124.87 1.268 . . . . 0.0 113.74 -174.186 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.2 t -141.95 -169.3 2.89 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 125.599 1.56 . . . . 0.0 111.154 -177.844 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 38.0 mm -86.24 133.93 28.57 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.704 0 O-C-N 120.696 -1.253 . . . . 0.0 109.793 175.87 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 16.1 p -127.11 163.53 23.6 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 124.193 0.997 . . . . 0.0 112.163 170.908 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 96.5 p -108.28 158.64 17.3 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 124.259 1.024 . . . . 0.0 112.959 -177.581 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 55.6 mt -64.22 -34.18 77.51 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 123.738 0.815 . . . . 0.0 111.391 173.402 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 82.5 t80 -62.66 -35.83 80.89 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 123.756 0.823 . . . . 0.0 113.149 172.474 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 37.1 mt-30 -73.72 -32.76 64.04 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-O 118.502 -0.761 . . . . 0.0 112.121 173.775 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 81.7 mt -65.16 -40.4 94.27 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 119.594 1.088 . . . . 0.0 111.707 168.526 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -60.81 -26.93 67.66 Favored 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 113.478 0.918 . . . . 0.0 113.478 -177.1 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 18.9 t30 -55.34 -27.76 49.33 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 123.921 0.888 . . . . 0.0 113.323 172.522 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 97.0 m-85 -98.79 5.48 47.47 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 125.838 1.655 . . . . 0.0 114.251 -175.451 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 73.5 m -68.92 160.21 31.19 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 123.719 0.808 . . . . 0.0 113.09 169.936 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.252 1.224 0 C-N-CA 126.384 1.874 . . . . 0.0 110.871 -179.427 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 83.6 m-85 . . . . . 0 N--CA 1.485 1.303 0 N-CA-C 110.481 -0.192 . . . . 0.0 110.481 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 14.2 p -146.29 145.61 19.75 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.012 0 C-N-CA 129.182 2.993 . . . . 0.0 110.479 0.219 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 55.3 m-20 -80.31 139.86 36.41 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 124.539 1.136 . . . . 0.0 110.935 -178.069 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 28.9 mm-40 -149.69 167.92 25.08 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 124.1 0.96 . . . . 0.0 112.48 -165.359 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 88.1 m-70 -79.16 138.88 38.06 Favored 'General case' 0 CA--C 1.542 0.646 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 155.092 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 43.1 mt -151.17 136.17 17.42 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 124.78 1.232 . . . . 0.0 108.61 -175.617 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 2.3 t -155.41 153.97 31.21 Favored 'General case' 0 CA--C 1.534 0.328 0 O-C-N 121.549 -0.719 . . . . 0.0 112.343 -176.357 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 54.32 -130.97 45.5 Favored Glycine 0 CA--C 1.532 1.149 0 C-N-CA 125.195 1.379 . . . . 0.0 113.617 175.034 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 25.4 p -57.59 -38.0 74.15 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 124.353 1.061 . . . . 0.0 112.803 178.323 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 73.4 m-70 -71.95 -29.51 64.34 Favored 'General case' 0 CA--C 1.544 0.735 0 O-C-N 121.107 -0.995 . . . . 0.0 112.801 177.533 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 9.7 tt -66.74 -47.19 73.06 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 119.527 1.058 . . . . 0.0 110.877 168.123 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 58.3 t -61.87 -38.78 81.42 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.897 0 C-N-CA 123.239 0.616 . . . . 0.0 111.403 178.971 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -61.73 -51.86 66.62 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 125.709 1.604 . . . . 0.0 111.509 172.425 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.58 -46.16 91.07 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 123.231 0.612 . . . . 0.0 112.01 179.608 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 46.7 tp -58.19 -51.67 68.79 Favored 'General case' 0 CA--C 1.53 0.182 0 C-N-CA 124.807 1.243 . . . . 0.0 111.014 176.699 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 56.8 t80 -54.37 -42.59 70.5 Favored 'General case' 0 CA--C 1.543 0.678 0 N-CA-C 112.868 0.692 . . . . 0.0 112.868 174.262 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 83.0 mt -71.53 -34.68 70.26 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 124.093 0.957 . . . . 0.0 113.163 178.911 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 25.2 t -64.47 -44.42 96.99 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.844 0 C-N-CA 124.534 1.133 . . . . 0.0 110.419 171.277 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 79.4 m -72.61 -34.08 67.13 Favored 'General case' 0 CA--C 1.538 0.513 0 N-CA-C 113.129 0.789 . . . . 0.0 113.129 -178.651 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 69.78 -111.63 3.96 Favored Glycine 0 CA--C 1.529 0.927 0 C-N-CA 124.743 1.163 . . . . 0.0 111.797 173.619 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -70.16 -26.65 64.02 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 124.33 1.052 . . . . 0.0 112.061 174.955 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 83.6 mtm180 -72.44 154.37 40.91 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 124.886 1.274 . . . . 0.0 111.137 176.211 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . -79.86 -167.61 35.47 Favored Glycine 0 N--CA 1.471 0.977 0 C-N-CA 124.255 0.931 . . . . 0.0 111.353 167.817 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 52.9 p90 -159.53 162.85 35.53 Favored 'General case' 0 CA--C 1.538 0.506 0 N-CA-C 113.789 1.033 . . . . 0.0 113.789 179.248 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 83.1 t80 -156.94 106.31 2.23 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 125.733 1.613 . . . . 0.0 110.025 168.908 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 29.2 p90 -77.33 170.05 17.24 Favored 'General case' 0 CA--C 1.55 0.979 0 C-N-CA 125.073 1.349 . . . . 0.0 114.067 -179.331 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 63.3 m -133.91 122.36 16.4 Favored Pre-proline 0 N--CA 1.477 0.913 0 C-N-CA 125.25 1.42 . . . . 0.0 111.407 179.634 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 28.2 Cg_endo -88.53 -124.0 0.01 OUTLIER 'Trans proline' 0 CA--C 1.542 0.885 0 C-N-CA 124.916 3.744 . . . . 0.0 109.639 170.139 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 15.8 tppt? -71.0 -30.65 66.95 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 124.604 1.162 . . . . 0.0 113.391 177.483 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 33.7 m . . . . . 0 C--O 1.254 1.296 0 C-N-CA 126.265 1.826 . . . . 0.0 110.982 -172.63 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.553 0 N-CA-C 111.838 -0.505 . . . . 0.0 111.838 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 19.1 tt -59.89 -35.99 63.94 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.079 0 CA-C-O 117.909 -1.044 . . . . 0.0 113.122 -175.524 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 29.5 t -66.25 -43.84 91.56 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.043 0 CA-C-N 120.16 1.346 . . . . 0.0 110.723 179.066 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 46.6 tt0 -62.65 -47.62 82.89 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 118.623 0.647 . . . . 0.0 111.078 174.085 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 63.1 tp60 -63.26 -37.11 85.97 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 123.005 0.522 . . . . 0.0 112.095 -177.426 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 78.2 m -85.64 -29.3 24.15 Favored 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 114.607 1.336 . . . . 0.0 114.607 -179.828 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 41.7 t -98.48 -57.16 2.26 Favored 'General case' 0 N--CA 1.473 0.724 0 N-CA-C 113.272 0.841 . . . . 0.0 113.272 -166.301 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 36.5 p -88.7 -33.02 17.69 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 124.178 0.991 . . . . 0.0 111.914 179.228 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.0 t -94.13 -162.61 0.96 Allowed 'General case' 0 CA--C 1.551 0.982 0 C-N-CA 123.531 0.733 . . . . 0.0 110.935 158.396 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 12.0 tt -118.22 146.55 22.6 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.907 0 C-N-CA 125.926 1.69 . . . . 0.0 111.048 174.95 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 14.9 p -132.45 159.23 39.95 Favored 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 113.122 0.786 . . . . 0.0 113.122 177.675 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 52.6 m -99.72 154.03 18.63 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 125.315 1.446 . . . . 0.0 112.186 -179.612 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 43.9 mt -59.37 -33.13 70.81 Favored 'General case' 0 N--CA 1.472 0.653 0 O-C-N 120.86 -1.15 . . . . 0.0 112.042 173.487 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 83.2 t80 -62.41 -30.69 71.4 Favored 'General case' 0 CA--C 1.546 0.804 0 N-CA-C 113.368 0.877 . . . . 0.0 113.368 171.673 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 94.0 mt-30 -80.15 -33.95 38.08 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 123.83 0.852 . . . . 0.0 111.365 174.895 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 56.3 mt -56.93 -48.49 78.15 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 118.841 0.746 . . . . 0.0 110.397 166.444 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -66.19 -31.7 72.69 Favored 'General case' 0 CA--C 1.544 0.712 0 N-CA-C 112.853 0.686 . . . . 0.0 112.853 179.279 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 32.8 t30 -62.9 -27.25 69.24 Favored 'General case' 0 CA--C 1.55 0.973 0 O-C-N 120.965 -1.084 . . . . 0.0 113.24 176.035 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 10.9 m-85 -80.6 -4.19 53.19 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 124.697 1.199 . . . . 0.0 113.894 172.324 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 72.1 m -102.86 172.79 6.63 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 124.905 1.282 . . . . 0.0 113.738 178.286 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 24.5 t-20 . . . . . 0 C--O 1.252 1.186 0 C-N-CA 125.167 1.387 . . . . 0.0 112.969 171.146 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 87.2 m-85 . . . . . 0 N--CA 1.485 1.285 0 N-CA-C 111.489 0.181 . . . . 0.0 111.489 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 69.0 t -80.95 136.31 23.43 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.989 0 C-N-CA 127.66 2.384 . . . . 0.0 109.758 -1.311 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -143.54 139.09 29.58 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 125.283 1.433 . . . . 0.0 111.201 -179.856 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 47.9 mm-40 -149.11 155.07 40.15 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 124.293 1.037 . . . . 0.0 110.694 -161.685 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 97.7 m-70 -87.69 122.95 32.0 Favored 'General case' 0 CA--C 1.539 0.552 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 164.545 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 77.5 mt -140.71 130.83 24.81 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 125.869 1.668 . . . . 0.0 109.139 -172.086 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 64.8 m -134.17 143.16 47.74 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 125.024 1.33 . . . . 0.0 111.091 -175.374 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 55.61 -125.66 37.31 Favored Glycine 0 N--CA 1.472 1.099 0 C-N-CA 124.763 1.173 . . . . 0.0 114.427 166.225 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 24.5 p -62.57 -34.57 77.24 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 124.382 1.073 . . . . 0.0 112.607 179.34 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 24.7 m80 -68.13 -38.7 82.5 Favored 'General case' 0 CA--C 1.541 0.622 0 O-C-N 121.275 -0.89 . . . . 0.0 111.422 176.038 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 50.4 tp -63.8 -49.43 72.91 Favored 'General case' 0 N--CA 1.464 0.272 0 C-N-CA 123.469 0.708 . . . . 0.0 111.172 170.889 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 47.8 t -58.32 -39.94 76.04 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.905 0 C-N-CA 123.093 0.557 . . . . 0.0 111.83 177.938 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -64.68 -49.75 69.71 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 123.786 0.835 . . . . 0.0 111.82 175.384 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.9 -46.89 88.86 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 123.34 0.656 . . . . 0.0 111.932 179.362 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 52.4 tp -56.0 -50.71 70.11 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 126.365 1.866 . . . . 0.0 111.409 175.482 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 91.4 t80 -61.14 -40.09 92.53 Favored 'General case' 0 CA--C 1.54 0.572 0 N-CA-C 112.998 0.74 . . . . 0.0 112.998 175.093 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 79.0 mt -72.7 -36.05 67.76 Favored 'General case' 0 N--CA 1.471 0.621 0 N-CA-C 113.284 0.846 . . . . 0.0 113.284 -179.828 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 25.5 t -63.31 -45.86 97.09 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.081 0 C-N-CA 123.43 0.692 . . . . 0.0 110.45 171.408 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 69.7 m -83.6 -19.18 35.97 Favored 'General case' 0 CA--C 1.54 0.576 0 N-CA-C 114.193 1.183 . . . . 0.0 114.193 -173.685 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 76.44 -126.09 7.98 Favored Glycine 0 CA--C 1.53 1.019 0 C-N-CA 124.724 1.154 . . . . 0.0 111.574 174.146 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -72.5 -13.39 61.41 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 123.78 0.832 . . . . 0.0 113.121 175.677 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 87.7 mtm180 -71.07 159.16 35.22 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 124.645 1.178 . . . . 0.0 112.511 178.504 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . -91.76 157.72 24.64 Favored Glycine 0 CA--C 1.528 0.873 0 C-N-CA 125.631 1.586 . . . . 0.0 112.246 174.981 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 49.1 p90 -127.42 151.8 48.35 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 125.255 1.422 . . . . 0.0 112.757 -178.553 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 30.2 t80 -94.25 162.82 13.69 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 126.38 1.872 . . . . 0.0 110.267 165.413 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 38.5 t80 -158.22 126.61 5.41 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 123.754 0.821 . . . . 0.0 112.21 -168.671 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 38.0 p -143.18 133.63 12.26 Favored Pre-proline 0 N--CA 1.478 0.946 0 C-N-CA 125.549 1.54 . . . . 0.0 112.62 -172.81 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 88.5 Cg_endo -82.04 -85.34 0.0 OUTLIER 'Trans proline' 0 CA--C 1.538 0.677 0 C-N-CA 123.75 2.967 . . . . 0.0 110.546 171.523 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 57.2 tttp -157.84 139.84 14.16 Favored 'General case' 0 CA--C 1.549 0.92 0 C-N-CA 126.519 1.928 . . . . 0.0 110.555 -175.772 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 17.8 p . . . . . 0 C--O 1.251 1.168 0 C-N-CA 128.524 2.73 . . . . 0.0 112.339 -6.563 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.651 0 N-CA-C 111.286 -0.726 . . . . 0.0 111.286 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 12.4 tt -74.57 -24.48 18.57 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.987 0 N-CA-C 114.868 1.433 . . . . 0.0 114.868 -174.697 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 91.3 t -64.26 -42.21 94.76 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.922 0 CA-C-N 119.33 0.968 . . . . 0.0 110.441 -174.403 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -62.33 -44.01 97.5 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 124.855 1.262 . . . . 0.0 111.359 176.731 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 17.5 tt0 -61.96 -56.44 19.18 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.074 0.949 . . . . 0.0 110.138 177.763 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 70.3 m -56.1 -33.43 65.08 Favored 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 113.759 1.022 . . . . 0.0 113.759 -179.728 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 12.6 t -91.38 -34.84 14.71 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 124.251 1.02 . . . . 0.0 113.691 -171.77 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 43.2 p -108.43 -26.08 10.65 Favored 'General case' 0 N--CA 1.482 1.134 0 N-CA-C 114.485 1.291 . . . . 0.0 114.485 -176.149 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 95.8 p -115.41 -131.28 0.32 Allowed 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 124.43 1.092 . . . . 0.0 109.129 162.337 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 10.0 tt -135.22 149.54 28.9 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 C-N-CA 125.219 1.408 . . . . 0.0 110.46 -177.95 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 15.6 p -140.26 157.19 45.97 Favored 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 113.427 0.899 . . . . 0.0 113.427 178.062 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 22.8 t -100.16 158.8 15.59 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-O 122.254 1.026 . . . . 0.0 113.151 178.271 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 52.7 mt -63.38 -33.92 76.6 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 123.847 0.859 . . . . 0.0 110.947 170.838 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 77.2 t80 -63.06 -29.58 70.92 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 124.103 0.961 . . . . 0.0 112.962 173.481 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 98.5 mt-30 -81.55 -38.88 25.49 Favored 'General case' 0 N--CA 1.467 0.381 0 C-N-CA 123.769 0.828 . . . . 0.0 110.736 176.101 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 86.8 mt -59.23 -36.06 74.75 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-N 119.135 0.88 . . . . 0.0 111.96 170.128 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -59.57 -26.98 65.86 Favored 'General case' 0 CA--C 1.546 0.799 0 N-CA-C 113.462 0.912 . . . . 0.0 113.462 178.722 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 26.4 t30 -60.86 -24.51 65.97 Favored 'General case' 0 CA--C 1.55 0.978 0 O-C-N 120.903 -1.123 . . . . 0.0 113.119 173.654 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 84.2 m-85 -98.47 5.96 47.59 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 126.429 1.892 . . . . 0.0 113.247 -178.079 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 71.1 m -72.63 163.6 27.8 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 123.881 0.872 . . . . 0.0 112.753 166.12 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.251 1.15 0 C-N-CA 126.595 1.958 . . . . 0.0 110.712 179.228 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 86.8 m-85 . . . . . 0 N--CA 1.49 1.556 0 N-CA-C 111.217 0.081 . . . . 0.0 111.217 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 28.5 m -138.32 158.81 32.05 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.134 0 C-N-CA 125.769 1.628 . . . . 0.0 110.457 176.019 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -121.96 142.91 49.83 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 124.89 1.276 . . . . 0.0 113.417 178.086 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 38.5 mt-30 -147.4 163.04 37.73 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 124.961 1.305 . . . . 0.0 111.434 -168.427 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 98.2 m-70 -80.11 132.68 35.99 Favored 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 109.02 -0.733 . . . . 0.0 109.02 156.74 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 76.5 mt -148.21 139.13 23.14 Favored 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 125.327 1.451 . . . . 0.0 109.082 -176.464 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 2.8 t -159.14 155.7 27.7 Favored 'General case' 0 N--CA 1.468 0.474 0 O-C-N 121.587 -0.695 . . . . 0.0 111.904 -177.472 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 54.1 -135.17 44.02 Favored Glycine 0 CA--C 1.53 1.004 0 C-N-CA 124.922 1.249 . . . . 0.0 113.593 175.072 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 20.0 m -58.15 -33.02 68.73 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 124.056 0.942 . . . . 0.0 112.552 -179.712 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 76.2 m-70 -75.67 -28.76 58.83 Favored 'General case' 0 CA--C 1.543 0.688 0 O-C-N 121.102 -0.999 . . . . 0.0 112.85 178.565 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 9.3 tt -66.15 -46.52 77.19 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 119.312 0.96 . . . . 0.0 110.757 166.198 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 95.4 t -62.36 -38.93 82.45 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.766 0 C-N-CA 122.906 0.482 . . . . 0.0 111.396 179.364 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -62.13 -51.27 68.55 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 125.751 1.62 . . . . 0.0 111.691 172.234 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.04 -46.09 92.14 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 123.159 0.584 . . . . 0.0 111.913 179.151 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 58.5 tp -57.59 -53.19 60.96 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 124.66 1.184 . . . . 0.0 110.84 175.858 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 38.6 t80 -53.73 -41.42 67.05 Favored 'General case' 0 CA--C 1.543 0.693 0 N-CA-C 112.886 0.699 . . . . 0.0 112.886 175.308 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 83.2 mt -72.93 -33.08 65.72 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 124.203 1.001 . . . . 0.0 113.457 178.813 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 25.6 t -65.83 -43.91 93.07 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.922 0 C-N-CA 124.343 1.057 . . . . 0.0 110.344 170.78 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 69.5 m -73.07 -39.56 65.78 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 122.952 0.501 . . . . 0.0 112.335 -178.206 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 62.83 -104.35 0.78 Allowed Glycine 0 CA--C 1.533 1.176 0 C-N-CA 124.244 0.926 . . . . 0.0 112.059 174.006 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -77.05 -21.42 54.51 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 124.362 1.065 . . . . 0.0 113.854 175.045 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 1.4 mpp_? -73.52 154.01 40.05 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 123.528 0.731 . . . . 0.0 109.985 166.866 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . -77.4 -171.31 35.75 Favored Glycine 0 CA--C 1.534 1.267 0 C-N-CA 124.154 0.883 . . . . 0.0 111.248 166.101 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 43.8 p90 -156.53 162.96 39.9 Favored 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 113.969 1.1 . . . . 0.0 113.969 179.405 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 92.0 t80 -155.39 109.05 2.82 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 125.436 1.494 . . . . 0.0 110.412 169.584 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 31.3 p90 -79.81 155.05 28.05 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 124.776 1.23 . . . . 0.0 112.199 173.99 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 46.2 p -117.75 86.08 23.46 Favored Pre-proline 0 N--CA 1.478 0.955 0 C-N-CA 125.317 1.447 . . . . 0.0 111.328 -176.601 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 23.5 Cg_endo -91.36 -174.79 0.66 Allowed 'Trans proline' 0 CA--C 1.541 0.868 0 C-N-CA 124.373 3.382 . . . . 0.0 112.442 -177.157 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 2.4 ptpp? -159.06 161.46 36.51 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 126.227 1.811 . . . . 0.0 112.124 164.414 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 17.4 p . . . . . 0 C--O 1.253 1.267 0 C-N-CA 125.779 1.632 . . . . 0.0 113.181 177.676 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.581 0 N-CA-C 111.833 -0.507 . . . . 0.0 111.833 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 18.8 tt -61.95 -38.52 80.89 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.986 0 N-CA-C 114.432 1.271 . . . . 0.0 114.432 -167.696 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 61.5 t -68.51 -36.26 73.94 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.075 0 CA-C-N 120.004 1.274 . . . . 0.0 110.971 -176.653 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 79.5 mm-40 -72.13 -43.32 64.89 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 118.761 0.71 . . . . 0.0 111.149 171.912 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 66.3 tp60 -63.08 -36.24 82.93 Favored 'General case' 0 CA--C 1.534 0.34 0 O-C-N 121.744 -0.598 . . . . 0.0 112.135 -178.794 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 68.3 m -85.77 -29.8 23.55 Favored 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 114.575 1.324 . . . . 0.0 114.575 179.641 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 17.6 t -107.47 -41.67 5.01 Favored 'General case' 0 N--CA 1.473 0.698 0 N-CA-C 113.59 0.959 . . . . 0.0 113.59 -169.53 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 44.3 m -84.54 -46.34 11.69 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 125.013 1.325 . . . . 0.0 109.596 176.132 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 31.4 m -96.8 -162.74 0.98 Allowed 'General case' 0 CA--C 1.55 0.961 0 C-N-CA 124.643 1.177 . . . . 0.0 111.278 166.63 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 12.1 tt -111.38 148.3 14.74 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.944 0 C-N-CA 125.469 1.508 . . . . 0.0 110.154 170.996 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 14.7 p -135.5 163.12 30.81 Favored 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 113.554 0.946 . . . . 0.0 113.554 179.911 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 36.2 t -103.0 156.45 17.66 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 124.46 1.104 . . . . 0.0 112.6 177.07 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 69.0 mt -60.12 -30.0 69.0 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 123.977 0.911 . . . . 0.0 111.606 169.964 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 77.2 t80 -65.07 -27.39 68.74 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 123.997 0.919 . . . . 0.0 113.287 171.66 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 86.9 mt-30 -85.32 -33.16 22.15 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 124.061 0.944 . . . . 0.0 110.826 175.685 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 9.5 mp -56.18 -47.52 78.16 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 118.555 0.616 . . . . 0.0 110.749 165.274 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -66.35 -31.22 71.87 Favored 'General case' 0 CA--C 1.546 0.79 0 N-CA-C 112.817 0.673 . . . . 0.0 112.817 177.68 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 24.3 t30 -64.36 -26.94 68.69 Favored 'General case' 0 CA--C 1.547 0.856 0 O-C-N 120.953 -1.092 . . . . 0.0 112.902 173.934 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 10.7 m-85 -85.03 8.07 19.16 Favored 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 125.329 1.452 . . . . 0.0 114.02 171.901 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 73.3 m -112.11 168.32 9.7 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 125.153 1.381 . . . . 0.0 113.408 175.556 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 23.7 t-20 . . . . . 0 C--O 1.253 1.241 0 C-N-CA 124.875 1.27 . . . . 0.0 113.084 179.337 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 12.7 p90 . . . . . 0 N--CA 1.485 1.3 0 N-CA-C 111.359 0.133 . . . . 0.0 111.359 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 30.6 m -137.98 160.54 33.08 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.225 0 C-N-CA 125.832 1.653 . . . . 0.0 110.857 176.315 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 44.4 p-10 -113.4 147.39 37.84 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 124.842 1.257 . . . . 0.0 113.541 177.308 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 44.8 mt-30 -150.86 158.9 44.72 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 125.796 1.638 . . . . 0.0 110.953 -172.334 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 96.9 m-70 -87.52 127.78 35.24 Favored 'General case' 0 CA--C 1.54 0.59 0 N-CA-C 108.963 -0.754 . . . . 0.0 108.963 159.989 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 87.4 mt -140.62 131.41 25.84 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 125.876 1.67 . . . . 0.0 108.715 -173.476 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 71.7 m -138.07 146.23 42.7 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 124.483 1.113 . . . . 0.0 111.56 -172.861 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 55.57 -131.67 49.33 Favored Glycine 0 N--CA 1.471 0.978 0 C-N-CA 124.961 1.267 . . . . 0.0 114.208 165.262 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 22.6 m -59.13 -33.17 70.55 Favored 'General case' 0 N--CA 1.468 0.465 0 C-N-CA 124.241 1.016 . . . . 0.0 112.375 -179.543 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 75.2 m-70 -75.88 -27.8 57.89 Favored 'General case' 0 CA--C 1.542 0.639 0 O-C-N 121.065 -1.022 . . . . 0.0 112.813 176.336 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 54.9 tp -70.15 -46.79 63.98 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-N 119.104 0.865 . . . . 0.0 110.604 167.26 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 74.4 t -55.93 -43.0 73.41 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.306 0 CA-C-N 118.744 0.702 . . . . 0.0 111.43 174.675 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -60.45 -48.99 79.37 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 125.442 1.497 . . . . 0.0 111.477 173.039 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.35 -42.87 99.4 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 123.467 0.707 . . . . 0.0 112.673 179.215 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -52.71 -55.16 24.69 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-N 119.432 1.014 . . . . 0.0 110.58 172.576 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 70.6 t80 -60.21 -35.12 74.71 Favored 'General case' 0 CA--C 1.543 0.691 0 N-CA-C 113.471 0.915 . . . . 0.0 113.471 178.753 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 83.9 mt -74.93 -34.07 62.05 Favored 'General case' 0 N--CA 1.472 0.649 0 N-CA-C 113.524 0.935 . . . . 0.0 113.524 177.43 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 49.5 t -71.16 -42.89 75.58 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.918 0 C-N-CA 123.812 0.845 . . . . 0.0 110.765 174.544 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 70.2 m -102.67 -24.63 13.74 Favored 'General case' 0 N--CA 1.468 0.463 0 N-CA-C 114.771 1.397 . . . . 0.0 114.771 -165.76 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 64.59 -140.6 42.93 Favored Glycine 0 CA--C 1.534 1.231 0 C-N-CA 124.094 0.854 . . . . 0.0 112.315 -178.536 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 57.3 mp0 -65.03 -11.87 44.03 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 125.732 1.613 . . . . 0.0 114.19 -178.412 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 82.6 mtm180 -61.95 -28.79 69.79 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 124.195 0.998 . . . . 0.0 113.322 177.662 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 81.04 162.35 28.23 Favored Glycine 0 CA--C 1.532 1.155 0 C-N-CA 124.53 1.062 . . . . 0.0 112.918 -178.195 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 54.7 p90 -143.54 158.75 43.41 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 125.201 1.4 . . . . 0.0 113.48 -169.501 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 78.3 m-85 -108.0 159.37 16.61 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 126.573 1.949 . . . . 0.0 110.648 169.912 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 62.2 t80 -157.87 126.68 5.65 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 125.158 1.383 . . . . 0.0 110.682 -169.0 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 11.8 t -169.62 143.73 2.28 Favored Pre-proline 0 N--CA 1.482 1.164 0 C-N-CA 125.162 1.385 . . . . 0.0 112.679 -170.752 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 41.2 Cg_endo -81.42 -132.8 0.01 OUTLIER 'Trans proline' 0 CA--C 1.54 0.8 0 C-N-CA 125.051 3.834 . . . . 0.0 110.179 172.826 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 28.4 ttpp -60.59 119.91 9.0 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 124.294 1.038 . . . . 0.0 112.592 -174.993 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 8.2 p . . . . . 0 C--O 1.253 1.248 0 C-N-CA 126.934 2.094 . . . . 0.0 112.423 -179.403 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.467 0 N-CA-C 111.841 -0.504 . . . . 0.0 111.841 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 48.5 pt -59.97 -29.46 43.42 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.968 0 C-N-CA 124.08 0.952 . . . . 0.0 113.142 -176.91 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 56.1 t -61.55 -31.66 51.28 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.07 0 CA-C-N 118.918 0.781 . . . . 0.0 112.08 177.938 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 14.4 mm-40 -82.84 -56.25 3.93 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 118.286 0.493 . . . . 0.0 110.618 167.333 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 1.2 tm0? -60.86 -46.41 90.71 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 123.035 0.534 . . . . 0.0 112.237 -166.673 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 70.4 m -76.65 -21.41 55.49 Favored 'General case' 0 N--CA 1.467 0.398 0 N-CA-C 114.289 1.218 . . . . 0.0 114.289 -177.339 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 10.6 t -100.69 -32.3 10.8 Favored 'General case' 0 CA--C 1.541 0.598 0 N-CA-C 113.244 0.831 . . . . 0.0 113.244 -173.851 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 44.5 p -95.76 -14.63 23.16 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 125.211 1.404 . . . . 0.0 113.429 176.586 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 84.3 p -144.34 -174.49 4.32 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 125.546 1.538 . . . . 0.0 110.173 174.279 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 16.9 tt -91.38 138.05 20.54 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.817 0 O-C-N 120.614 -1.304 . . . . 0.0 110.388 178.652 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 8.7 p -132.29 159.05 40.25 Favored 'General case' 0 N--CA 1.469 0.51 0 O-C-N 121.207 -0.933 . . . . 0.0 113.014 178.547 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 36.7 m -106.96 162.32 13.94 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 124.787 1.235 . . . . 0.0 111.145 -175.852 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 24.8 mt -59.32 -33.0 70.58 Favored 'General case' 0 CA--C 1.535 0.393 0 O-C-N 121.164 -0.96 . . . . 0.0 110.934 172.108 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 89.3 t80 -60.15 -33.16 71.78 Favored 'General case' 0 CA--C 1.546 0.815 0 N-CA-C 113.821 1.045 . . . . 0.0 113.821 170.68 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 14.0 mm100 -75.18 -33.92 61.5 Favored 'General case' 0 N--CA 1.471 0.589 0 O-C-N 121.537 -0.727 . . . . 0.0 111.217 174.941 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 93.2 mt -65.85 -44.33 85.8 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-N 118.307 0.503 . . . . 0.0 111.165 170.45 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -68.67 -26.83 65.51 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 125.325 1.45 . . . . 0.0 112.94 -177.078 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 18.6 t30 -52.73 -32.65 44.18 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 124.922 1.289 . . . . 0.0 113.771 179.773 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 84.3 m-85 -96.1 0.37 51.32 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 125.112 1.365 . . . . 0.0 114.365 -177.366 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 88.8 m -91.35 167.03 12.59 Favored 'General case' 0 CA--C 1.542 0.635 0 N-CA-C 114.333 1.234 . . . . 0.0 114.333 178.941 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.252 1.204 0 C-N-CA 127.129 2.172 . . . . 0.0 110.919 -176.008 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 67.0 m-85 . . . . . 0 N--CA 1.484 1.257 0 CA-C-O 119.807 -0.139 . . . . 0.0 111.184 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 7.1 p -158.45 155.83 4.32 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.082 0 C-N-CA 125.005 1.322 . . . . 0.0 111.1 -175.982 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 44.2 p-10 -69.18 146.99 51.96 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 124.541 1.136 . . . . 0.0 112.403 172.806 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 41.4 mt-30 -148.34 162.55 39.3 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.039 0.936 . . . . 0.0 111.625 -160.535 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 95.7 m-70 -88.26 132.63 34.31 Favored 'General case' 0 CA--C 1.54 0.57 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 157.689 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 91.5 mt -144.43 132.5 21.6 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 125.347 1.459 . . . . 0.0 109.406 -174.668 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 62.6 m -139.52 151.2 45.94 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 125.159 1.384 . . . . 0.0 110.641 -175.909 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 57.78 -133.14 52.79 Favored Glycine 0 N--CA 1.473 1.112 0 C-N-CA 124.499 1.047 . . . . 0.0 114.466 165.558 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 13.5 t -59.1 -39.41 82.14 Favored 'General case' 0 N--CA 1.472 0.645 0 O-C-N 121.928 -0.748 . . . . 0.0 111.776 -179.875 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 22.1 m-70 -67.39 -29.56 69.1 Favored 'General case' 0 CA--C 1.544 0.716 0 O-C-N 120.524 -1.36 . . . . 0.0 112.62 178.285 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 55.9 tp -69.46 -40.32 77.21 Favored 'General case' 0 CA--C 1.54 0.572 0 O-C-N 121.524 -0.735 . . . . 0.0 111.508 169.753 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 85.5 t -60.87 -45.49 98.07 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.269 0 C-N-CA 123.101 0.56 . . . . 0.0 110.794 172.926 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -61.26 -48.1 82.98 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 124.039 0.936 . . . . 0.0 111.138 177.639 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.48 -47.59 84.95 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 118.499 0.59 . . . . 0.0 111.686 -179.612 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 61.6 tp -55.3 -52.67 62.71 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 124.57 1.148 . . . . 0.0 111.571 176.164 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 25.9 t80 -57.55 -42.27 82.64 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 123.733 0.813 . . . . 0.0 112.629 175.863 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 81.8 mt -74.95 -32.25 61.69 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 124.145 0.978 . . . . 0.0 113.195 -177.678 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 26.8 t -66.08 -47.42 85.0 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 C-N-CA 123.882 0.873 . . . . 0.0 110.405 171.563 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 85.7 m -84.1 -27.46 28.19 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 113.059 0.763 . . . . 0.0 113.059 -172.2 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 69.1 -118.33 8.65 Favored Glycine 0 N--CA 1.468 0.786 0 C-N-CA 124.837 1.208 . . . . 0.0 112.221 169.141 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -70.58 -19.53 62.85 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 124.38 1.072 . . . . 0.0 113.702 175.591 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 89.3 mtm180 -72.59 158.77 35.04 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 124.976 1.31 . . . . 0.0 111.524 177.433 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . -78.22 147.62 31.86 Favored Glycine 0 N--CA 1.467 0.745 0 N-CA-C 110.939 -0.864 . . . . 0.0 110.939 175.152 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 52.6 p90 -128.02 160.1 32.96 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 124.141 0.976 . . . . 0.0 113.054 179.572 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 27.6 t80 -138.46 119.56 14.51 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 124.818 1.247 . . . . 0.0 110.67 175.376 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 81.4 t80 -87.57 89.63 8.07 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 125.808 1.643 . . . . 0.0 110.255 -175.319 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 27.8 p -72.44 123.9 90.11 Favored Pre-proline 0 N--CA 1.472 0.631 0 C-N-CA 123.287 0.635 . . . . 0.0 111.662 -172.426 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 16.5 Cg_endo -86.72 -142.11 0.02 OUTLIER 'Trans proline' 0 CA--C 1.54 0.797 0 C-N-CA 124.432 3.422 . . . . 0.0 111.724 -166.574 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 71.3 mmtt -69.78 12.47 0.2 Allowed 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 128.721 2.809 . . . . 0.0 115.081 -177.033 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 14.2 p . . . . . 0 C--O 1.252 1.205 0 C-N-CA 126.216 1.807 . . . . 0.0 113.985 176.682 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.765 0 N-CA-C 111.854 -0.498 . . . . 0.0 111.854 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 10.5 tp -59.69 -31.49 47.22 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.159 0 C-N-CA 124.116 0.967 . . . . 0.0 113.118 -174.258 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 82.9 t -59.22 -45.2 93.11 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.963 0 CA-C-N 118.465 0.575 . . . . 0.0 111.422 176.308 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -70.63 -42.79 70.42 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-N 119.108 0.867 . . . . 0.0 111.15 176.02 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 71.0 tp60 -58.96 -42.83 90.84 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 123.172 0.589 . . . . 0.0 111.647 -179.62 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 97.9 m -76.1 -31.35 58.66 Favored 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 114.487 1.292 . . . . 0.0 114.487 177.707 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 30.3 t -98.06 -43.5 7.02 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 113.468 0.914 . . . . 0.0 113.468 -167.852 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 64.3 m -88.97 -38.47 14.43 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 125.216 1.406 . . . . 0.0 110.926 179.81 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 9.5 t -107.91 -155.86 0.56 Allowed 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 124.923 1.289 . . . . 0.0 110.758 167.561 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 29.8 pt -107.81 152.39 9.55 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.565 0 C-N-CA 125.715 1.606 . . . . 0.0 111.609 172.912 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 14.0 p -139.57 164.21 30.52 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 123.799 0.84 . . . . 0.0 112.276 171.997 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 32.8 t -107.23 156.65 18.62 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 124.111 0.964 . . . . 0.0 113.068 179.251 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 62.9 mt -60.21 -33.08 71.74 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 124.176 0.991 . . . . 0.0 111.081 170.051 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 79.9 t80 -61.85 -28.6 69.6 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 124.685 1.194 . . . . 0.0 113.287 172.241 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 86.1 mt-30 -82.1 -39.56 23.19 Favored 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 123.642 0.777 . . . . 0.0 110.955 174.033 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 40.5 mt -58.16 -37.52 74.86 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-N 118.905 0.775 . . . . 0.0 112.218 172.662 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -59.01 -30.81 68.27 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 124.271 1.028 . . . . 0.0 113.181 179.216 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 89.0 m-20 -66.46 -18.78 65.55 Favored 'General case' 0 CA--C 1.544 0.725 0 O-C-N 121.127 -0.983 . . . . 0.0 113.511 179.196 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 92.2 m-85 -92.93 -7.41 46.13 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.177 1.391 . . . . 0.0 113.341 177.163 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 13.7 t -72.38 154.34 40.96 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 124.835 1.254 . . . . 0.0 112.162 171.323 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 20.1 t-20 . . . . . 0 C--O 1.251 1.144 0 C-N-CA 124.562 1.145 . . . . 0.0 111.929 170.446 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 20.7 p90 . . . . . 0 N--CA 1.486 1.368 0 N-CA-C 111.346 0.128 . . . . 0.0 111.346 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 27.1 m -141.14 158.38 22.74 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.113 0 C-N-CA 125.782 1.633 . . . . 0.0 111.162 -179.582 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 11.2 p30 -108.33 149.41 28.7 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 124.857 1.263 . . . . 0.0 112.562 173.235 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 39.3 mt-30 -151.69 167.81 26.99 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.836 1.654 . . . . 0.0 111.224 -171.857 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 99.5 m-70 -87.02 133.34 33.6 Favored 'General case' 0 CA--C 1.541 0.63 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 153.312 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 85.4 mt -145.55 138.72 26.25 Favored 'General case' 0 N--CA 1.466 0.374 0 C-N-CA 126.039 1.736 . . . . 0.0 108.806 -177.812 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 3.3 t -155.79 153.88 30.51 Favored 'General case' 0 N--CA 1.47 0.53 0 O-C-N 121.373 -0.83 . . . . 0.0 112.357 -175.899 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 50.6 -127.44 26.9 Favored Glycine 0 N--CA 1.472 1.042 0 C-N-CA 125.185 1.374 . . . . 0.0 113.69 175.327 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 16.1 m -58.27 -34.75 70.85 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 124.193 0.997 . . . . 0.0 112.556 178.881 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 80.5 m-70 -76.19 -27.54 56.94 Favored 'General case' 0 CA--C 1.541 0.614 0 O-C-N 121.363 -0.836 . . . . 0.0 113.121 178.477 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 56.3 tp -69.17 -45.41 70.08 Favored 'General case' 0 N--CA 1.469 0.492 0 O-C-N 121.423 -0.798 . . . . 0.0 110.889 168.042 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 77.7 t -62.59 -37.28 78.52 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.08 0 C-N-CA 123.607 0.763 . . . . 0.0 111.467 175.715 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 43.9 tt0 -63.54 -48.55 77.02 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 125.174 1.389 . . . . 0.0 111.462 172.507 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.51 -43.54 98.57 Favored 'General case' 0 CA--C 1.54 0.593 0 O-C-N 121.563 -0.71 . . . . 0.0 112.253 178.243 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 18.4 mt -54.7 -48.69 72.15 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 124.244 1.017 . . . . 0.0 111.008 171.67 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 80.6 t80 -62.85 -37.33 86.41 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 113.201 0.815 . . . . 0.0 113.201 176.193 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 78.5 mt -72.95 -34.65 66.66 Favored 'General case' 0 N--CA 1.47 0.564 0 O-C-N 121.266 -0.896 . . . . 0.0 112.891 178.551 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 44.8 t -73.3 -41.86 57.62 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 C-N-CA 124.236 1.014 . . . . 0.0 111.299 174.935 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 44.5 t -90.05 -30.73 17.53 Favored 'General case' 0 CA--C 1.537 0.479 0 N-CA-C 113.957 1.095 . . . . 0.0 113.957 -171.995 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 71.01 -155.71 52.89 Favored Glycine 0 CA--C 1.532 1.102 0 C-N-CA 124.223 0.916 . . . . 0.0 112.078 -171.093 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -71.34 -3.77 22.44 Favored 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 124.746 1.218 . . . . 0.0 113.98 179.734 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 58.5 mtp180 -57.8 -34.09 69.26 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 124.845 1.258 . . . . 0.0 113.178 175.49 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 88.04 147.0 12.5 Favored Glycine 0 CA--C 1.531 1.061 0 C-N-CA 125.349 1.452 . . . . 0.0 112.83 178.746 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 52.2 p90 -137.87 166.66 23.49 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 125.27 1.428 . . . . 0.0 112.21 -173.234 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 88.7 t80 -146.42 103.35 3.68 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 124.661 1.184 . . . . 0.0 110.279 174.377 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 44.6 p90 -76.07 178.84 6.03 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 125.246 1.418 . . . . 0.0 112.765 176.093 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 12.2 t -136.94 128.77 16.87 Favored Pre-proline 0 N--CA 1.476 0.843 0 C-N-CA 124.287 1.035 . . . . 0.0 111.673 173.017 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 42.5 Cg_endo -84.49 -175.65 2.22 Favored 'Trans proline' 0 C--N 1.351 0.659 0 C-N-CA 123.841 3.027 . . . . 0.0 112.102 -177.801 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 80.6 tttt -72.78 -25.39 61.15 Favored 'General case' 0 CA--C 1.55 0.943 0 C-N-CA 123.827 0.851 . . . . 0.0 112.843 168.671 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 8.3 m . . . . . 0 C--O 1.253 1.241 0 C-N-CA 127.011 2.125 . . . . 0.0 113.368 -175.279 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 1.275 0 N-CA-C 110.465 -1.054 . . . . 0.0 110.465 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 10.3 tp -111.15 -30.64 2.28 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.126 0 N-CA-C 113.161 0.8 . . . . 0.0 113.161 174.076 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 86.5 t -63.47 -44.85 98.98 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.036 0 CA-C-N 119.792 1.178 . . . . 0.0 112.334 -176.459 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -73.8 -36.44 65.01 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 119.344 0.974 . . . . 0.0 111.312 175.595 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 8.0 tt0 -61.42 -36.79 81.32 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 124.317 1.047 . . . . 0.0 111.882 179.699 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 95.6 m -88.65 -27.93 20.96 Favored 'General case' 0 CA--C 1.534 0.353 0 N-CA-C 114.679 1.363 . . . . 0.0 114.679 176.807 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 20.7 t -102.04 -46.05 4.98 Favored 'General case' 0 N--CA 1.475 0.781 0 N-CA-C 113.281 0.845 . . . . 0.0 113.281 -169.456 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 22.8 m -86.24 -44.72 11.93 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 125.39 1.476 . . . . 0.0 109.829 178.636 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 69.0 m -95.26 -169.55 2.0 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 124.567 1.147 . . . . 0.0 110.739 163.251 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 32.4 pt -108.35 144.94 16.03 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.755 0 C-N-CA 124.914 1.286 . . . . 0.0 110.403 169.485 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 19.3 p -126.41 151.82 47.17 Favored 'General case' 0 N--CA 1.47 0.575 0 C-N-CA 123.744 0.818 . . . . 0.0 112.332 176.683 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 90.1 p -91.05 166.93 12.74 Favored 'General case' 0 C--N 1.323 -0.56 0 C-N-CA 124.392 1.077 . . . . 0.0 113.428 174.648 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 46.6 mt -61.65 -34.78 76.3 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 123.339 0.656 . . . . 0.0 111.505 169.74 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 59.5 m-85 -66.4 -33.92 76.8 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.599 1.159 . . . . 0.0 112.698 175.001 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 85.5 mt-30 -75.29 -35.27 61.33 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 124.323 1.049 . . . . 0.0 112.026 173.056 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 93.3 mt -61.52 -42.04 98.21 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-N 119.582 1.083 . . . . 0.0 111.049 168.19 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -60.0 -30.18 68.96 Favored 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 123.936 0.895 . . . . 0.0 112.682 179.463 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 15.9 t-20 -64.54 -22.49 66.98 Favored 'General case' 0 CA--C 1.55 0.962 0 N-CA-C 113.402 0.889 . . . . 0.0 113.402 176.486 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 61.7 m-85 -99.34 2.4 45.32 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.644 1.578 . . . . 0.0 114.126 178.905 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 37.7 m -65.74 147.89 52.65 Favored 'General case' 0 N--CA 1.474 0.73 0 O-C-N 121.144 -0.973 . . . . 0.0 111.135 163.124 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.252 1.204 0 C-N-CA 123.835 0.854 . . . . 0.0 112.764 174.327 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 77.7 m-85 . . . . . 0 N--CA 1.486 1.357 0 CA-C-O 119.885 -0.102 . . . . 0.0 110.769 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 2.0 t 61.62 36.93 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.334 0 C-N-CA 125.27 1.428 . . . . 0.0 111.943 -179.185 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 9.3 m120 -79.71 138.11 37.24 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 125.854 1.662 . . . . 0.0 111.557 178.194 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 43.5 mt-30 -145.5 159.33 43.27 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 125.212 1.405 . . . . 0.0 110.64 -174.628 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 62.4 m-70 -82.31 127.46 33.24 Favored 'General case' 0 CA--C 1.537 0.456 0 N-CA-C 108.766 -0.827 . . . . 0.0 108.766 156.359 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 93.0 mt -141.87 132.68 25.75 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 126.014 1.726 . . . . 0.0 108.092 -177.726 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 3.0 t -153.84 153.92 32.99 Favored 'General case' 0 N--CA 1.468 0.434 0 O-C-N 121.044 -1.035 . . . . 0.0 112.279 -173.91 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 55.45 -129.54 46.59 Favored Glycine 0 CA--C 1.529 0.96 0 C-N-CA 125.097 1.332 . . . . 0.0 113.331 176.676 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 20.5 p -60.96 -33.99 74.05 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 124.506 1.123 . . . . 0.0 112.734 177.718 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 26.1 m80 -68.7 -36.66 78.76 Favored 'General case' 0 CA--C 1.542 0.652 0 O-C-N 121.229 -0.919 . . . . 0.0 111.708 176.292 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 55.7 tp -67.07 -46.04 75.49 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 123.072 0.549 . . . . 0.0 111.004 171.409 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 55.1 t -58.52 -42.56 84.86 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.992 0 C-N-CA 122.959 0.503 . . . . 0.0 111.126 177.011 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -64.98 -47.81 76.24 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 124.175 0.99 . . . . 0.0 111.415 176.562 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.7 -47.5 83.36 Favored 'General case' 0 CA--C 1.54 0.568 0 O-C-N 121.42 -0.8 . . . . 0.0 111.789 -179.508 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 31.0 tp -60.87 -45.65 93.7 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 124.388 1.075 . . . . 0.0 111.019 177.778 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 83.9 t80 -56.79 -43.66 81.14 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 123.621 0.768 . . . . 0.0 112.926 172.758 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 79.7 mt -72.75 -33.41 66.35 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 123.677 0.791 . . . . 0.0 113.04 -179.619 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 41.2 t -68.14 -43.34 85.13 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.739 0 C-N-CA 123.742 0.817 . . . . 0.0 111.105 172.837 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 83.5 m -82.35 -30.27 30.46 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 113.664 0.987 . . . . 0.0 113.664 -175.407 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 62.77 -131.24 43.36 Favored Glycine 0 CA--C 1.531 1.053 0 C-N-CA 124.487 1.041 . . . . 0.0 112.176 -178.771 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 31.1 mm-40 -64.9 -18.95 65.64 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 124.929 1.292 . . . . 0.0 114.193 -176.246 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -70.52 -43.08 70.34 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 124.128 0.971 . . . . 0.0 112.763 -174.19 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 86.19 -179.44 49.58 Favored Glycine 0 CA--C 1.534 1.28 0 C-N-CA 124.359 0.98 . . . . 0.0 113.017 -168.278 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 43.4 p90 -152.65 166.31 32.5 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 125.35 1.46 . . . . 0.0 113.261 -170.032 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 47.7 t80 -114.42 108.08 16.41 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.648 1.179 . . . . 0.0 110.01 169.137 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 60.2 t80 -75.05 94.48 2.89 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 125.089 1.355 . . . . 0.0 110.979 -177.112 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 52.1 m -93.52 117.47 67.35 Favored Pre-proline 0 N--CA 1.475 0.808 0 C-N-CA 124.4 1.08 . . . . 0.0 111.139 -168.623 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 67.0 Cg_endo -75.12 -169.5 0.65 Allowed 'Trans proline' 0 C--N 1.352 0.733 0 C-N-CA 124.504 3.469 . . . . 0.0 111.759 -176.613 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 22.9 tptm -55.02 121.9 9.74 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 123.865 0.866 . . . . 0.0 111.676 171.065 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 25.5 p . . . . . 0 C--O 1.254 1.32 0 C-N-CA 124.882 1.273 . . . . 0.0 112.634 176.272 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.684 0 N-CA-C 111.684 -0.566 . . . . 0.0 111.684 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 24.7 pt -85.24 -24.07 7.07 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.374 0 CA-C-N 118.805 1.302 . . . . 0.0 114.132 -179.37 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 45.4 t -63.19 -44.84 99.53 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.032 0 C-N-CA 123.9 0.88 . . . . 0.0 111.144 -168.194 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 14.2 pm0 -69.55 -30.61 68.46 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 125.398 1.479 . . . . 0.0 112.651 176.828 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 33.5 tt0 -73.5 -45.4 54.15 Favored 'General case' 0 N--CA 1.465 0.315 0 C-N-CA 124.093 0.957 . . . . 0.0 110.422 177.25 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 67.0 m -60.01 -24.07 64.18 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 124.545 1.138 . . . . 0.0 113.326 170.835 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 9.5 t -84.78 -51.36 6.84 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 124.129 0.972 . . . . 0.0 111.095 -179.644 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 47.2 p -79.68 -23.47 42.43 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 125.531 1.532 . . . . 0.0 113.721 -175.913 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.5 t -140.37 -173.7 3.75 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 125.857 1.663 . . . . 0.0 110.818 175.008 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 39.1 pt -81.86 144.37 10.49 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.398 0 O-C-N 120.905 -1.122 . . . . 0.0 111.539 175.634 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 12.6 p -137.29 165.69 25.57 Favored 'General case' 0 N--CA 1.466 0.329 0 C-N-CA 124.677 1.191 . . . . 0.0 110.979 166.958 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 96.0 p -108.54 166.55 10.7 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 124.374 1.07 . . . . 0.0 113.73 -174.92 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 56.1 mt -64.38 -35.26 80.32 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 123.376 0.67 . . . . 0.0 112.092 175.013 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 29.1 p90 -68.95 -32.23 71.67 Favored 'General case' 0 N--CA 1.468 0.452 0 O-C-N 121.103 -0.998 . . . . 0.0 113.19 174.034 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 39.0 mt-30 -70.92 -33.69 70.77 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-O 118.819 -0.61 . . . . 0.0 112.187 171.819 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 76.0 mt -65.29 -40.39 93.79 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-N 119.417 1.008 . . . . 0.0 111.608 167.086 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 23.1 tt0 -62.54 -24.02 67.29 Favored 'General case' 0 CA--C 1.54 0.579 0 N-CA-C 113.213 0.82 . . . . 0.0 113.213 -178.125 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 19.9 t-20 -57.58 -26.39 61.41 Favored 'General case' 0 CA--C 1.552 1.034 0 O-C-N 120.967 -1.083 . . . . 0.0 113.367 171.883 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 2.4 m-30 -89.73 -10.35 46.0 Favored 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 125.008 1.323 . . . . 0.0 113.839 174.705 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 64.0 m -70.41 158.76 35.41 Favored 'General case' 0 N--CA 1.479 1.003 0 CA-C-N 120.315 1.416 . . . . 0.0 111.823 171.77 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.253 1.255 0 N-CA-C 112.743 0.645 . . . . 0.0 112.743 166.86 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 69.5 m-85 . . . . . 0 N--CA 1.488 1.436 0 CA-C-O 120.466 0.174 . . . . 0.0 111.438 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 12.6 p -154.74 153.78 7.75 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.83 0 C-N-CA 126.558 1.943 . . . . 0.0 109.396 179.258 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -126.97 142.72 51.48 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 124.842 1.257 . . . . 0.0 113.414 179.54 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 44.7 mt-30 -149.06 163.93 36.11 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 125.683 1.593 . . . . 0.0 110.904 -170.822 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 36.0 m-70 -81.96 132.49 35.26 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 108.915 -0.772 . . . . 0.0 108.915 156.345 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 86.7 mt -146.11 135.2 22.68 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 126.541 1.936 . . . . 0.0 108.851 -177.06 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 4.4 t -151.91 153.57 34.39 Favored 'General case' 0 N--CA 1.467 0.424 0 O-C-N 121.445 -0.785 . . . . 0.0 112.395 -173.386 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 51.53 -132.05 35.02 Favored Glycine 0 CA--C 1.531 1.075 0 C-N-CA 125.38 1.466 . . . . 0.0 113.831 174.817 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 19.8 m -58.56 -36.7 74.32 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 124.341 1.056 . . . . 0.0 112.108 -179.899 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 19.5 m-70 -71.54 -30.8 66.32 Favored 'General case' 0 CA--C 1.541 0.603 0 O-C-N 121.148 -0.97 . . . . 0.0 112.478 179.007 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 7.8 tt -67.01 -44.54 80.08 Favored 'General case' 0 C--N 1.343 0.288 0 O-C-N 121.37 -0.831 . . . . 0.0 111.227 166.381 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 72.4 t -60.1 -38.3 76.42 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.072 0 CA-C-N 118.907 0.776 . . . . 0.0 111.525 177.467 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -63.74 -50.49 68.9 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.496 1.118 . . . . 0.0 111.669 171.604 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.45 -44.23 97.47 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 118.578 0.626 . . . . 0.0 112.21 179.946 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 48.0 tp -57.99 -53.05 62.66 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 125.738 1.615 . . . . 0.0 110.698 175.375 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 51.9 t80 -54.34 -42.21 69.97 Favored 'General case' 0 CA--C 1.543 0.676 0 N-CA-C 112.952 0.723 . . . . 0.0 112.952 174.053 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 77.3 mt -69.94 -35.44 74.52 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 123.983 0.913 . . . . 0.0 112.857 178.682 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 39.6 t -64.21 -44.39 97.45 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.853 0 C-N-CA 124.483 1.113 . . . . 0.0 111.039 170.603 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 56.5 m -73.17 -29.04 62.56 Favored 'General case' 0 CA--C 1.54 0.591 0 N-CA-C 112.961 0.726 . . . . 0.0 112.961 -179.002 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 70.57 -120.1 8.84 Favored Glycine 0 CA--C 1.529 0.918 0 C-N-CA 125.03 1.3 . . . . 0.0 110.748 177.492 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 37.4 mp0 -67.3 -22.4 65.63 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 124.581 1.152 . . . . 0.0 112.659 173.566 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 56.2 mtm-85 -79.18 153.97 29.63 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 124.479 1.111 . . . . 0.0 111.451 -179.724 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . -86.76 -178.35 49.21 Favored Glycine 0 CA--C 1.529 0.943 0 C-N-CA 125.128 1.347 . . . . 0.0 112.618 172.327 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 42.0 p90 -146.06 151.94 38.53 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 124.659 1.183 . . . . 0.0 114.15 -176.74 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 64.1 t80 -81.21 160.38 24.32 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 126.458 1.903 . . . . 0.0 109.76 161.151 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 68.8 t80 -159.41 139.12 11.6 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 124.966 1.306 . . . . 0.0 111.718 -178.886 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 9.6 t -170.0 127.42 0.78 Allowed Pre-proline 0 N--CA 1.479 0.987 0 C-N-CA 126.144 1.778 . . . . 0.0 111.486 171.585 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 21.5 Cg_endo -87.96 -156.5 0.06 OUTLIER 'Trans proline' 0 CA--C 1.54 0.79 0 C-N-CA 124.641 3.561 . . . . 0.0 111.268 179.767 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 47.2 tttp -60.53 139.45 57.76 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 124.271 1.028 . . . . 0.0 113.34 176.646 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 28.4 m . . . . . 0 C--O 1.253 1.247 0 C-N-CA 125.986 1.714 . . . . 0.0 111.065 165.225 . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.533 0 N-CA-C 111.533 -0.627 . . . . 0.0 111.533 . . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 13.9 tt -166.97 -58.6 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.474 0.761 0 C-N-CA 126.374 1.869 . . . . 0.0 112.801 -171.557 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 78.0 t -74.56 -23.94 18.29 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.321 0 CA-C-N 120.798 1.636 . . . . 0.0 113.525 -169.217 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 68.5 mm-40 -100.79 -44.12 5.89 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 119.074 0.852 . . . . 0.0 109.923 164.378 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 54.7 tt0 -59.21 -45.26 91.56 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 123.967 0.907 . . . . 0.0 113.159 -172.354 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 2.6 t -84.71 -16.74 40.71 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-N 119.756 1.162 . . . . 0.0 113.381 -177.07 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 79.5 m -76.53 -41.67 45.93 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 123.966 0.906 . . . . 0.0 111.809 170.992 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 72.3 p -93.94 -36.31 12.24 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 125.147 1.379 . . . . 0.0 112.928 -175.001 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.9 t -121.08 -160.2 0.84 Allowed 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 126.268 1.827 . . . . 0.0 110.255 174.342 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 69.5 mt -103.3 144.39 14.0 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.746 0 C-N-CA 125.555 1.542 . . . . 0.0 110.163 -178.129 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 15.1 p -130.92 157.7 42.23 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 123.845 0.858 . . . . 0.0 112.749 164.472 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 59.6 p -95.33 162.91 13.48 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 124.784 1.234 . . . . 0.0 113.234 177.358 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 51.6 mt -61.47 -33.39 73.68 Favored 'General case' 0 N--CA 1.468 0.462 0 O-C-N 121.502 -0.749 . . . . 0.0 111.781 172.027 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 58.2 m-85 -65.15 -33.9 77.12 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 123.853 0.861 . . . . 0.0 112.654 173.824 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 90.0 mt-30 -75.76 -34.41 60.25 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 124.061 0.944 . . . . 0.0 111.567 174.166 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 83.3 mt -62.45 -41.11 98.5 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 119.767 1.167 . . . . 0.0 111.49 167.967 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 31.8 tt0 -62.92 -27.32 69.29 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 123.669 0.788 . . . . 0.0 112.89 -179.482 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 15.5 t-20 -59.79 -21.89 61.44 Favored 'General case' 0 CA--C 1.549 0.919 0 N-CA-C 113.485 0.92 . . . . 0.0 113.485 175.237 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 86.5 m-85 -97.39 -0.58 46.05 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 125.419 1.488 . . . . 0.0 114.266 178.255 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 55.5 m -66.66 149.87 49.88 Favored 'General case' 0 CA--C 1.543 0.676 0 O-C-N 121.071 -1.018 . . . . 0.0 111.356 167.424 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 33.3 m120 . . . . . 0 C--O 1.251 1.139 0 C-N-CA 124.896 1.278 . . . . 0.0 112.63 173.478 . . . . . . . . 0 0 . 1 . 021 nuclear build full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 30.6 p90 . . . . . 0 N--CA 1.484 1.243 0 CA-C-O 119.642 -0.218 . . . . 0.0 110.63 . . . . . . . . . 0 0 . 1 . 021 nuclear build full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . 0.277 26.9 m 45.65 66.87 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.173 0 C-N-CA 126.097 1.759 . . . . 0.0 113.012 -169.954 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 1.5 p-10 -148.54 142.62 25.96 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 124.894 1.278 . . . . 0.0 112.974 -172.787 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 28.6 mm-40 -152.57 167.94 27.21 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 125.302 1.441 . . . . 0.0 112.041 -169.041 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 98.2 m-70 -83.21 138.23 33.7 Favored 'General case' 0 CA--C 1.543 0.682 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 155.903 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 79.2 mt -151.86 133.95 15.07 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 124.907 1.283 . . . . 0.0 109.08 -175.156 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 2.0 t -151.59 152.05 32.37 Favored 'General case' 0 N--CA 1.465 0.318 0 N-CA-C 112.8 0.667 . . . . 0.0 112.8 -177.815 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 60.99 -130.68 47.95 Favored Glycine 0 CA--C 1.529 0.969 0 C-N-CA 124.886 1.231 . . . . 0.0 113.472 175.543 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 19.8 p -61.3 -33.69 73.99 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 124.016 0.927 . . . . 0.0 112.161 179.481 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 11.6 m80 -64.36 -40.95 96.86 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 124.461 1.104 . . . . 0.0 111.557 176.472 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 60.2 tp -68.33 -43.67 77.02 Favored 'General case' 0 N--CA 1.468 0.433 0 C-N-CA 124.119 0.968 . . . . 0.0 111.461 176.001 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 79.5 t -64.35 -37.77 80.81 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.958 0 C-N-CA 123.422 0.689 . . . . 0.0 111.858 176.172 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -67.19 -45.44 76.88 Favored 'General case' 0 N--CA 1.466 0.375 0 C-N-CA 124.196 0.999 . . . . 0.0 111.581 173.722 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.43 -45.29 91.98 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 123.173 0.589 . . . . 0.0 111.735 176.976 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 27.4 mt -53.63 -54.79 32.67 Favored 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 124.29 1.036 . . . . 0.0 111.526 171.371 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 90.0 t80 -54.86 -42.48 72.06 Favored 'General case' 0 CA--C 1.543 0.688 0 N-CA-C 112.763 0.653 . . . . 0.0 112.763 177.774 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 92.4 mt -74.65 -35.36 62.85 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 124.158 0.983 . . . . 0.0 113.274 -178.893 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 33.9 t -68.07 -43.89 84.98 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 C-N-CA 124.034 0.934 . . . . 0.0 110.664 173.661 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 84.6 m -77.43 -32.11 54.41 Favored 'General case' 0 CA--C 1.54 0.591 0 N-CA-C 112.782 0.66 . . . . 0.0 112.782 -176.409 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 69.14 -119.76 9.85 Favored Glycine 0 N--CA 1.467 0.746 0 C-N-CA 124.354 0.978 . . . . 0.0 111.438 174.927 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -64.25 -24.49 67.68 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 124.839 1.255 . . . . 0.0 112.658 174.203 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 83.9 mtm180 -75.56 146.22 40.62 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 124.625 1.17 . . . . 0.0 110.95 175.896 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . -75.72 178.62 47.98 Favored Glycine 0 N--CA 1.475 1.248 0 C-N-CA 123.4 0.524 . . . . 0.0 111.968 166.514 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 55.0 p90 -148.27 161.23 41.93 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 124.074 0.949 . . . . 0.0 113.231 174.343 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 83.3 t80 -146.22 99.37 3.23 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 124.896 1.278 . . . . 0.0 110.145 171.613 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -68.27 167.12 15.02 Favored 'General case' 0 CA--C 1.553 1.06 0 C-N-CA 125.183 1.393 . . . . 0.0 113.589 168.305 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 16.8 p -57.58 -36.39 45.08 Favored Pre-proline 0 N--CA 1.483 1.204 0 N-CA-C 116.699 2.111 . . . . 0.0 116.699 -159.22 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 17.0 Cg_endo -102.17 65.21 0.38 Allowed 'Cis proline' 0 CA--C 1.541 0.873 0 CA-C-N 122.992 2.104 . . . . 0.0 110.112 -24.182 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -151.48 6.18 0.47 Allowed 'General case' 0 N--CA 1.482 1.16 0 N-CA-C 114.714 1.375 . . . . 0.0 114.714 -174.737 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 20.0 p . . . . . 0 C--O 1.248 1.026 0 C-N-CA 128.317 2.647 . . . . 0.0 109.057 -178.638 . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.658 0 N-CA-C 111.607 -0.597 . . . . 0.0 111.607 . . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 45.7 pt -93.91 4.49 8.0 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.441 0 N-CA-C 115.042 1.497 . . . . 0.0 115.042 -169.074 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 60.5 t -54.34 -44.07 64.76 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.273 0 C-N-CA 124.74 1.216 . . . . 0.0 112.553 -176.541 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -76.44 -44.0 37.68 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 122.858 0.463 . . . . 0.0 110.83 173.602 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -59.22 -49.17 78.87 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 124.827 1.251 . . . . 0.0 111.822 -173.063 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 8.1 t -74.91 -17.99 60.48 Favored 'General case' 0 N--CA 1.472 0.626 0 N-CA-C 113.542 0.941 . . . . 0.0 113.542 -176.696 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 42.3 t -90.06 -41.41 11.7 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 124.977 1.311 . . . . 0.0 112.46 177.286 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 50.1 m -82.35 -44.68 15.87 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 126.718 2.007 . . . . 0.0 110.572 -177.784 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 73.0 m -108.77 -132.4 0.32 Allowed 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 125.948 1.699 . . . . 0.0 108.512 165.851 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 29.8 pt -136.73 161.9 35.64 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.776 0 C-N-CA 125.843 1.657 . . . . 0.0 112.184 -174.363 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 13.8 p -150.81 162.96 39.74 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 123.664 0.786 . . . . 0.0 112.38 167.046 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 10.8 t -106.88 164.11 12.39 Favored 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 125.3 1.44 . . . . 0.0 112.752 -177.919 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 28.5 mt -60.36 -35.62 76.11 Favored 'General case' 0 N--CA 1.468 0.425 0 C-N-CA 124.724 1.209 . . . . 0.0 111.945 -178.526 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 80.3 t80 -62.93 -29.98 71.21 Favored 'General case' 0 CA--C 1.543 0.685 0 N-CA-C 113.665 0.987 . . . . 0.0 113.665 172.349 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 75.8 mt-30 -82.2 -30.95 30.59 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 123.724 0.809 . . . . 0.0 111.376 176.649 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 88.4 mt -60.81 -48.91 79.64 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-N 118.503 0.592 . . . . 0.0 110.667 164.862 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 28.7 tt0 -63.0 -24.48 67.94 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 123.873 0.869 . . . . 0.0 112.938 -176.524 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 26.4 t30 -57.68 -27.26 62.74 Favored 'General case' 0 CA--C 1.549 0.932 0 O-C-N 121.118 -0.989 . . . . 0.0 113.422 174.893 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 64.7 m-85 -89.25 -3.8 58.41 Favored 'General case' 0 CA--C 1.548 0.887 0 C-N-CA 125.215 1.406 . . . . 0.0 113.714 176.965 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 79.8 m -93.83 164.51 13.09 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 124.857 1.263 . . . . 0.0 113.203 176.141 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.247 0.962 0 C-N-CA 125.781 1.633 . . . . 0.0 110.521 170.154 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 53.6 m-85 . . . . . 0 N--CA 1.489 1.482 0 CA-C-O 118.978 -0.534 . . . . 0.0 110.445 . . . . . . . . . 0 0 . 1 . 022 nuclear build full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 7.5 p -165.92 131.42 0.47 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.039 0 C-N-CA 125.261 1.425 . . . . 0.0 110.356 -177.656 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 11.9 p30 -97.98 150.3 21.51 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 124.867 1.267 . . . . 0.0 113.209 -179.674 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 39.6 mt-30 -147.36 160.79 42.14 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 125.247 1.419 . . . . 0.0 110.657 -178.162 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 98.1 m-70 -81.36 127.11 32.4 Favored 'General case' 0 CA--C 1.54 0.576 0 N-CA-C 108.432 -0.951 . . . . 0.0 108.432 155.926 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 90.7 mt -143.28 130.0 20.33 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 124.679 1.192 . . . . 0.0 109.907 -177.204 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 83.8 m -128.72 141.23 51.39 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 124.805 1.242 . . . . 0.0 111.787 -174.926 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 49.0 -120.16 6.76 Favored Glycine 0 N--CA 1.473 1.153 0 C-N-CA 125.652 1.596 . . . . 0.0 114.525 164.556 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 25.3 m -58.2 -38.54 76.94 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 123.979 0.912 . . . . 0.0 112.481 -179.623 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 80.2 m-70 -75.37 -28.18 59.43 Favored 'General case' 0 CA--C 1.541 0.628 0 O-C-N 121.203 -0.936 . . . . 0.0 112.804 177.765 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 51.4 tp -67.23 -46.96 72.21 Favored 'General case' 0 N--CA 1.469 0.507 0 O-C-N 121.345 -0.847 . . . . 0.0 110.824 169.952 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 75.6 t -66.87 -33.88 66.3 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.019 0 C-N-CA 123.752 0.821 . . . . 0.0 111.651 176.591 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 43.2 tt0 -63.69 -49.82 71.65 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 124.987 1.315 . . . . 0.0 111.254 171.781 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -58.94 -45.61 90.01 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 123.159 0.584 . . . . 0.0 112.003 176.845 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 59.9 tp -55.37 -51.44 66.81 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 125.522 1.529 . . . . 0.0 111.745 174.633 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 80.9 t80 -58.61 -40.12 82.37 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 123.823 0.849 . . . . 0.0 112.849 175.062 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 85.8 mt -76.83 -34.35 57.89 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 124.075 0.95 . . . . 0.0 113.246 -177.913 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 27.3 t -63.22 -47.05 94.11 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.843 0 C-N-CA 124.267 1.027 . . . . 0.0 110.25 172.297 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 84.5 m -87.78 -23.78 23.98 Favored 'General case' 0 N--CA 1.471 0.579 0 N-CA-C 113.821 1.045 . . . . 0.0 113.821 -172.82 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 66.48 -115.06 7.0 Favored Glycine 0 CA--C 1.529 0.909 0 C-N-CA 124.625 1.107 . . . . 0.0 111.846 172.464 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -72.56 -19.88 61.42 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 123.844 0.858 . . . . 0.0 112.854 175.257 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 71.6 mtp180 -75.8 133.04 40.76 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 123.969 0.908 . . . . 0.0 109.72 172.932 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . -89.67 167.74 33.93 Favored Glycine 0 N--CA 1.469 0.842 0 C-N-CA 125.268 1.413 . . . . 0.0 113.094 -178.668 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 45.4 p90 -135.36 163.83 29.13 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 124.986 1.314 . . . . 0.0 113.595 -179.502 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 85.1 t80 -126.83 143.89 51.13 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 126.161 1.784 . . . . 0.0 108.484 162.478 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -146.89 144.86 29.58 Favored 'General case' 0 N--CA 1.476 0.833 0 N-CA-C 113.486 0.921 . . . . 0.0 113.486 -166.724 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 10.7 m -151.11 140.01 13.37 Favored Pre-proline 0 N--CA 1.476 0.843 0 C-N-CA 125.131 1.372 . . . . 0.0 109.57 -169.675 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 65.9 Cg_endo -77.38 -169.96 0.84 Allowed 'Trans proline' 0 CA--C 1.541 0.84 0 C-N-CA 123.676 2.917 . . . . 0.0 111.972 173.508 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 38.5 ttpt -63.41 -33.33 75.31 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 124.042 0.937 . . . . 0.0 113.483 179.961 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 22.4 p . . . . . 0 C--O 1.253 1.256 0 C-N-CA 126.05 1.74 . . . . 0.0 113.362 -176.854 . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.549 0 N-CA-C 111.772 -0.531 . . . . 0.0 111.772 . . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 47.8 pt -90.61 -28.46 4.91 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.207 0 N-CA-C 114.855 1.428 . . . . 0.0 114.855 -172.398 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 16.6 t -66.84 -41.81 88.25 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.296 0 CA-C-N 119.795 1.179 . . . . 0.0 110.254 -171.071 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 4.9 pm0 -71.41 -0.09 9.47 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 127.322 2.249 . . . . 0.0 113.905 174.007 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 33.4 tt0 -104.72 -60.06 1.65 Allowed 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 123.861 0.865 . . . . 0.0 109.638 161.982 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 92.7 m -58.16 -30.9 66.75 Favored 'General case' 0 N--CA 1.467 0.411 0 N-CA-C 115.308 1.595 . . . . 0.0 115.308 -171.175 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 16.6 t -84.71 -38.94 19.11 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 123.194 0.598 . . . . 0.0 112.604 -172.553 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 22.0 p -99.97 -31.8 11.29 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 125.609 1.563 . . . . 0.0 113.618 -177.727 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.8 t -117.78 -166.2 1.18 Allowed 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 126.112 1.765 . . . . 0.0 110.206 172.603 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 14.9 tt -96.56 149.84 4.65 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.66 0 C-N-CA 124.631 1.172 . . . . 0.0 110.782 176.654 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 15.6 p -141.93 157.11 45.35 Favored 'General case' 0 N--CA 1.471 0.594 0 O-C-N 121.267 -0.896 . . . . 0.0 113.135 174.266 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 35.6 m -103.12 152.57 21.26 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 124.022 0.929 . . . . 0.0 112.335 -171.805 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 42.6 mt -60.27 -32.7 71.42 Favored 'General case' 0 N--CA 1.473 0.719 0 O-C-N 121.101 -0.999 . . . . 0.0 111.7 176.019 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 56.4 m-85 -61.77 -31.94 72.17 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 124.392 1.077 . . . . 0.0 113.534 172.422 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 97.1 mt-30 -79.96 -35.55 37.44 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 124.705 1.202 . . . . 0.0 110.833 175.415 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 63.1 mt -61.74 -39.01 90.08 Favored 'General case' 0 N--CA 1.473 0.684 0 CA-C-N 118.499 0.59 . . . . 0.0 111.946 168.662 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 28.8 tt0 -63.56 -30.53 71.63 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 123.419 0.688 . . . . 0.0 112.769 179.295 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 45.4 t30 -62.3 -20.77 64.66 Favored 'General case' 0 CA--C 1.55 0.977 0 O-C-N 120.924 -1.11 . . . . 0.0 113.007 173.417 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 1.4 m-85 -97.16 5.13 50.71 Favored 'General case' 0 CA--C 1.549 0.909 0 C-N-CA 125.989 1.715 . . . . 0.0 114.089 175.81 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 79.5 m -68.28 159.3 31.58 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-N 119.355 0.98 . . . . 0.0 112.682 169.034 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.253 1.278 0 C-N-CA 126.939 2.096 . . . . 0.0 110.504 179.478 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 40.0 t80 . . . . . 0 N--CA 1.486 1.374 0 CA-C-O 118.733 -0.651 . . . . 0.0 110.877 . . . . . . . . . 0 0 . 1 . 023 nuclear build full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 13.7 t -138.4 46.37 0.36 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.582 0 C-N-CA 126.357 1.863 . . . . 0.0 108.273 177.508 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 25.0 p-10 -163.72 144.32 8.73 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 125.834 1.654 . . . . 0.0 113.125 -160.035 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 45.5 mm-40 -153.4 164.51 38.03 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 125.486 1.514 . . . . 0.0 111.979 -169.516 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 98.4 m-70 -83.74 133.08 34.8 Favored 'General case' 0 CA--C 1.542 0.637 0 O-C-N 121.653 -0.655 . . . . 0.0 109.259 158.359 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 84.0 mt -150.49 135.17 17.4 Favored 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 124.83 1.252 . . . . 0.0 109.97 -170.722 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 3.6 t -154.45 155.54 35.12 Favored 'General case' 0 N--CA 1.468 0.439 0 O-C-N 121.488 -0.757 . . . . 0.0 111.869 -179.925 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 52.84 -129.3 38.37 Favored Glycine 0 N--CA 1.47 0.944 0 C-N-CA 124.923 1.249 . . . . 0.0 113.536 176.393 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 28.3 p -56.78 -36.48 69.9 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 125.028 1.331 . . . . 0.0 113.065 178.662 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 75.3 m-70 -73.76 -29.62 62.32 Favored 'General case' 0 CA--C 1.541 0.631 0 O-C-N 120.883 -1.136 . . . . 0.0 113.07 177.181 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 35.9 tp -71.59 -42.1 68.16 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 119.172 0.896 . . . . 0.0 110.774 170.291 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 49.7 t -59.07 -41.48 83.59 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.074 0 C-N-CA 124.032 0.933 . . . . 0.0 111.526 172.24 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 43.3 tt0 -63.78 -47.29 81.52 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 125.631 1.572 . . . . 0.0 111.779 174.655 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.8 -43.86 97.69 Favored 'General case' 0 CA--C 1.537 0.447 0 O-C-N 121.749 -0.594 . . . . 0.0 111.61 179.168 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 40.1 mt -56.69 -52.45 64.89 Favored 'General case' 0 N--CA 1.465 0.318 0 C-N-CA 123.675 0.79 . . . . 0.0 111.307 172.181 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 77.2 t80 -53.16 -41.39 65.11 Favored 'General case' 0 CA--C 1.542 0.658 0 N-CA-C 112.803 0.668 . . . . 0.0 112.803 176.044 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 88.6 mt -75.24 -36.44 61.29 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 124.401 1.08 . . . . 0.0 113.525 179.962 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 36.9 t -71.25 -41.38 74.8 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.038 0 C-N-CA 124.249 1.02 . . . . 0.0 110.617 176.186 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 86.3 m -81.47 -38.77 25.85 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 123.825 0.85 . . . . 0.0 112.246 -175.175 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 62.26 -100.52 0.31 Allowed Glycine 0 N--CA 1.472 1.048 0 C-N-CA 124.483 1.039 . . . . 0.0 112.813 172.051 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -69.93 -31.29 68.98 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 124.824 1.249 . . . . 0.0 112.458 174.302 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 1.3 mpp_? -75.52 153.88 37.21 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.072 0.949 . . . . 0.0 110.426 170.243 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . -81.44 -164.9 33.74 Favored Glycine 0 CA--C 1.531 1.064 0 C-N-CA 124.027 0.822 . . . . 0.0 111.26 165.12 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 51.3 p90 -154.63 156.92 37.39 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 124.192 0.997 . . . . 0.0 113.503 177.847 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 60.3 t80 -91.24 -40.54 11.47 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 125.08 1.352 . . . . 0.0 113.704 -176.103 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 48.1 t80 64.6 -59.74 0.22 Allowed 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 128.494 2.718 . . . . 0.0 116.291 179.066 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 23.9 p -62.94 147.92 93.21 Favored Pre-proline 0 N--CA 1.478 0.954 0 C-N-CA 124.856 1.262 . . . . 0.0 114.19 -158.117 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 91.2 Cg_endo -73.26 178.78 6.16 Favored 'Trans proline' 0 C--N 1.354 0.836 0 C-N-CA 124.312 3.341 . . . . 0.0 111.981 179.217 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 63.3 pttt -64.23 -16.85 62.86 Favored 'General case' 0 CA--C 1.547 0.861 0 N-CA-C 115.6 1.704 . . . . 0.0 115.6 -176.023 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 12.9 t . . . . . 0 C--O 1.252 1.209 0 C-N-CA 126.549 1.94 . . . . 0.0 112.235 -176.447 . . . . . . . . 0 0 . 1 . 024 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 1.279 0 N-CA-C 111.178 -0.769 . . . . 0.0 111.178 . . . . . . . . . 0 0 . 1 . 024 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 15.2 pt -97.62 -23.85 4.52 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.25 0 N-CA-C 114.282 1.216 . . . . 0.0 114.282 -179.974 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 99.1 t -74.73 -46.53 41.33 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.083 0 CA-C-N 119.224 0.92 . . . . 0.0 110.809 -166.844 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 5.5 pm0 -67.5 -32.45 73.27 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 124.388 1.075 . . . . 0.0 111.265 171.904 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 8.5 tt0 -66.41 -38.19 86.92 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 124.24 1.016 . . . . 0.0 111.617 179.726 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 3.3 t -88.79 -16.76 31.3 Favored 'General case' 0 CA--C 1.544 0.719 0 N-CA-C 114.247 1.203 . . . . 0.0 114.247 176.01 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 52.5 t -97.92 -53.53 3.37 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 124.864 1.266 . . . . 0.0 113.633 -175.819 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 38.5 m -77.97 -47.36 18.72 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 125.396 1.478 . . . . 0.0 109.701 -179.245 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 74.7 m -90.47 -152.85 0.28 Allowed 'General case' 0 CA--C 1.551 1.01 0 C-N-CA 123.737 0.815 . . . . 0.0 109.888 158.224 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 28.8 pt -132.13 154.57 40.37 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.99 0 O-C-N 120.485 -1.384 . . . . 0.0 111.902 -176.821 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 1.1 p -149.94 164.89 34.24 Favored 'General case' 0 N--CA 1.468 0.468 0 N-CA-C 112.98 0.733 . . . . 0.0 112.98 168.89 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 2.8 t -111.9 166.41 11.24 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 124.674 1.19 . . . . 0.0 113.521 -177.414 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 71.1 mt -59.15 -34.42 72.05 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 124.359 1.064 . . . . 0.0 111.967 178.107 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 78.1 m-85 -63.97 -28.77 70.04 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 124.276 1.03 . . . . 0.0 113.476 173.671 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 55.8 mt-30 -81.17 -37.76 28.22 Favored 'General case' 0 N--CA 1.467 0.405 0 C-N-CA 123.778 0.831 . . . . 0.0 110.916 173.65 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 45.0 mt -56.02 -44.89 79.16 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 119.132 0.878 . . . . 0.0 111.086 170.524 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -60.84 -30.91 70.4 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 124.117 0.967 . . . . 0.0 112.959 177.448 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 27.2 t30 -80.64 -31.44 36.47 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 124.341 1.056 . . . . 0.0 112.832 174.608 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 19.6 m-30 -68.15 -37.17 80.76 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 123.975 0.91 . . . . 0.0 112.212 173.466 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 72.1 m -64.98 163.46 14.57 Favored 'General case' 0 N--CA 1.473 0.717 0 N-CA-C 113.602 0.964 . . . . 0.0 113.602 178.482 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.252 1.225 0 C-N-CA 125.382 1.473 . . . . 0.0 111.532 -179.357 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 70.1 m-85 . . . . . 0 N--CA 1.486 1.355 0 N-CA-C 110.374 -0.232 . . . . 0.0 110.374 . . . . . . . . . 0 0 . 1 . 024 nuclear build full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 19.0 m -73.56 145.22 11.81 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.123 0 C-N-CA 128.318 2.647 . . . . 0.0 113.469 3.214 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 11.0 m120 72.81 128.21 0.04 OUTLIER 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 129.306 3.043 . . . . 0.0 112.951 176.934 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 27.7 mm-40 -145.15 164.81 30.14 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 125.373 1.469 . . . . 0.0 110.511 178.499 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 90.4 m-70 -83.59 117.21 23.0 Favored 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 107.785 -1.191 . . . . 0.0 107.785 160.832 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 94.3 mt -129.22 131.74 47.12 Favored 'General case' 0 N--CA 1.462 0.164 0 C-N-CA 124.859 1.263 . . . . 0.0 108.532 178.704 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -142.97 153.76 43.34 Favored 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 124.267 1.027 . . . . 0.0 111.517 -173.867 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 48.23 -126.69 15.55 Favored Glycine 0 N--CA 1.471 0.98 0 C-N-CA 125.578 1.561 . . . . 0.0 114.338 170.047 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 16.0 p -59.88 -38.91 83.58 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 124.579 1.152 . . . . 0.0 112.618 179.46 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 26.7 m170 -65.23 -37.87 88.63 Favored 'General case' 0 CA--C 1.544 0.718 0 O-C-N 121.076 -1.015 . . . . 0.0 111.803 177.74 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 56.6 tp -67.9 -44.23 77.44 Favored 'General case' 0 N--CA 1.466 0.37 0 C-N-CA 123.405 0.682 . . . . 0.0 111.117 172.234 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 53.5 t -59.02 -38.8 76.09 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.973 0 CA-C-N 118.836 0.744 . . . . 0.0 111.978 174.92 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -66.3 -45.71 79.44 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 123.87 0.868 . . . . 0.0 111.579 173.815 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.07 -46.37 90.92 Favored 'General case' 0 CA--C 1.543 0.681 0 CA-C-N 119.296 0.953 . . . . 0.0 111.901 176.794 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 32.5 mt -54.76 -50.28 68.82 Favored 'General case' 0 N--CA 1.466 0.333 0 C-N-CA 124.574 1.149 . . . . 0.0 111.436 173.174 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 88.4 t80 -62.36 -36.55 82.59 Favored 'General case' 0 CA--C 1.543 0.706 0 O-C-N 121.2 -0.938 . . . . 0.0 113.331 177.04 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 76.3 mt -73.01 -33.12 65.56 Favored 'General case' 0 N--CA 1.469 0.495 0 O-C-N 121.155 -0.966 . . . . 0.0 113.296 177.677 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 84.5 t -81.21 -37.1 15.49 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.93 0 C-N-CA 123.945 0.898 . . . . 0.0 111.469 176.869 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 44.0 m -124.8 6.03 8.09 Favored 'General case' 0 N--CA 1.473 0.691 0 N-CA-C 115.587 1.699 . . . . 0.0 115.587 -163.05 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . -57.53 -27.16 58.14 Favored Glycine 0 N--CA 1.479 1.533 0 N-CA-C 116.302 1.281 . . . . 0.0 116.302 -166.523 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -81.39 -21.55 38.91 Favored 'General case' 0 CA--C 1.548 0.871 0 N-CA-C 114.13 1.159 . . . . 0.0 114.13 174.709 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 75.9 mtp180 -91.52 -42.36 10.29 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 126.199 1.8 . . . . 0.0 112.23 177.961 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 97.31 136.98 9.35 Favored Glycine 0 CA--C 1.531 1.049 0 C-N-CA 125.651 1.596 . . . . 0.0 110.558 -163.155 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 46.8 p90 -105.1 165.12 11.31 Favored 'General case' 0 CA--C 1.538 0.519 0 N-CA-C 114.198 1.184 . . . . 0.0 114.198 -172.625 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 69.9 t80 -108.81 148.98 29.74 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 126.391 1.876 . . . . 0.0 109.92 175.609 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 64.8 t80 -160.96 117.86 2.31 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 124.673 1.189 . . . . 0.0 111.1 -175.843 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 20.2 p -142.45 114.85 6.23 Favored Pre-proline 0 N--CA 1.475 0.809 0 C-N-CA 125.186 1.394 . . . . 0.0 112.128 -174.704 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_endo -82.36 178.1 6.53 Favored 'Trans proline' 0 C--N 1.35 0.634 0 C-N-CA 124.184 3.256 . . . . 0.0 112.407 173.667 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 14.7 ptmm? -73.85 169.39 17.5 Favored 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 124.385 1.074 . . . . 0.0 113.058 169.706 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 21.6 m . . . . . 0 C--O 1.254 1.324 0 C-N-CA 125.271 1.428 . . . . 0.0 111.514 169.249 . . . . . . . . 0 0 . 1 . 025 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.563 0 CA-C-O 121.44 0.467 . . . . 0.0 112.039 . . . . . . . . . 0 0 . 1 . 025 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 1.7 pp -70.58 -21.09 22.73 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.095 0 N-CA-C 114.006 1.113 . . . . 0.0 114.006 -164.994 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 45.3 t -58.83 -36.79 62.9 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.084 0 CA-C-N 118.947 0.794 . . . . 0.0 111.53 171.699 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 24.6 tt0 -78.8 -44.04 24.03 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-O 118.935 -0.555 . . . . 0.0 111.308 174.599 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -58.58 -49.79 76.18 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-N 118.572 0.624 . . . . 0.0 111.455 -177.558 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 16.5 m -60.89 -22.5 64.38 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 124.183 0.993 . . . . 0.0 113.392 176.935 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 49.7 t -96.93 -50.41 4.65 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 124.586 1.155 . . . . 0.0 112.824 -173.677 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 3.1 t -78.39 -35.46 47.16 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.398 1.079 . . . . 0.0 112.054 -179.221 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 30.9 m -107.74 -161.6 0.79 Allowed 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.235 1.414 . . . . 0.0 109.183 165.146 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 26.8 pt -109.49 157.55 9.83 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.734 0 C-N-CA 124.515 1.126 . . . . 0.0 110.878 174.787 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 18.1 p -140.62 160.39 40.13 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-O 121.615 0.721 . . . . 0.0 112.387 171.835 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 4.1 m -96.08 149.36 21.69 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 124.874 1.269 . . . . 0.0 111.896 -169.414 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 55.5 mt -57.27 -33.26 67.44 Favored 'General case' 0 N--CA 1.474 0.73 0 O-C-N 121.09 -1.006 . . . . 0.0 111.833 167.893 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 80.6 t80 -63.71 -30.81 71.86 Favored 'General case' 0 CA--C 1.543 0.682 0 N-CA-C 113.46 0.911 . . . . 0.0 113.46 172.491 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 45.9 mm-40 -80.99 -34.46 32.98 Favored 'General case' 0 CA--C 1.534 0.358 0 O-C-N 121.46 -0.775 . . . . 0.0 111.05 174.099 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 38.4 mt -58.18 -37.2 74.26 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 119.602 1.092 . . . . 0.0 111.296 167.095 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.43 ' HA ' ' SG ' ' A' ' 20' ' ' CYS . 24.7 tt0 -68.97 -35.3 76.58 Favored 'General case' 0 CA--C 1.545 0.768 0 N-CA-C 112.619 0.6 . . . . 0.0 112.619 173.74 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 62.3 t30 -64.74 -22.92 67.09 Favored 'General case' 0 CA--C 1.553 1.072 0 O-C-N 121.009 -1.057 . . . . 0.0 112.257 171.988 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 16.0 m-30 -91.65 -0.16 57.55 Favored 'General case' 0 CA--C 1.551 1.008 0 C-N-CA 125.802 1.641 . . . . 0.0 113.562 177.378 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.43 ' SG ' ' HA ' ' A' ' 17' ' ' GLU . 81.6 m -66.73 160.42 25.75 Favored 'General case' 0 N--CA 1.474 0.752 0 O-C-N 121.063 -1.023 . . . . 0.0 113.639 172.572 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 7.7 t-20 . . . . . 0 C--O 1.251 1.18 0 C-N-CA 128.661 2.784 . . . . 0.0 113.686 177.29 . . . . . . . . 0 0 . 1 . 025 nuclear build full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 68.3 m-85 . . . . . 0 N--CA 1.487 1.413 0 CA-C-O 120.332 0.111 . . . . 0.0 111.055 . . . . . . . . . 0 0 . 1 . 025 nuclear build full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 11.0 p -154.46 150.18 12.06 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.988 0 C-N-CA 125.562 1.545 . . . . 0.0 110.335 178.991 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 61.6 m-20 -109.54 146.69 34.23 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 124.905 1.282 . . . . 0.0 111.601 179.301 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 38.3 mt-30 -143.26 158.7 43.4 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 124.445 1.098 . . . . 0.0 111.229 -179.257 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 95.8 m-70 -80.28 127.33 32.24 Favored 'General case' 0 CA--C 1.539 0.522 0 N-CA-C 108.639 -0.874 . . . . 0.0 108.639 156.623 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 98.5 mt -140.23 123.0 16.41 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 125.59 1.556 . . . . 0.0 109.242 -175.142 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 57.7 m -130.73 138.81 50.16 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 124.891 1.277 . . . . 0.0 110.727 -174.176 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 54.43 -123.67 28.78 Favored Glycine 0 N--CA 1.473 1.101 0 C-N-CA 124.86 1.219 . . . . 0.0 114.029 166.522 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 17.8 p -59.9 -35.47 74.93 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 124.35 1.06 . . . . 0.0 112.387 179.973 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 24.2 m80 -67.69 -38.27 83.44 Favored 'General case' 0 CA--C 1.541 0.607 0 O-C-N 121.25 -0.906 . . . . 0.0 111.714 177.817 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 60.1 tp -67.5 -44.92 77.32 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 123.639 0.776 . . . . 0.0 111.213 172.206 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 53.1 t -60.45 -38.54 78.25 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.131 0 C-N-CA 123.614 0.766 . . . . 0.0 111.761 177.023 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 33.2 mm-40 -68.62 -43.89 75.41 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 123.855 0.862 . . . . 0.0 111.91 173.258 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.36 -43.62 98.56 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-N 119.278 0.944 . . . . 0.0 112.253 176.746 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 44.5 mt -55.48 -54.57 42.26 Favored 'General case' 0 N--CA 1.467 0.412 0 C-N-CA 124.803 1.241 . . . . 0.0 110.84 171.771 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 81.9 t80 -55.19 -40.75 71.11 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 123.48 0.712 . . . . 0.0 112.884 177.471 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 83.0 mt -75.74 -34.38 60.3 Favored 'General case' 0 CA--C 1.534 0.358 0 N-CA-C 113.645 0.979 . . . . 0.0 113.645 -179.121 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 42.9 t -72.73 -42.35 61.98 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.922 0 CA-C-N 118.666 0.666 . . . . 0.0 110.642 174.29 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 75.5 m -83.43 -35.6 24.88 Favored 'General case' 0 N--CA 1.466 0.37 0 N-CA-C 113.539 0.941 . . . . 0.0 113.539 -173.21 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 62.54 -131.43 44.09 Favored Glycine 0 CA--C 1.532 1.094 0 C-N-CA 123.839 0.733 . . . . 0.0 111.66 -175.973 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -63.28 -18.85 64.02 Favored 'General case' 0 CA--C 1.55 0.96 0 C-N-CA 124.942 1.297 . . . . 0.0 113.512 179.452 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 85.4 mtm180 -66.17 -21.9 66.34 Favored 'General case' 0 N--CA 1.477 0.919 0 N-CA-C 113.924 1.083 . . . . 0.0 113.924 -177.567 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.73 -178.43 39.5 Favored Glycine 0 CA--C 1.534 1.236 0 C-N-CA 124.658 1.123 . . . . 0.0 112.154 -172.934 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 53.4 p90 -159.86 164.57 33.48 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 124.368 1.067 . . . . 0.0 113.421 -177.299 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 93.6 t80 -146.26 121.83 10.42 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 124.776 1.23 . . . . 0.0 110.635 171.744 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 44.4 p90 -101.87 155.21 18.29 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 125.975 1.71 . . . . 0.0 111.911 172.569 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 39.8 p -102.17 137.14 19.38 Favored Pre-proline 0 N--CA 1.472 0.673 0 C-N-CA 124.568 1.147 . . . . 0.0 110.078 167.279 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 68.8 Cg_endo -76.25 -168.87 0.6 Allowed 'Trans proline' 0 C--N 1.349 0.6 0 C-N-CA 124.657 3.571 . . . . 0.0 112.287 -169.705 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 27.7 mtpp -58.25 -30.0 66.2 Favored 'General case' 0 CA--C 1.549 0.92 0 O-C-N 121.106 -0.996 . . . . 0.0 113.561 173.222 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 24.5 m . . . . . 0 N--CA 1.486 1.332 0 C-N-CA 129.053 2.941 . . . . 0.0 111.779 173.599 . . . . . . . . 0 0 . 1 . 026 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.728 0 N-CA-C 112.003 -0.439 . . . . 0.0 112.003 . . . . . . . . . 0 0 . 1 . 026 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 14.0 tt -55.38 -42.08 65.43 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.259 0 C-N-CA 124.748 1.219 . . . . 0.0 113.966 -171.934 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 83.5 t -63.03 -45.94 97.53 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.1 0 CA-C-N 119.306 0.957 . . . . 0.0 111.028 -176.707 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 78.5 mm-40 -70.68 -40.8 72.73 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-N 118.465 0.575 . . . . 0.0 111.329 176.597 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 63.9 tp60 -64.77 -38.9 92.56 Favored 'General case' 0 N--CA 1.463 0.222 0 O-C-N 121.83 -0.544 . . . . 0.0 112.052 -179.252 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 88.3 m -83.03 -31.5 27.39 Favored 'General case' 0 CA--C 1.53 0.204 0 N-CA-C 114.268 1.211 . . . . 0.0 114.268 178.607 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 30.5 t -103.46 -48.47 3.97 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 113.153 0.798 . . . . 0.0 113.153 -169.369 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 34.6 m -79.33 -47.12 16.37 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 124.526 1.131 . . . . 0.0 109.536 178.699 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 71.0 m -94.74 -164.32 1.15 Allowed 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 124.625 1.17 . . . . 0.0 111.255 164.112 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 40.4 pt -109.5 149.35 12.66 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 C-N-CA 124.694 1.198 . . . . 0.0 110.885 169.254 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 17.5 p -128.33 158.42 38.27 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 123.567 0.747 . . . . 0.0 112.028 174.149 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 61.5 p -98.67 160.03 14.55 Favored 'General case' 0 N--CA 1.468 0.441 0 N-CA-C 114.003 1.112 . . . . 0.0 114.003 -179.857 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 59.7 mt -60.88 -35.46 76.7 Favored 'General case' 0 CA--C 1.54 0.573 0 O-C-N 121.646 -0.659 . . . . 0.0 111.452 172.107 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 91.6 t80 -62.57 -35.45 79.54 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 124.118 0.967 . . . . 0.0 112.896 172.641 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 84.3 mt-30 -74.16 -35.4 64.03 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 123.866 0.866 . . . . 0.0 111.884 173.349 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 56.8 mt -63.28 -39.02 93.4 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 119.599 1.091 . . . . 0.0 111.923 171.433 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -60.91 -26.73 67.67 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 124.621 1.168 . . . . 0.0 113.319 -178.989 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 26.3 t30 -57.4 -28.69 63.46 Favored 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 124.261 1.024 . . . . 0.0 113.307 175.521 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 98.2 m-85 -95.07 -2.28 50.47 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 125.146 1.378 . . . . 0.0 114.022 -174.174 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 86.3 m -70.67 151.61 44.75 Favored 'General case' 0 CA--C 1.541 0.629 0 N-CA-C 113.938 1.088 . . . . 0.0 113.938 178.701 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.25 1.11 0 C-N-CA 126.378 1.871 . . . . 0.0 110.223 170.522 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 1.8 p90 . . . . . 0 N--CA 1.485 1.307 0 N-CA-C 111.54 0.2 . . . . 0.0 111.54 . . . . . . . . . 0 0 . 1 . 026 nuclear build full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 96.8 t -85.94 143.14 12.11 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.072 0 C-N-CA 124.554 1.142 . . . . 0.0 109.786 173.888 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 51.4 p30 -134.45 149.7 50.76 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 125.303 1.441 . . . . 0.0 112.864 173.103 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 40.9 mt-30 -151.29 162.53 40.74 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 124.922 1.289 . . . . 0.0 111.722 -164.754 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 84.0 m-70 -82.67 130.16 35.08 Favored 'General case' 0 CA--C 1.541 0.633 0 N-CA-C 109.522 -0.548 . . . . 0.0 109.522 154.589 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 78.5 mt -144.07 126.88 16.24 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 126.391 1.876 . . . . 0.0 108.996 -178.5 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 62.3 m -134.74 140.68 46.12 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 124.986 1.315 . . . . 0.0 110.455 -174.754 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 51.7 -118.88 7.6 Favored Glycine 0 N--CA 1.473 1.137 0 C-N-CA 124.88 1.229 . . . . 0.0 114.022 169.147 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 19.3 m -59.48 -33.92 71.92 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 124.475 1.11 . . . . 0.0 112.688 -179.804 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 93.2 m-70 -72.67 -38.83 67.48 Favored 'General case' 0 CA--C 1.539 0.55 0 O-C-N 121.409 -0.807 . . . . 0.0 111.163 178.196 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 55.7 tp -63.81 -45.87 87.7 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 124.053 0.941 . . . . 0.0 111.056 171.827 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 21.8 t -59.59 -43.28 90.67 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.952 0 C-N-CA 124.614 1.166 . . . . 0.0 111.751 176.171 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -65.57 -46.42 79.53 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 123.175 0.59 . . . . 0.0 111.65 175.683 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.07 -44.01 98.02 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 123.533 0.733 . . . . 0.0 112.058 179.961 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 21.4 mt -54.94 -55.51 29.82 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 124.301 1.041 . . . . 0.0 111.132 173.0 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 79.9 t80 -58.15 -34.51 70.36 Favored 'General case' 0 N--CA 1.472 0.666 0 N-CA-C 113.512 0.93 . . . . 0.0 113.512 179.417 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 86.1 mt -74.79 -40.94 60.85 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 124.661 1.184 . . . . 0.0 113.559 175.062 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 38.7 t -64.49 -42.77 96.19 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.021 0 C-N-CA 123.956 0.903 . . . . 0.0 111.052 174.24 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 61.6 m -73.58 -25.7 60.48 Favored 'General case' 0 CA--C 1.538 0.518 0 N-CA-C 112.611 0.597 . . . . 0.0 112.611 179.264 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 83.77 49.29 4.89 Favored Glycine 0 N--CA 1.471 1.008 0 C-N-CA 124.648 1.118 . . . . 0.0 112.184 171.944 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 36.4 mt-10 78.06 -7.93 1.74 Allowed 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 127.997 2.519 . . . . 0.0 113.362 -177.418 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 32.2 mtp180 -66.47 162.48 20.54 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 125.238 1.415 . . . . 0.0 111.927 168.278 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . -63.63 159.42 38.59 Favored Glycine 0 CA--C 1.532 1.145 0 C-N-CA 124.154 0.883 . . . . 0.0 112.939 174.668 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 56.1 p90 -153.8 175.44 13.3 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 125.518 1.527 . . . . 0.0 111.675 -172.288 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 61.0 t80 -138.88 118.46 12.99 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 124.416 1.086 . . . . 0.0 110.884 178.081 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 37.3 p90 -112.3 -13.0 13.5 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 125.67 1.588 . . . . 0.0 114.068 -178.273 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 8.6 m -69.23 137.63 89.23 Favored Pre-proline 0 N--CA 1.473 0.682 0 C-N-CA 125.803 1.641 . . . . 0.0 111.668 -161.812 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 81.2 Cg_endo -72.37 163.66 37.94 Favored 'Trans proline' 0 CA--C 1.537 0.672 0 C-N-CA 123.252 2.635 . . . . 0.0 111.928 175.584 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 11.4 mmpt? -73.63 152.55 40.48 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 123.39 0.676 . . . . 0.0 112.546 174.426 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 21.8 m . . . . . 0 C--O 1.254 1.296 0 C-N-CA 126.089 1.756 . . . . 0.0 112.396 -179.272 . . . . . . . . 0 0 . 1 . 027 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.755 0 N-CA-C 112.244 -0.342 . . . . 0.0 112.244 . . . . . . . . . 0 0 . 1 . 027 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 42.2 pt -89.87 -15.86 8.59 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.959 0 C-N-CA 128.592 2.757 . . . . 0.0 114.215 -4.828 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 25.0 t -51.34 -37.7 18.87 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.659 0 CA-C-N 120.858 1.663 . . . . 0.0 112.135 178.627 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -68.74 -16.52 63.83 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.536 1.134 . . . . 0.0 113.391 -179.867 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 36.7 tt0 -91.82 -57.11 2.85 Favored 'General case' 0 C--O 1.225 -0.207 0 C-N-CA 123.633 0.773 . . . . 0.0 109.474 162.73 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 64.0 m -63.28 -29.89 71.13 Favored 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 114.779 1.4 . . . . 0.0 114.779 -165.412 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 26.7 t -96.18 -38.87 9.96 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 123.872 0.869 . . . . 0.0 112.458 -175.513 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 27.3 m -83.08 -39.21 21.45 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 125.536 1.534 . . . . 0.0 111.766 -179.425 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 22.6 t -114.29 -135.7 0.36 Allowed 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 126.953 2.101 . . . . 0.0 108.768 168.291 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 16.0 pt -133.2 151.18 33.45 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.727 0 C-N-CA 125.901 1.681 . . . . 0.0 111.964 -178.507 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 66.9 m -125.41 158.32 34.64 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 125.392 1.477 . . . . 0.0 111.096 170.38 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 10.5 t -109.52 158.36 18.07 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 124.248 1.019 . . . . 0.0 112.49 175.566 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 45.0 mt -58.87 -35.26 72.69 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 125.297 1.439 . . . . 0.0 111.735 178.942 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 76.2 t80 -62.46 -29.9 70.86 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 124.33 1.052 . . . . 0.0 113.188 173.34 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 94.9 mt-30 -81.63 -33.68 31.3 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 124.313 1.045 . . . . 0.0 110.529 176.586 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 44.1 mt -65.56 -37.98 88.24 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 123.546 0.738 . . . . 0.0 112.129 171.76 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 29.1 tt0 -60.04 -24.32 64.43 Favored 'General case' 0 CA--C 1.544 0.73 0 N-CA-C 113.62 0.971 . . . . 0.0 113.62 -178.901 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 17.3 t-20 -58.47 -23.35 57.57 Favored 'General case' 0 CA--C 1.549 0.939 0 N-CA-C 113.637 0.977 . . . . 0.0 113.637 174.774 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 96.5 m-85 -97.92 0.98 47.52 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.479 1.511 . . . . 0.0 114.195 -177.601 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 60.3 m -68.84 161.26 28.97 Favored 'General case' 0 N--CA 1.473 0.722 0 N-CA-C 113.226 0.824 . . . . 0.0 113.226 173.29 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 20.9 t-20 . . . . . 0 C--O 1.251 1.15 0 C-N-CA 126.027 1.731 . . . . 0.0 112.526 -178.881 . . . . . . . . 0 0 . 1 . 027 nuclear build full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 60.0 m-85 . . . . . 0 N--CA 1.488 1.436 0 CA-C-O 119.189 -0.434 . . . . 0.0 110.781 . . . . . . . . . 0 0 . 1 . 027 nuclear build full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 11.9 p -166.8 136.59 0.65 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.074 0 C-N-CA 125.306 1.442 . . . . 0.0 110.902 -175.35 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 10.6 m120 -89.76 142.12 27.98 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 124.429 1.092 . . . . 0.0 112.063 176.674 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 38.1 mt-30 -144.87 157.34 44.19 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.16 1.384 . . . . 0.0 110.985 -177.985 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 99.2 m-70 -79.57 127.1 31.74 Favored 'General case' 0 CA--C 1.538 0.508 0 N-CA-C 108.61 -0.885 . . . . 0.0 108.61 160.774 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 98.8 mt -143.21 120.76 11.75 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 125.489 1.516 . . . . 0.0 109.914 -173.165 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 58.1 m -127.54 136.94 52.41 Favored 'General case' 0 N--CA 1.467 0.41 0 C-N-CA 125.066 1.346 . . . . 0.0 110.703 -176.878 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 48.43 -116.57 3.21 Favored Glycine 0 CA--C 1.531 1.046 0 C-N-CA 125.208 1.385 . . . . 0.0 114.275 167.556 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 21.1 m -59.31 -34.6 72.52 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 124.39 1.076 . . . . 0.0 112.651 -178.986 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 94.8 m-70 -72.22 -36.74 69.23 Favored 'General case' 0 CA--C 1.542 0.67 0 O-C-N 121.268 -0.895 . . . . 0.0 111.404 177.891 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 58.8 tp -65.77 -45.51 82.24 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 123.69 0.796 . . . . 0.0 110.99 171.963 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 53.6 t -62.65 -37.15 78.25 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.042 0 C-N-CA 124.381 1.073 . . . . 0.0 111.76 176.916 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -66.19 -47.08 75.1 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 123.627 0.771 . . . . 0.0 111.336 172.593 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.57 -43.53 97.18 Favored 'General case' 0 CA--C 1.539 0.539 0 O-C-N 121.521 -0.737 . . . . 0.0 111.996 177.792 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 18.3 mt -53.16 -56.16 18.57 Favored 'General case' 0 N--CA 1.468 0.448 0 C-N-CA 124.673 1.189 . . . . 0.0 111.175 172.037 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 71.5 t80 -55.82 -41.99 75.03 Favored 'General case' 0 CA--C 1.542 0.646 0 N-CA-C 113.151 0.797 . . . . 0.0 113.151 177.41 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 87.6 mt -72.36 -34.72 68.18 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 124.281 1.032 . . . . 0.0 113.134 -179.461 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 28.6 t -66.79 -43.92 89.54 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.909 0 C-N-CA 123.804 0.842 . . . . 0.0 110.624 172.464 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 82.6 m -72.43 -35.98 68.46 Favored 'General case' 0 CA--C 1.539 0.557 0 N-CA-C 112.206 0.447 . . . . 0.0 112.206 -177.85 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 68.51 -109.51 2.94 Favored Glycine 0 CA--C 1.528 0.885 0 C-N-CA 125.136 1.35 . . . . 0.0 112.112 170.512 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -68.85 -27.75 66.1 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 124.362 1.065 . . . . 0.0 112.199 173.575 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 82.6 mtm180 -74.16 154.59 39.03 Favored 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 124.968 1.307 . . . . 0.0 111.019 175.323 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . -80.62 -173.1 46.39 Favored Glycine 0 CA--C 1.527 0.801 0 C-N-CA 123.985 0.802 . . . . 0.0 111.316 168.721 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 15.3 p90 -162.0 165.43 27.39 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 124.7 1.2 . . . . 0.0 112.213 176.161 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 88.2 t80 -152.18 126.34 9.21 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 123.544 0.738 . . . . 0.0 111.696 167.074 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 60.0 t80 -164.29 151.49 11.75 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 126.828 2.051 . . . . 0.0 111.511 172.204 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 9.8 t -164.47 142.84 5.65 Favored Pre-proline 0 N--CA 1.475 0.792 0 C-N-CA 127.134 2.174 . . . . 0.0 109.523 172.381 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 48.4 Cg_endo -64.06 155.48 64.49 Favored 'Trans proline' 0 C--N 1.353 0.812 0 C-N-CA 123.272 2.648 . . . . 0.0 111.665 176.038 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 24.4 pttm -75.03 -3.0 29.87 Favored 'General case' 0 N--CA 1.477 0.88 0 N-CA-C 115.261 1.578 . . . . 0.0 115.261 -174.91 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 21.0 p . . . . . 0 C--O 1.253 1.255 0 C-N-CA 126.775 2.03 . . . . 0.0 113.884 -178.35 . . . . . . . . 0 0 . 1 . 028 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.388 0 N-CA-C 111.728 -0.549 . . . . 0.0 111.728 . . . . . . . . . 0 0 . 1 . 028 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 9.5 tp -104.2 -25.3 3.74 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.306 0 C-N-CA 127.823 2.449 . . . . 0.0 115.407 12.436 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 76.2 t -66.79 -46.07 86.37 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.031 0 N-CA-C 113.406 0.891 . . . . 0.0 113.406 -152.705 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 67.3 mm-40 -69.21 -42.58 75.56 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 118.693 0.679 . . . . 0.0 111.389 177.517 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 17.0 tm0? -61.72 -48.45 80.67 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 123.895 0.878 . . . . 0.0 111.346 -174.49 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 5.0 t -75.66 -12.45 60.2 Favored 'General case' 0 N--CA 1.472 0.646 0 N-CA-C 113.642 0.979 . . . . 0.0 113.642 -179.866 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 25.2 t -87.25 -43.47 12.17 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 124.88 1.272 . . . . 0.0 112.519 177.119 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 74.2 p -86.37 -43.26 13.0 Favored 'General case' 0 N--CA 1.478 0.966 0 C-N-CA 124.408 1.083 . . . . 0.0 112.268 177.952 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 17.5 t -104.52 -149.6 0.41 Allowed 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 125.807 1.643 . . . . 0.0 109.75 169.589 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 27.6 pt -125.94 157.03 36.08 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.728 0 C-N-CA 125.577 1.551 . . . . 0.0 112.286 -178.081 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 17.3 p -143.1 159.66 41.86 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 124.307 1.043 . . . . 0.0 112.157 170.779 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 8.5 t -105.76 162.81 13.22 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 124.885 1.274 . . . . 0.0 112.799 -177.646 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 53.0 mt -58.64 -35.59 72.75 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 124.773 1.229 . . . . 0.0 111.882 179.646 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 69.7 t80 -64.17 -28.58 69.85 Favored 'General case' 0 CA--C 1.547 0.829 0 N-CA-C 113.722 1.008 . . . . 0.0 113.722 173.598 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 75.2 mt-30 -83.32 -33.26 25.96 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 124.269 1.028 . . . . 0.0 110.997 175.495 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 83.2 mt -63.32 -38.14 90.01 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-N 118.576 0.626 . . . . 0.0 111.907 168.858 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 28.8 tt0 -62.23 -23.77 66.85 Favored 'General case' 0 CA--C 1.542 0.651 0 N-CA-C 113.566 0.951 . . . . 0.0 113.566 -179.691 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 29.7 t30 -57.25 -25.92 59.92 Favored 'General case' 0 CA--C 1.549 0.918 0 O-C-N 120.969 -1.082 . . . . 0.0 113.309 173.425 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 97.4 m-85 -96.73 0.84 50.18 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 125.411 1.484 . . . . 0.0 113.735 -175.744 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 61.2 m -67.54 156.49 36.58 Favored 'General case' 0 N--CA 1.474 0.727 0 CA-C-N 119.252 0.933 . . . . 0.0 113.143 175.69 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 22.1 t-20 . . . . . 0 C--O 1.254 1.321 0 C-N-CA 125.877 1.671 . . . . 0.0 112.79 -175.786 . . . . . . . . 0 0 . 1 . 028 nuclear build full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 57.2 m-85 . . . . . 0 N--CA 1.488 1.457 0 CA-C-O 119.07 -0.49 . . . . 0.0 110.76 . . . . . . . . . 0 0 . 1 . 028 nuclear build full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 7.5 p -168.99 134.19 0.4 Allowed 'Isoleucine or valine' 0 N--CA 1.479 0.993 0 C-N-CA 125.539 1.536 . . . . 0.0 110.194 -176.865 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 39.4 p30 -99.6 143.59 29.66 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 124.614 1.166 . . . . 0.0 113.401 179.778 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 39.0 mt-30 -147.48 160.35 42.69 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 125.234 1.413 . . . . 0.0 110.947 -170.22 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 99.3 m-70 -82.18 129.11 34.75 Favored 'General case' 0 CA--C 1.539 0.537 0 N-CA-C 108.156 -1.053 . . . . 0.0 108.156 159.51 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 87.0 mt -145.17 134.18 22.59 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 125.025 1.33 . . . . 0.0 109.211 -176.972 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 4.1 t -151.97 153.82 34.83 Favored 'General case' 0 C--O 1.235 0.342 0 C-N-CA 123.02 0.528 . . . . 0.0 111.786 -174.867 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 49.62 -128.66 24.75 Favored Glycine 0 CA--C 1.53 0.97 0 C-N-CA 125.465 1.507 . . . . 0.0 113.799 175.743 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 18.6 m -58.78 -33.45 70.32 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 124.53 1.132 . . . . 0.0 112.824 -179.136 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 80.8 m-70 -76.78 -26.74 54.81 Favored 'General case' 0 CA--C 1.54 0.578 0 O-C-N 121.073 -1.017 . . . . 0.0 112.875 177.857 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 42.6 tp -72.58 -42.26 64.79 Favored 'General case' 0 N--CA 1.468 0.457 0 O-C-N 121.225 -0.922 . . . . 0.0 111.07 168.28 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 55.8 t -59.28 -41.7 84.88 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.003 0 C-N-CA 123.794 0.838 . . . . 0.0 111.378 172.714 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 43.7 tt0 -62.47 -47.35 84.39 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 125.633 1.573 . . . . 0.0 111.823 173.44 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.25 -44.95 95.38 Favored 'General case' 0 CA--C 1.539 0.541 0 O-C-N 121.927 -0.483 . . . . 0.0 112.245 178.276 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 39.6 mt -55.92 -51.48 67.47 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 124.204 1.002 . . . . 0.0 111.092 173.265 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 68.1 t80 -55.32 -43.66 75.1 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 123.619 0.768 . . . . 0.0 113.058 175.262 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 89.8 mt -74.75 -32.86 62.21 Favored 'General case' 0 N--CA 1.471 0.619 0 N-CA-C 113.595 0.961 . . . . 0.0 113.595 -178.478 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 30.4 t -70.91 -43.58 76.67 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 C-N-CA 123.998 0.919 . . . . 0.0 110.466 173.655 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 76.1 m -81.62 -36.55 28.79 Favored 'General case' 0 CA--C 1.533 0.302 0 N-CA-C 113.533 0.938 . . . . 0.0 113.533 -173.855 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . -50.84 131.89 32.04 Favored Glycine 0 CA--C 1.538 1.521 0 C-N-CA 124.324 0.964 . . . . 0.0 113.37 -168.415 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -80.14 -3.59 49.46 Favored 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 128.468 2.707 . . . . 0.0 115.496 10.908 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 75.3 mtm180 -64.2 155.32 32.17 Favored 'General case' 0 N--CA 1.475 0.798 0 CA-C-N 119.567 1.076 . . . . 0.0 110.708 174.628 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . -78.69 -174.08 43.96 Favored Glycine 0 N--CA 1.471 0.972 0 C-N-CA 124.147 0.88 . . . . 0.0 111.519 169.825 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 45.6 p90 -157.02 155.69 31.64 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 123.882 0.873 . . . . 0.0 112.927 -179.075 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 68.3 t80 -100.33 148.68 24.43 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 125.628 1.571 . . . . 0.0 111.205 173.068 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 66.1 t80 -159.12 138.09 11.15 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 125.524 1.53 . . . . 0.0 111.14 179.797 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 11.5 t -168.22 132.46 1.41 Allowed Pre-proline 0 N--CA 1.476 0.854 0 C-N-CA 126.181 1.792 . . . . 0.0 109.877 173.938 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 91.0 Cg_endo -80.65 155.72 21.08 Favored 'Trans proline' 0 C--N 1.349 0.565 0 C-N-CA 122.735 2.29 . . . . 0.0 112.494 -172.334 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 67.4 mttm 66.18 1.66 2.05 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 126.62 1.968 . . . . 0.0 115.534 172.463 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 88.8 m . . . . . 0 C--O 1.252 1.194 0 C-N-CA 125.992 1.717 . . . . 0.0 110.528 164.016 . . . . . . . . 0 0 . 1 . 029 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.806 0 N-CA-C 111.097 -0.801 . . . . 0.0 111.097 . . . . . . . . . 0 0 . 1 . 029 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 17.6 tt -62.06 -38.62 81.27 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.267 0 CA-C-N 118.722 1.261 . . . . 0.0 114.005 -168.544 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 47.2 t -66.07 -34.19 68.57 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.12 0 C-N-CA 123.467 0.707 . . . . 0.0 111.343 -179.021 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -70.75 -54.94 9.82 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 124.114 0.965 . . . . 0.0 110.099 169.956 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 6.7 tt0 -56.91 -49.08 76.68 Favored 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 123.999 0.919 . . . . 0.0 112.117 -174.121 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 63.7 m -62.33 -28.24 69.61 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 114.006 1.113 . . . . 0.0 114.006 -179.094 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 18.6 t -102.1 -36.39 8.57 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 123.806 0.842 . . . . 0.0 112.763 -171.736 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 92.4 m -82.78 -29.51 29.57 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 126.228 1.811 . . . . 0.0 111.713 175.524 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 9.9 t -135.98 -156.26 0.7 Allowed 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 125.616 1.566 . . . . 0.0 110.697 177.124 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 28.1 mm -93.5 147.35 5.55 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.74 0 C-N-CA 125.408 1.483 . . . . 0.0 109.814 172.047 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 19.1 p -132.73 159.01 40.92 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 123.514 0.726 . . . . 0.0 112.486 163.665 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 53.3 p -100.08 162.72 12.8 Favored 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 113.788 1.033 . . . . 0.0 113.788 -175.22 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 78.4 mt -64.22 -33.54 76.03 Favored 'General case' 0 CA--C 1.536 0.421 0 O-C-N 121.344 -0.848 . . . . 0.0 111.5 172.126 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 87.2 t80 -66.78 -34.01 76.89 Favored 'General case' 0 CA--C 1.544 0.713 0 O-C-N 121.459 -0.776 . . . . 0.0 112.845 173.058 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 78.3 mt-30 -71.38 -37.04 71.61 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 123.556 0.742 . . . . 0.0 111.312 173.36 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 95.6 mt -60.98 -42.68 98.82 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-N 119.144 0.884 . . . . 0.0 111.245 167.346 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 56.6 tt0 -64.75 -31.13 72.22 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 123.353 0.661 . . . . 0.0 112.722 178.495 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 18.6 t-20 -64.2 -22.49 66.96 Favored 'General case' 0 CA--C 1.551 0.987 0 O-C-N 121.044 -1.035 . . . . 0.0 112.846 173.129 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 23.5 m-85 -95.73 0.47 52.52 Favored 'General case' 0 CA--C 1.55 0.958 0 C-N-CA 125.686 1.595 . . . . 0.0 113.338 171.661 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 76.4 m -83.82 161.83 20.79 Favored 'General case' 0 CA--C 1.542 0.639 0 O-C-N 120.649 -1.282 . . . . 0.0 112.133 165.772 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 44.0 t30 . . . . . 0 C--O 1.252 1.195 0 C-N-CA 125.074 1.35 . . . . 0.0 111.661 170.946 . . . . . . . . 0 0 . 1 . 029 nuclear build full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 71.0 t80 . . . . . 0 N--CA 1.488 1.469 0 CA-C-O 119.63 -0.224 . . . . 0.0 110.783 . . . . . . . . . 0 0 . 1 . 029 nuclear build full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 63.8 t -83.07 130.71 35.26 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.935 0 C-N-CA 124.125 0.97 . . . . 0.0 109.943 -178.217 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . 0.316 6.2 p30 69.3 131.09 0.03 OUTLIER 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 129.231 3.012 . . . . 0.0 114.162 -174.953 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 78.1 mt-30 -156.09 168.42 27.33 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 123.734 0.814 . . . . 0.0 113.149 -162.939 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 93.5 m-70 -84.52 134.21 34.43 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 123.628 0.771 . . . . 0.0 109.53 158.173 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 75.4 mt -148.34 131.91 16.78 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 126.277 1.831 . . . . 0.0 109.895 -176.861 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 85.5 m -135.97 144.52 45.44 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 124.992 1.317 . . . . 0.0 110.911 -177.596 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 52.46 -125.21 28.35 Favored Glycine 0 N--CA 1.474 1.199 0 C-N-CA 125.464 1.507 . . . . 0.0 114.248 165.414 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 27.5 m -58.21 -38.46 76.82 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 123.671 0.788 . . . . 0.0 112.296 -179.196 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 17.5 m-70 -72.33 -32.17 66.29 Favored 'General case' 0 CA--C 1.54 0.565 0 O-C-N 121.142 -0.974 . . . . 0.0 112.237 179.253 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 59.2 tp -65.43 -43.6 89.96 Favored 'General case' 0 CA--C 1.534 0.346 0 O-C-N 121.629 -0.669 . . . . 0.0 111.112 168.708 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 55.4 t -62.3 -40.49 88.03 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.942 0 C-N-CA 123.696 0.798 . . . . 0.0 111.661 175.684 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -62.93 -48.14 80.2 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 124.218 1.007 . . . . 0.0 111.613 173.368 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.63 -44.72 96.02 Favored 'General case' 0 CA--C 1.538 0.497 0 O-C-N 121.759 -0.588 . . . . 0.0 112.224 178.709 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 60.7 tp -57.07 -53.37 58.89 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 123.995 0.918 . . . . 0.0 110.571 174.494 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 9.9 m-30 -55.72 -38.62 69.98 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 123.328 0.651 . . . . 0.0 112.514 178.038 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 76.5 mt -71.65 -35.44 70.36 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 124.42 1.088 . . . . 0.0 113.137 177.758 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 55.3 t -70.44 -40.58 77.71 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.055 0 C-N-CA 123.754 0.822 . . . . 0.0 110.972 173.324 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 57.7 m -75.64 -35.52 60.42 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 113.075 0.769 . . . . 0.0 113.075 -178.747 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 59.02 -129.63 49.89 Favored Glycine 0 CA--C 1.532 1.107 0 N-CA-C 111.544 -0.622 . . . . 0.0 111.544 -174.942 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -75.66 -9.92 59.0 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 124.528 1.131 . . . . 0.0 114.035 179.566 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 60.1 mtp180 -65.95 -35.51 80.79 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 123.957 0.903 . . . . 0.0 113.251 -176.009 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 95.46 158.79 32.72 Favored Glycine 0 CA--C 1.532 1.152 0 C-N-CA 125.366 1.46 . . . . 0.0 113.069 -169.714 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 33.0 p90 -122.77 168.12 12.63 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 125.848 1.659 . . . . 0.0 113.117 -173.192 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 80.9 t80 -131.88 138.07 48.29 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 125.823 1.649 . . . . 0.0 109.239 161.057 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 69.6 t80 -154.07 139.1 17.3 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 123.84 0.856 . . . . 0.0 112.493 -175.084 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 10.2 t -173.6 138.77 0.77 Allowed Pre-proline 0 N--CA 1.476 0.871 0 C-N-CA 127.002 2.121 . . . . 0.0 109.639 174.983 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -74.19 136.8 22.74 Favored 'Trans proline' 0 C--N 1.351 0.668 0 C-N-CA 122.942 2.428 . . . . 0.0 110.812 174.669 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 22.4 ptmt -163.88 148.43 10.38 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 124.497 1.119 . . . . 0.0 113.255 -175.236 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 22.6 p . . . . . 0 C--O 1.253 1.274 0 C-N-CA 125.962 1.705 . . . . 0.0 111.048 174.125 . . . . . . . . 0 0 . 1 . 030 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.805 0 N-CA-C 111.419 -0.672 . . . . 0.0 111.419 . . . . . . . . . 0 0 . 1 . 030 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 43.8 pt -58.92 -31.9 46.25 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.131 0 N-CA-C 114.748 1.388 . . . . 0.0 114.748 -164.552 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 11.0 t -61.85 -34.95 65.12 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.996 0 C-N-CA 123.619 0.768 . . . . 0.0 111.08 178.461 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 29.7 mm-40 -79.15 8.88 5.11 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.963 1.305 . . . . 0.0 112.535 178.402 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -115.71 -53.63 2.57 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 124.729 1.212 . . . . 0.0 109.993 162.314 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 11.7 m -65.85 -28.48 69.0 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 115.392 1.627 . . . . 0.0 115.392 -173.954 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 42.6 t -92.86 -45.41 8.0 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-N 118.667 0.667 . . . . 0.0 111.927 -178.12 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 23.1 p -68.76 -35.98 77.75 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 126.806 2.042 . . . . 0.0 112.601 -179.308 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 65.0 m -132.76 -171.43 2.66 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 126.42 1.888 . . . . 0.0 110.775 179.064 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 30.3 mm -75.88 142.27 14.68 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.793 0 O-C-N 120.565 -1.335 . . . . 0.0 110.767 172.341 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 14.1 p -134.15 160.58 37.39 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 123.547 0.739 . . . . 0.0 112.461 158.758 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 37.4 t -101.99 159.79 15.06 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 124.889 1.276 . . . . 0.0 112.523 -178.225 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 40.2 mt -63.35 -30.41 71.55 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 123.594 0.758 . . . . 0.0 111.518 170.685 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 26.6 m-85 -65.6 -28.74 69.35 Favored 'General case' 0 CA--C 1.544 0.714 0 N-CA-C 113.304 0.853 . . . . 0.0 113.304 171.881 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 79.0 mt-30 -78.78 -38.36 38.67 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-O 118.558 -0.734 . . . . 0.0 110.593 172.598 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 42.6 mt -58.01 -37.96 75.27 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 119.099 0.863 . . . . 0.0 111.549 168.708 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 25.4 tt0 -66.37 -31.99 73.1 Favored 'General case' 0 CA--C 1.546 0.818 0 CA-C-N 118.688 0.676 . . . . 0.0 112.65 175.891 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 32.8 t30 -68.2 -23.97 64.89 Favored 'General case' 0 CA--C 1.548 0.892 0 O-C-N 121.043 -1.035 . . . . 0.0 112.685 171.947 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 10.5 m-30 -86.7 -5.7 59.05 Favored 'General case' 0 CA--C 1.549 0.917 0 C-N-CA 125.326 1.45 . . . . 0.0 113.545 177.455 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 58.2 m -65.46 155.47 35.45 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 123.562 0.745 . . . . 0.0 112.342 169.614 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 93.3 m-20 . . . . . 0 C--O 1.256 1.413 0 C-N-CA 124.414 1.086 . . . . 0.0 113.072 178.475 . . . . . . . . 0 0 . 1 . 030 nuclear build full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 42.8 p90 . . . . . 0 N--CA 1.487 1.422 0 N-CA-C 110.678 -0.119 . . . . 0.0 110.678 . . . . . . . . . 0 0 . 1 . 030 nuclear build full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 93.0 t -72.81 130.05 35.75 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.914 0 O-C-N 121.426 -0.797 . . . . 0.0 110.008 -178.811 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 4.1 p30 -151.94 132.25 13.68 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 125.504 1.522 . . . . 0.0 110.406 177.456 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 36.2 mt-30 -153.37 166.17 33.48 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 123.821 0.849 . . . . 0.0 112.36 -159.264 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 51.3 m-70 -81.8 132.3 35.28 Favored 'General case' 0 CA--C 1.542 0.664 0 N-CA-C 108.519 -0.919 . . . . 0.0 108.519 156.298 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 72.5 mt -140.73 126.83 19.56 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 125.698 1.599 . . . . 0.0 109.062 -178.263 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 68.7 m -131.14 143.95 51.02 Favored 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 125.053 1.341 . . . . 0.0 110.986 -173.77 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 56.47 -128.42 46.32 Favored Glycine 0 CA--C 1.528 0.866 0 C-N-CA 124.807 1.194 . . . . 0.0 113.927 166.433 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 23.5 p -61.5 -31.79 71.8 Favored 'General case' 0 N--CA 1.467 0.401 0 C-N-CA 124.482 1.113 . . . . 0.0 112.864 179.742 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 26.5 m80 -69.27 -39.99 78.05 Favored 'General case' 0 CA--C 1.54 0.565 0 O-C-N 121.042 -1.037 . . . . 0.0 111.395 175.792 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 50.5 tp -65.13 -45.28 85.71 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 123.379 0.671 . . . . 0.0 111.226 171.917 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 65.8 t -59.55 -43.02 89.93 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.008 0 C-N-CA 123.265 0.626 . . . . 0.0 111.656 176.381 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -65.01 -47.78 76.24 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 123.776 0.83 . . . . 0.0 111.529 177.214 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.92 -46.78 89.32 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 123.022 0.529 . . . . 0.0 111.653 178.632 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 43.8 tp -59.39 -49.99 75.67 Favored 'General case' 0 CA--C 1.533 0.327 0 C-N-CA 124.783 1.233 . . . . 0.0 111.229 176.981 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 63.2 t80 -55.43 -42.56 74.35 Favored 'General case' 0 CA--C 1.54 0.569 0 N-CA-C 113.122 0.786 . . . . 0.0 113.122 174.158 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 88.0 mt -73.88 -31.52 63.18 Favored 'General case' 0 N--CA 1.469 0.517 0 N-CA-C 113.104 0.779 . . . . 0.0 113.104 -179.324 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 41.1 t -68.65 -45.8 80.86 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.763 0 C-N-CA 123.538 0.735 . . . . 0.0 110.618 171.126 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 76.0 m -76.83 -35.15 57.75 Favored 'General case' 0 N--CA 1.469 0.498 0 N-CA-C 113.232 0.827 . . . . 0.0 113.232 -175.207 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 62.62 -130.82 43.53 Favored Glycine 0 CA--C 1.53 1.019 0 C-N-CA 124.284 0.945 . . . . 0.0 111.182 -175.762 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -64.38 -19.75 65.69 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 124.913 1.285 . . . . 0.0 113.57 179.182 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 83.7 mtm180 -64.2 -31.77 73.1 Favored 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 113.661 0.986 . . . . 0.0 113.661 -176.073 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 75.19 178.87 42.9 Favored Glycine 0 CA--C 1.535 1.284 0 C-N-CA 124.412 1.006 . . . . 0.0 112.852 -172.06 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 51.4 p90 -154.78 166.51 33.24 Favored 'General case' 0 CA--C 1.539 0.554 0 N-CA-C 114.179 1.177 . . . . 0.0 114.179 -170.626 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 83.3 t80 -109.16 144.69 36.9 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 125.826 1.65 . . . . 0.0 110.149 167.06 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 39.5 t80 -154.29 136.18 14.56 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 124.832 1.253 . . . . 0.0 111.765 -174.269 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 9.0 t -177.44 145.7 0.6 Allowed Pre-proline 0 N--CA 1.482 1.141 0 C-N-CA 127.036 2.134 . . . . 0.0 110.699 176.115 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 90.9 Cg_endo -76.33 -33.09 3.54 Favored 'Trans proline' 0 CA--C 1.537 0.665 0 C-N-CA 122.863 2.375 . . . . 0.0 112.251 166.173 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 1.3 tmmt? -163.84 135.58 4.8 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 124.734 1.214 . . . . 0.0 111.925 -168.454 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 8.9 t . . . . . 0 C--O 1.254 1.294 0 C-N-CA 126.829 2.051 . . . . 0.0 111.556 178.618 . . . . . . . . 0 0 . 1 . 031 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 1.272 0 N-CA-C 112.211 -0.356 . . . . 0.0 112.211 . . . . . . . . . 0 0 . 1 . 031 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 22.4 pt -101.72 -36.02 4.45 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.32 0 C-N-CA 127.545 2.338 . . . . 0.0 114.346 -4.868 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 21.5 t -63.43 -32.22 55.8 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.239 0 CA-C-N 119.391 0.996 . . . . 0.0 112.94 -165.834 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -85.65 -48.26 9.04 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 125.157 1.383 . . . . 0.0 111.405 176.529 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 62.9 tt0 -69.7 -43.68 71.95 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 124.582 1.153 . . . . 0.0 112.193 -172.436 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 74.0 m -74.15 -15.68 61.02 Favored 'General case' 0 N--CA 1.464 0.256 0 N-CA-C 113.595 0.961 . . . . 0.0 113.595 -179.763 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 44.6 t -85.22 -52.62 5.79 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 125.519 1.528 . . . . 0.0 111.783 172.283 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 37.4 p -74.14 -44.32 54.12 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 124.693 1.197 . . . . 0.0 112.476 -176.525 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 50.9 m -101.54 -161.25 0.84 Allowed 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 125.415 1.486 . . . . 0.0 109.737 164.596 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 27.3 pt -112.31 151.38 14.3 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.708 0 O-C-N 120.801 -1.187 . . . . 0.0 111.311 175.309 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 69.6 m -131.1 161.25 32.48 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 124.741 1.216 . . . . 0.0 111.83 172.841 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 47.1 p -97.77 165.19 12.07 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 124.548 1.139 . . . . 0.0 113.385 176.555 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 58.0 mt -63.81 -33.13 74.98 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 123.571 0.748 . . . . 0.0 111.988 171.492 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 88.5 t80 -67.35 -33.66 75.69 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 123.663 0.785 . . . . 0.0 112.891 173.644 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 92.2 mt-30 -73.09 -33.81 65.82 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 123.464 0.705 . . . . 0.0 111.751 173.553 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 90.9 mt -64.94 -39.59 93.73 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 118.766 0.712 . . . . 0.0 111.701 166.555 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 29.8 tt0 -64.2 -30.64 71.69 Favored 'General case' 0 CA--C 1.543 0.698 0 N-CA-C 112.822 0.675 . . . . 0.0 112.822 179.748 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 18.4 t-20 -60.35 -21.62 62.3 Favored 'General case' 0 CA--C 1.551 1.014 0 O-C-N 121.177 -0.952 . . . . 0.0 113.362 172.794 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 27.6 m-85 -99.89 4.97 45.37 Favored 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 126.301 1.84 . . . . 0.0 113.89 177.128 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 74.7 m -65.57 150.37 48.53 Favored 'General case' 0 N--CA 1.473 0.682 0 O-C-N 120.65 -1.281 . . . . 0.0 111.877 167.303 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 4.8 t30 . . . . . 0 C--O 1.251 1.158 0 C-N-CA 125.646 1.578 . . . . 0.0 112.028 177.176 . . . . . . . . 0 0 . 1 . 031 nuclear build full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 95.0 m-85 . . . . . 0 N--CA 1.485 1.305 0 CA-C-O 119.657 -0.211 . . . . 0.0 110.846 . . . . . . . . . 0 0 . 1 . 031 nuclear build full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 10.8 p -68.52 140.98 18.1 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.051 0 CA-C-N 118.47 0.577 . . . . 0.0 110.902 173.882 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 4.6 m-80 -116.82 145.01 43.82 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 125.308 1.443 . . . . 0.0 111.312 175.998 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 41.9 mt-30 -146.42 157.49 43.77 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 124.549 1.14 . . . . 0.0 111.423 -174.74 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 81.8 m-70 -79.3 125.76 29.91 Favored 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 108.173 -1.047 . . . . 0.0 108.173 157.513 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 93.2 mt -137.93 121.51 17.33 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 125.187 1.395 . . . . 0.0 109.612 -176.086 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 59.0 m -128.48 138.58 52.35 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 125.136 1.375 . . . . 0.0 110.633 -174.402 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 52.64 -121.59 15.69 Favored Glycine 0 N--CA 1.473 1.13 0 C-N-CA 124.773 1.178 . . . . 0.0 113.484 167.369 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 31.7 p -61.96 -31.73 72.1 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 124.799 1.24 . . . . 0.0 113.293 -179.789 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 93.0 m-70 -69.75 -37.53 76.46 Favored 'General case' 0 CA--C 1.54 0.591 0 O-C-N 120.896 -1.128 . . . . 0.0 111.436 174.748 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 6.9 tt -68.0 -43.44 78.88 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-O 118.581 -0.724 . . . . 0.0 110.98 172.035 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 53.2 t -55.86 -45.56 79.8 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.004 0 CA-C-N 118.985 0.811 . . . . 0.0 111.253 173.647 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 7.1 tp10 -63.21 -46.96 84.56 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 123.573 0.749 . . . . 0.0 111.281 178.002 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.64 -48.14 80.67 Favored 'General case' 0 CA--C 1.537 0.481 0 O-C-N 121.609 -0.682 . . . . 0.0 111.808 178.881 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 44.1 tp -60.2 -46.62 89.09 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 125.356 1.462 . . . . 0.0 111.124 178.726 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 67.5 t80 -57.69 -42.67 84.14 Favored 'General case' 0 CA--C 1.539 0.522 0 N-CA-C 113.012 0.745 . . . . 0.0 113.012 173.481 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 83.6 mt -74.45 -32.43 62.6 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 123.771 0.828 . . . . 0.0 112.784 -179.741 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 25.8 t -66.29 -46.91 85.96 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.884 0 C-N-CA 124.268 1.027 . . . . 0.0 110.456 171.471 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 75.8 m -80.44 -32.55 37.26 Favored 'General case' 0 N--CA 1.467 0.398 0 N-CA-C 113.628 0.973 . . . . 0.0 113.628 -174.345 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 64.3 -134.13 39.29 Favored Glycine 0 CA--C 1.529 0.914 0 C-N-CA 124.167 0.889 . . . . 0.0 111.454 -176.397 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -68.84 -12.08 61.16 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 124.497 1.119 . . . . 0.0 113.956 179.448 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 86.5 mtm180 -65.25 -32.27 73.86 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 124.162 0.985 . . . . 0.0 113.058 179.802 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 79.26 -179.98 52.51 Favored Glycine 0 CA--C 1.533 1.16 0 C-N-CA 124.517 1.056 . . . . 0.0 112.626 -171.329 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 48.3 p90 -151.73 161.45 42.65 Favored 'General case' 0 N--CA 1.468 0.449 0 N-CA-C 114.057 1.132 . . . . 0.0 114.057 -174.645 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 82.7 t80 -105.13 125.74 51.31 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 125.807 1.643 . . . . 0.0 109.216 167.627 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 62.2 t80 -99.15 -32.26 11.33 Favored 'General case' 0 N--CA 1.475 0.814 0 N-CA-C 114.945 1.461 . . . . 0.0 114.945 -170.265 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 24.2 m -60.83 123.7 76.1 Favored Pre-proline 0 N--CA 1.477 0.877 0 C-N-CA 124.557 1.143 . . . . 0.0 111.615 -162.567 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 68.6 Cg_endo -82.31 171.3 12.61 Favored 'Trans proline' 0 C--N 1.351 0.696 0 C-N-CA 123.322 2.681 . . . . 0.0 111.857 -179.457 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 63.5 tttp -59.07 134.27 56.84 Favored 'General case' 0 CA--C 1.551 1.009 0 C-N-CA 124.058 0.943 . . . . 0.0 112.211 167.764 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 29.9 m . . . . . 0 N--CA 1.489 1.503 0 C-N-CA 129.02 2.928 . . . . 0.0 111.739 176.924 . . . . . . . . 0 0 . 1 . 032 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.74 0 N-CA-C 111.218 -0.753 . . . . 0.0 111.218 . . . . . . . . . 0 0 . 1 . 032 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 25.0 pt -61.72 -28.03 43.36 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.158 0 O-C-N 121.335 -1.097 . . . . 0.0 113.673 -167.677 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 37.9 t -65.83 -23.49 32.45 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.898 0 CA-C-N 118.916 0.78 . . . . 0.0 111.819 -177.925 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -77.68 -57.82 3.6 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-N 118.722 0.692 . . . . 0.0 110.201 168.318 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 62.5 tp60 -55.72 -49.83 71.98 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 124.786 1.235 . . . . 0.0 112.76 -174.662 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 89.3 m -62.21 -26.01 68.12 Favored 'General case' 0 N--CA 1.466 0.348 0 C-N-CA 124.644 1.178 . . . . 0.0 113.711 179.295 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 14.0 t -98.4 -39.73 8.64 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 124.278 1.031 . . . . 0.0 112.257 -171.902 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 1.7 t -83.36 -27.61 29.57 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 125.052 1.341 . . . . 0.0 112.828 178.315 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 21.1 t -140.82 -153.23 0.45 Allowed 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 126.277 1.831 . . . . 0.0 108.828 176.583 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 43.6 pt -101.09 156.24 4.4 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.401 0 C-N-CA 123.889 0.876 . . . . 0.0 111.608 175.329 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 18.1 p -140.17 165.95 26.0 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 124.252 1.021 . . . . 0.0 111.898 173.567 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 88.3 p -104.17 155.72 18.48 Favored 'General case' 0 C--O 1.236 0.383 0 C-N-CA 124.291 1.036 . . . . 0.0 112.481 -175.112 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 57.2 mt -59.02 -29.02 66.95 Favored 'General case' 0 CA--C 1.533 0.293 0 O-C-N 121.294 -0.878 . . . . 0.0 112.058 170.557 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 84.4 t80 -67.2 -29.77 69.53 Favored 'General case' 0 CA--C 1.542 0.653 0 N-CA-C 113.648 0.981 . . . . 0.0 113.648 171.648 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 -78.98 -33.0 45.52 Favored 'General case' 0 N--CA 1.468 0.464 0 O-C-N 121.43 -0.794 . . . . 0.0 110.637 174.333 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 10.8 mp -60.89 -44.46 97.08 Favored 'General case' 0 CA--C 1.542 0.658 0 CA-C-N 118.124 0.42 . . . . 0.0 111.076 164.891 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 31.9 tt0 -63.64 -37.17 86.31 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 123.969 0.908 . . . . 0.0 112.492 179.266 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 21.3 t-20 -61.27 -22.85 65.23 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 123.933 0.893 . . . . 0.0 112.955 173.904 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -94.82 -0.94 53.69 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 125.562 1.545 . . . . 0.0 114.01 176.823 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 38.3 m -65.95 140.66 58.33 Favored 'General case' 0 N--CA 1.471 0.597 0 O-C-N 120.657 -1.277 . . . . 0.0 110.731 163.447 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.254 1.303 0 N-CA-C 112.96 0.726 . . . . 0.0 112.96 177.93 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 73.1 m-85 . . . . . 0 N--CA 1.488 1.435 0 N-CA-C 111.222 0.082 . . . . 0.0 111.222 . . . . . . . . . 0 0 . 1 . 032 nuclear build full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 25.1 m -142.72 155.18 17.82 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.113 0 C-N-CA 125.19 1.396 . . . . 0.0 111.52 177.346 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 39.9 m-20 -69.9 151.94 45.07 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 124.759 1.223 . . . . 0.0 111.003 168.047 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 45.0 mt-30 -143.89 159.81 41.9 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 123.723 0.809 . . . . 0.0 112.049 -172.254 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 96.4 m-70 -78.3 133.4 37.64 Favored 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 108.936 -0.765 . . . . 0.0 108.936 155.02 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 93.6 mt -150.53 129.91 12.92 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 125.413 1.485 . . . . 0.0 108.259 -174.6 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 4.1 t -156.82 151.82 26.1 Favored 'General case' 0 N--CA 1.469 0.52 0 O-C-N 121.155 -0.966 . . . . 0.0 112.246 -178.677 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 56.94 -132.16 52.3 Favored Glycine 0 CA--C 1.531 1.033 0 C-N-CA 124.708 1.147 . . . . 0.0 112.698 -179.241 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 25.4 m -61.58 -29.32 69.95 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 124.27 1.028 . . . . 0.0 112.146 -177.615 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 14.9 m80 -68.71 -42.4 77.75 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 124.311 1.044 . . . . 0.0 111.008 178.398 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 51.2 tp -68.7 -44.15 74.56 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-O 118.458 -0.782 . . . . 0.0 110.663 172.806 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 53.7 t -58.57 -40.74 79.94 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.895 0 CA-C-N 119.042 0.837 . . . . 0.0 111.72 177.176 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -66.57 -48.58 69.17 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 123.614 0.766 . . . . 0.0 111.459 175.536 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.51 -44.21 97.47 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-O 121.318 0.58 . . . . 0.0 111.809 179.564 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 40.6 tp -60.95 -46.34 91.11 Favored 'General case' 0 C--N 1.333 -0.124 0 C-N-CA 124.905 1.282 . . . . 0.0 111.058 175.9 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 50.7 t80 -64.59 -26.17 68.29 Favored 'General case' 0 CA--C 1.543 0.691 0 N-CA-C 113.69 0.996 . . . . 0.0 113.69 173.814 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 73.7 mt -75.6 -32.44 60.31 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-N 119.71 1.141 . . . . 0.0 113.087 172.341 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 92.6 t -76.85 -38.9 29.91 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.252 0 C-N-CA 124.163 0.985 . . . . 0.0 111.311 173.237 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 63.5 m -105.58 14.68 28.15 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 126.044 1.738 . . . . 0.0 114.158 -172.566 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . -56.98 -36.71 75.0 Favored Glycine 0 N--CA 1.477 1.413 0 CA-C-N 119.275 0.943 . . . . 0.0 114.958 -168.686 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 4.4 mp0 -77.54 -11.75 59.89 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 124.917 1.287 . . . . 0.0 113.494 175.816 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 24.2 mmm180 -111.45 -53.03 2.74 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 126.225 1.81 . . . . 0.0 113.415 -169.467 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 92.18 162.61 37.44 Favored Glycine 0 CA--C 1.536 1.358 0 C-N-CA 124.706 1.146 . . . . 0.0 111.317 -153.641 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 49.5 p90 -142.02 156.58 45.43 Favored 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 114.403 1.26 . . . . 0.0 114.403 -170.94 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 57.3 t80 -94.27 158.57 15.52 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 127.393 2.277 . . . . 0.0 110.008 165.098 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 53.2 t80 -156.32 125.07 5.92 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 124.223 1.009 . . . . 0.0 111.96 -173.404 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 13.9 t -171.69 146.25 1.83 Allowed Pre-proline 0 N--CA 1.483 1.175 0 C-N-CA 125.794 1.638 . . . . 0.0 112.281 177.612 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 92.9 Cg_endo -81.13 -26.83 3.23 Favored 'Trans proline' 0 C--N 1.35 0.628 0 C-N-CA 123.145 2.563 . . . . 0.0 112.512 166.692 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 10.8 ptmt 174.59 -26.79 0.0 OUTLIER 'General case' 0 N--CA 1.481 1.115 0 C-N-CA 127.563 2.345 . . . . 0.0 113.995 -170.135 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 15.3 m . . . . . 0 C--O 1.254 1.298 0 C-N-CA 126.886 2.074 . . . . 0.0 112.846 178.08 . . . . . . . . 0 0 . 1 . 033 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.738 0 N-CA-C 112.589 -0.204 . . . . 0.0 112.589 . . . . . . . . . 0 0 . 1 . 033 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 25.3 pt -59.53 -42.96 89.72 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.167 0 N-CA-C 114.559 1.318 . . . . 0.0 114.559 -167.817 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 70.6 t -60.44 -27.96 41.17 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.281 0 CA-C-N 119.564 1.074 . . . . 0.0 112.166 -179.913 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 -79.64 -64.52 1.17 Allowed 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 123.594 0.758 . . . . 0.0 109.352 170.347 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 11.1 tt0 -58.69 -47.28 85.06 Favored 'General case' 0 N--CA 1.465 0.29 0 C-N-CA 125.063 1.345 . . . . 0.0 112.442 -168.048 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 87.3 m -64.86 -23.08 67.12 Favored 'General case' 0 C--O 1.234 0.255 0 N-CA-C 113.645 0.98 . . . . 0.0 113.645 -178.526 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 8.4 t -101.98 -31.41 10.68 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 123.49 0.716 . . . . 0.0 112.597 -172.377 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 80.7 p -88.6 -28.16 20.88 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 124.532 1.133 . . . . 0.0 112.9 172.399 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 11.8 t -139.13 -160.05 1.02 Allowed 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 126.492 1.917 . . . . 0.0 109.622 178.495 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 42.6 pt -96.51 156.98 3.3 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.476 0 C-N-CA 124.416 1.086 . . . . 0.0 111.731 176.061 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 18.2 p -147.35 160.55 42.41 Favored 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 124.219 1.008 . . . . 0.0 112.695 175.409 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 50.8 m -109.6 155.41 21.47 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 124.568 1.147 . . . . 0.0 111.774 -174.979 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 33.1 mt -60.41 -31.13 70.09 Favored 'General case' 0 N--CA 1.469 0.48 0 O-C-N 120.949 -1.094 . . . . 0.0 112.078 177.762 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 33.4 m-85 -61.09 -30.16 70.18 Favored 'General case' 0 CA--C 1.542 0.66 0 N-CA-C 113.558 0.947 . . . . 0.0 113.558 171.22 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 96.2 mt-30 -81.78 -34.55 30.28 Favored 'General case' 0 N--CA 1.465 0.294 0 C-N-CA 123.94 0.896 . . . . 0.0 110.298 177.355 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 8.3 mp -62.12 -40.39 95.73 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 118.775 0.716 . . . . 0.0 111.785 166.653 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -59.16 -28.35 66.51 Favored 'General case' 0 CA--C 1.541 0.596 0 C-N-CA 124.587 1.155 . . . . 0.0 113.105 -178.146 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 5.4 m-80 -66.29 -16.33 63.95 Favored 'General case' 0 CA--C 1.546 0.816 0 N-CA-C 113.795 1.035 . . . . 0.0 113.795 175.559 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 72.5 m-85 -102.21 5.2 40.04 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 125.908 1.683 . . . . 0.0 113.458 177.609 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 86.0 m -66.42 153.84 41.74 Favored 'General case' 0 N--CA 1.473 0.701 0 O-C-N 121.018 -1.052 . . . . 0.0 112.422 167.735 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 28.1 t30 . . . . . 0 C--O 1.252 1.203 0 C-N-CA 125.577 1.551 . . . . 0.0 112.185 175.763 . . . . . . . . 0 0 . 1 . 033 nuclear build full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 50.9 p90 . . . . . 0 N--CA 1.488 1.431 0 N-CA-C 110.807 -0.072 . . . . 0.0 110.807 . . . . . . . . . 0 0 . 1 . 033 nuclear build full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 9.0 p -156.64 154.57 6.01 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.052 0 C-N-CA 124.736 1.214 . . . . 0.0 111.473 -177.219 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 10.4 p30 -127.02 148.01 50.12 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 125.617 1.567 . . . . 0.0 111.569 171.973 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 38.7 mt-30 -150.43 167.42 27.17 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 124.444 1.098 . . . . 0.0 111.479 -166.673 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 92.4 m-70 -86.72 136.74 32.9 Favored 'General case' 0 CA--C 1.542 0.671 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 152.675 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 93.3 mt -148.93 136.03 19.99 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 125.582 1.553 . . . . 0.0 109.412 -176.875 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 73.0 m -140.74 145.29 36.23 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 124.742 1.217 . . . . 0.0 110.526 -179.11 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 52.53 -125.71 29.81 Favored Glycine 0 N--CA 1.473 1.135 0 C-N-CA 124.772 1.177 . . . . 0.0 114.503 165.381 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 23.6 m -60.39 -36.92 79.21 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 124.061 0.944 . . . . 0.0 111.941 -177.656 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 27.5 m170 -68.62 -37.93 80.13 Favored 'General case' 0 CA--C 1.54 0.559 0 O-C-N 121.325 -0.86 . . . . 0.0 111.809 178.25 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 9.6 tt -64.14 -45.94 86.29 Favored 'General case' 0 C--O 1.223 -0.305 0 C-N-CA 123.993 0.917 . . . . 0.0 110.796 170.074 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 41.7 t -61.65 -37.18 77.34 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.963 0 C-N-CA 123.602 0.761 . . . . 0.0 111.836 178.4 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -68.31 -45.43 72.99 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 124.022 0.929 . . . . 0.0 111.804 173.364 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.76 -43.67 97.72 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 119.352 0.978 . . . . 0.0 111.756 175.248 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 51.4 tp -61.15 -48.76 80.12 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 125.222 1.409 . . . . 0.0 111.022 177.109 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 46.9 t80 -54.35 -40.02 67.66 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 123.49 0.716 . . . . 0.0 112.659 172.436 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 82.2 mt -74.9 -33.9 62.1 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 123.961 0.904 . . . . 0.0 113.248 178.703 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 40.0 t -65.85 -44.7 92.7 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.924 0 C-N-CA 124.413 1.085 . . . . 0.0 110.98 172.15 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 58.5 m -83.41 -29.81 27.82 Favored 'General case' 0 N--CA 1.469 0.504 0 N-CA-C 113.676 0.991 . . . . 0.0 113.676 -175.087 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 67.61 -144.89 44.63 Favored Glycine 0 CA--C 1.532 1.129 0 C-N-CA 124.224 0.916 . . . . 0.0 112.012 -174.499 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -68.96 -7.42 35.05 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 124.65 1.18 . . . . 0.0 114.139 -178.953 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 80.0 mtt85 -61.31 -31.88 71.74 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 124.733 1.213 . . . . 0.0 113.389 177.049 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 86.34 179.35 49.55 Favored Glycine 0 CA--C 1.533 1.164 0 C-N-CA 125.112 1.339 . . . . 0.0 112.441 -170.654 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 52.6 p90 -159.65 167.32 28.69 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 124.729 1.212 . . . . 0.0 112.833 -173.274 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 81.7 t80 -132.97 96.27 3.74 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 125.999 1.72 . . . . 0.0 108.314 172.209 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 21.6 p90 -73.49 -19.16 61.0 Favored 'General case' 0 CA--C 1.541 0.605 0 N-CA-C 115.029 1.492 . . . . 0.0 115.029 -167.883 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 26.8 m -57.33 126.68 75.18 Favored Pre-proline 0 N--CA 1.473 0.711 0 C-N-CA 125.769 1.627 . . . . 0.0 110.196 -175.408 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 68.4 Cg_endo -74.2 -24.32 14.76 Favored 'Trans proline' 0 C--N 1.349 0.563 0 C-N-CA 123.173 2.582 . . . . 0.0 114.346 -166.649 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 25.4 ttmt -137.01 -2.61 2.07 Favored 'General case' 0 CA--C 1.551 0.982 0 N-CA-C 114.377 1.251 . . . . 0.0 114.377 -165.131 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 23.7 m . . . . . 0 N--CA 1.487 1.414 0 C-N-CA 128.976 2.91 . . . . 0.0 112.67 177.974 . . . . . . . . 0 0 . 1 . 034 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.729 0 CA-C-O 119.293 -0.726 . . . . 0.0 111.467 . . . . . . . . . 0 0 . 1 . 034 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 17.8 tt -60.16 -25.23 32.78 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.274 0 N-CA-C 115.142 1.534 . . . . 0.0 115.142 -167.367 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 74.7 t -52.87 -39.42 31.69 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.041 0 CA-C-N 119.447 1.021 . . . . 0.0 111.396 170.884 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 18.8 tt0 -79.17 0.89 26.49 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 123.642 0.777 . . . . 0.0 113.027 -179.519 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 6.7 tp60 -104.54 -63.05 1.25 Allowed 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 124.458 1.103 . . . . 0.0 109.643 166.032 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 64.5 m -66.19 -26.18 67.28 Favored 'General case' 0 N--CA 1.467 0.424 0 N-CA-C 115.151 1.537 . . . . 0.0 115.151 -170.152 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 12.1 t -87.61 -33.36 18.88 Favored 'General case' 0 N--CA 1.471 0.585 0 O-C-N 121.708 -0.62 . . . . 0.0 112.594 -172.117 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 20.7 p -105.69 -35.29 7.44 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 126.29 1.836 . . . . 0.0 112.826 -175.806 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.1 t -112.18 -171.79 1.92 Allowed 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 125.48 1.512 . . . . 0.0 110.31 169.579 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 11.1 tt -92.83 146.72 6.03 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.686 0 C-N-CA 124.807 1.243 . . . . 0.0 110.329 173.624 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 27.2 p -133.56 158.21 43.73 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-O 121.805 0.812 . . . . 0.0 112.448 175.285 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 83.8 p -104.78 158.29 16.62 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 125.006 1.322 . . . . 0.0 111.939 -179.802 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 55.8 mt -60.16 -30.29 69.22 Favored 'General case' 0 N--CA 1.466 0.34 0 O-C-N 121.083 -1.011 . . . . 0.0 111.927 173.87 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 76.9 t80 -65.7 -31.98 73.29 Favored 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 113.398 0.888 . . . . 0.0 113.398 171.249 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 40.5 mt-30 -73.73 -36.84 65.22 Favored 'General case' 0 N--CA 1.468 0.458 0 O-C-N 121.5 -0.75 . . . . 0.0 110.483 173.144 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 7.0 mp -61.59 -40.12 93.64 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-N 118.608 0.64 . . . . 0.0 111.603 168.992 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 27.5 tt0 -68.51 -32.41 72.35 Favored 'General case' 0 CA--C 1.544 0.737 0 N-CA-C 112.786 0.661 . . . . 0.0 112.786 178.83 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 6.3 m-80 -66.21 -15.11 62.89 Favored 'General case' 0 CA--C 1.549 0.936 0 O-C-N 120.914 -1.116 . . . . 0.0 112.976 171.05 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 14.0 m-85 -97.75 1.33 48.32 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 125.889 1.676 . . . . 0.0 113.639 172.381 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 39.4 m -65.41 146.68 54.59 Favored 'General case' 0 CA--C 1.546 0.789 0 CA-C-N 119.93 1.241 . . . . 0.0 110.794 162.144 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.252 1.196 0 C-N-CA 123.713 0.805 . . . . 0.0 112.974 174.949 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 63.7 m-85 . . . . . 0 N--CA 1.487 1.384 0 CA-C-O 119.64 -0.219 . . . . 0.0 111.167 . . . . . . . . . 0 0 . 1 . 034 nuclear build full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 22.0 m -141.79 152.07 18.98 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.104 0 C-N-CA 125.096 1.358 . . . . 0.0 111.842 177.292 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 65.4 m-20 -80.52 150.23 29.71 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 125.071 1.348 . . . . 0.0 110.426 169.836 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 41.9 mt-30 -146.03 159.29 43.47 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 123.575 0.75 . . . . 0.0 112.02 -166.908 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 99.0 m-70 -86.13 133.24 33.88 Favored 'General case' 0 CA--C 1.54 0.576 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 154.772 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 96.3 mt -146.66 135.52 22.33 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 125.375 1.47 . . . . 0.0 108.668 -172.007 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 4.2 t -160.45 154.8 23.46 Favored 'General case' 0 N--CA 1.466 0.348 0 O-C-N 121.538 -0.726 . . . . 0.0 111.99 -175.584 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 62.97 -139.61 44.92 Favored Glycine 0 N--CA 1.47 0.943 0 C-N-CA 123.969 0.795 . . . . 0.0 112.691 -178.845 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 23.9 p -61.83 -29.09 69.94 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 124.675 1.19 . . . . 0.0 112.411 179.64 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 15.7 m80 -62.6 -42.09 99.36 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 124.311 1.044 . . . . 0.0 111.939 176.668 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 40.4 tp -71.72 -40.0 69.75 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 123.628 0.771 . . . . 0.0 111.432 175.299 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 88.1 t -58.5 -43.19 86.37 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.202 0 C-N-CA 123.094 0.558 . . . . 0.0 111.406 173.31 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -67.31 -43.41 81.75 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 124.291 1.037 . . . . 0.0 111.752 176.443 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.36 -44.49 97.08 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 122.942 0.497 . . . . 0.0 111.671 177.14 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 34.9 mt -60.43 -46.59 89.48 Favored 'General case' 0 N--CA 1.467 0.407 0 C-N-CA 124.046 0.938 . . . . 0.0 111.084 174.408 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 84.2 t80 -56.56 -39.57 73.68 Favored 'General case' 0 CA--C 1.543 0.705 0 CA-C-N 118.725 0.693 . . . . 0.0 112.75 174.263 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 89.8 mt -77.62 -36.01 52.12 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 124.074 0.949 . . . . 0.0 113.47 179.805 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 41.1 t -69.14 -44.46 80.86 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.921 0 C-N-CA 124.036 0.934 . . . . 0.0 110.741 174.571 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 75.0 m -85.72 -30.75 22.88 Favored 'General case' 0 N--CA 1.47 0.531 0 N-CA-C 113.374 0.879 . . . . 0.0 113.374 -173.205 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 63.49 -132.08 41.42 Favored Glycine 0 CA--C 1.531 1.046 0 C-N-CA 123.975 0.797 . . . . 0.0 111.377 -177.508 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -69.74 -11.72 61.07 Favored 'General case' 0 CA--C 1.547 0.849 0 N-CA-C 113.8 1.037 . . . . 0.0 113.8 179.797 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 83.8 mtm180 -64.73 -37.45 87.65 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-N 119.13 0.877 . . . . 0.0 112.898 -179.459 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 83.07 169.68 45.02 Favored Glycine 0 CA--C 1.534 1.269 0 C-N-CA 124.513 1.054 . . . . 0.0 112.822 -170.356 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 53.5 p90 -153.34 160.61 42.72 Favored 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 114.198 1.184 . . . . 0.0 114.198 -170.398 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 46.0 t80 -101.42 154.51 18.75 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 126.317 1.847 . . . . 0.0 110.219 164.59 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 47.9 t80 -143.11 -35.14 0.41 Allowed 'General case' 0 CA--C 1.543 0.707 0 N-CA-C 114.604 1.335 . . . . 0.0 114.604 -172.029 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 11.6 m -51.89 138.49 33.85 Favored Pre-proline 0 N--CA 1.478 0.944 0 C-N-CA 126.338 1.855 . . . . 0.0 112.912 -163.742 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_exo -57.82 166.43 5.24 Favored 'Trans proline' 0 C--N 1.351 0.684 0 C-N-CA 124.07 3.18 . . . . 0.0 113.861 173.566 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -64.75 -39.56 93.83 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 123.693 0.797 . . . . 0.0 111.994 171.928 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 34.0 m . . . . . 0 N--CA 1.488 1.462 0 C-N-CA 129.669 3.188 . . . . 0.0 111.79 178.172 . . . . . . . . 0 0 . 1 . 035 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.663 0 N-CA-C 112.57 -0.212 . . . . 0.0 112.57 . . . . . . . . . 0 0 . 1 . 035 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 10.5 tp -126.3 -32.98 0.91 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.233 0 C-N-CA 127.615 2.366 . . . . 0.0 114.185 1.938 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 54.7 t -60.74 -59.85 3.56 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.27 0 CA-C-N 120.178 1.353 . . . . 0.0 112.553 -170.611 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -71.42 -33.68 69.63 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 118.187 0.449 . . . . 0.0 111.354 -178.873 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 18.1 tt0 -59.66 -56.89 16.26 Favored 'General case' 0 N--CA 1.466 0.334 0 C-N-CA 123.411 0.684 . . . . 0.0 110.987 177.948 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 2.1 t -73.45 -15.9 61.32 Favored 'General case' 0 N--CA 1.469 0.515 0 N-CA-C 113.547 0.943 . . . . 0.0 113.547 -174.276 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 26.2 t -90.29 -35.41 15.29 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 123.853 0.861 . . . . 0.0 112.999 178.634 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 76.8 p -95.58 -37.03 11.03 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 124.417 1.087 . . . . 0.0 113.097 177.833 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 17.7 t -113.46 -147.54 0.42 Allowed 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 126.923 2.089 . . . . 0.0 108.74 168.075 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 44.5 pt -118.01 168.49 9.86 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 C-N-CA 125.113 1.365 . . . . 0.0 112.616 -179.767 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 20.1 p -147.44 159.09 44.11 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 124.501 1.121 . . . . 0.0 111.661 166.663 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 88.6 p -96.17 162.12 13.67 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 125.142 1.377 . . . . 0.0 112.43 174.822 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 57.5 mt -60.42 -34.2 73.61 Favored 'General case' 0 N--CA 1.468 0.464 0 O-C-N 121.391 -0.818 . . . . 0.0 111.535 173.292 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 79.9 m-85 -65.6 -34.04 77.3 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 123.81 0.844 . . . . 0.0 113.014 173.028 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 45.2 mt-30 -72.28 -35.88 68.82 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-O 118.468 -0.777 . . . . 0.0 111.98 171.718 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 68.5 mt -58.57 -46.4 86.99 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 119.143 0.883 . . . . 0.0 110.949 169.276 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 22.5 tt0 -69.53 -27.34 65.08 Favored 'General case' 0 CA--C 1.541 0.597 0 N-CA-C 113.307 0.855 . . . . 0.0 113.307 -178.251 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.7 m-80 -62.65 -22.42 66.43 Favored 'General case' 0 CA--C 1.546 0.791 0 O-C-N 120.954 -1.091 . . . . 0.0 113.504 176.579 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 62.6 m-85 -99.91 0.81 41.99 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 125.169 1.388 . . . . 0.0 113.709 174.231 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 89.7 m -83.79 166.56 17.88 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 124.197 0.999 . . . . 0.0 113.188 171.838 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 32.3 m120 . . . . . 0 C--O 1.254 1.316 0 C-N-CA 124.771 1.228 . . . . 0.0 112.287 174.113 . . . . . . . . 0 0 . 1 . 035 nuclear build full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 77.6 m-85 . . . . . 0 N--CA 1.486 1.363 0 N-CA-C 111.286 0.106 . . . . 0.0 111.286 . . . . . . . . . 0 0 . 1 . 035 nuclear build full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 15.9 m -139.61 36.99 0.43 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.367 0 C-N-CA 126.052 1.741 . . . . 0.0 111.134 177.329 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 8.1 p-10 -165.8 147.1 7.0 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 125.723 1.609 . . . . 0.0 112.745 -157.381 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 41.7 mt-30 -152.14 169.16 23.11 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 125.11 1.364 . . . . 0.0 111.885 -169.29 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 98.4 m-70 -88.17 135.35 33.48 Favored 'General case' 0 CA--C 1.542 0.673 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 150.276 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 86.6 mt -145.09 132.28 20.49 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 125.063 1.345 . . . . 0.0 110.53 -179.055 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 63.6 m -131.51 141.87 49.83 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 125.568 1.547 . . . . 0.0 110.295 178.097 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 51.57 -120.26 9.83 Favored Glycine 0 N--CA 1.475 1.28 0 C-N-CA 124.843 1.211 . . . . 0.0 114.372 165.543 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 29.3 m -60.13 -33.8 72.64 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 124.234 1.014 . . . . 0.0 112.627 -177.742 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 97.1 m-70 -72.16 -38.21 69.21 Favored 'General case' 0 CA--C 1.54 0.574 0 O-C-N 121.324 -0.86 . . . . 0.0 111.324 177.554 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 62.6 tp -65.13 -45.34 85.45 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 123.718 0.807 . . . . 0.0 111.126 172.392 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 27.5 t -60.38 -41.69 88.21 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.898 0 C-N-CA 124.246 1.018 . . . . 0.0 111.771 175.61 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -63.77 -47.41 81.07 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 123.631 0.772 . . . . 0.0 111.423 174.498 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.49 -43.87 97.75 Favored 'General case' 0 CA--C 1.541 0.62 0 O-C-N 121.691 -0.631 . . . . 0.0 112.477 179.549 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 25.5 mt -54.27 -50.93 66.1 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 124.45 1.1 . . . . 0.0 110.913 172.354 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 57.7 t80 -63.75 -33.06 74.82 Favored 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 113.463 0.912 . . . . 0.0 113.463 176.9 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 74.5 mt -74.69 -36.28 62.75 Favored 'General case' 0 N--CA 1.472 0.631 0 O-C-N 121.044 -1.035 . . . . 0.0 113.175 177.394 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 53.2 t -71.72 -43.44 70.18 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.875 0 C-N-CA 123.762 0.825 . . . . 0.0 111.066 175.709 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 65.1 m -104.72 -17.77 14.52 Favored 'General case' 0 N--CA 1.475 0.783 0 N-CA-C 114.467 1.284 . . . . 0.0 114.467 -166.593 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 67.72 -155.57 52.87 Favored Glycine 0 CA--C 1.531 1.081 0 C-N-CA 124.927 1.251 . . . . 0.0 113.18 179.642 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -71.83 -1.75 15.28 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 124.526 1.13 . . . . 0.0 113.297 175.606 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 29.1 ttp180 -60.83 -26.21 67.16 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 125.45 1.5 . . . . 0.0 112.886 176.531 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 111.5 139.52 7.9 Favored Glycine 0 CA--C 1.53 1.001 0 C-N-CA 126.392 1.949 . . . . 0.0 112.863 177.093 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 40.9 p90 -144.07 166.92 23.63 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 125.671 1.589 . . . . 0.0 112.167 -176.647 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 44.5 t80 -153.38 141.67 20.56 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-O 121.74 0.781 . . . . 0.0 112.564 169.588 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 19.4 p90 -88.58 80.69 7.27 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 126.626 1.97 . . . . 0.0 110.597 175.558 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 55.8 m -62.5 122.0 70.79 Favored Pre-proline 0 N--CA 1.478 0.966 0 C-N-CA 125.678 1.591 . . . . 0.0 112.229 -176.09 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 66.4 Cg_endo -80.06 169.36 17.81 Favored 'Trans proline' 0 CA--C 1.537 0.65 0 C-N-CA 124.128 3.219 . . . . 0.0 111.7 176.097 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 33.7 ttmt -66.27 140.26 58.12 Favored 'General case' 0 CA--C 1.549 0.917 0 C-N-CA 123.694 0.798 . . . . 0.0 112.041 172.446 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 18.8 m . . . . . 0 C--O 1.253 1.275 0 C-N-CA 126.278 1.831 . . . . 0.0 112.889 -178.336 . . . . . . . . 0 0 . 1 . 036 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.67 0 N-CA-C 112.52 -0.232 . . . . 0.0 112.52 . . . . . . . . . 0 0 . 1 . 036 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 20.1 pt -63.11 -37.34 79.13 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.249 0 N-CA-C 115.086 1.513 . . . . 0.0 115.086 -163.973 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 85.2 t -63.99 -35.87 74.92 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.259 0 CA-C-N 118.952 0.796 . . . . 0.0 110.909 176.102 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -74.04 -47.81 34.29 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 123.097 0.559 . . . . 0.0 110.102 176.379 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 13.3 tm0? -58.74 -47.07 85.9 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 124.499 1.12 . . . . 0.0 111.693 -177.409 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 12.4 m -59.15 -23.89 62.56 Favored 'General case' 0 N--CA 1.47 0.525 0 N-CA-C 113.727 1.01 . . . . 0.0 113.727 174.988 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 49.4 t -98.13 -49.23 4.81 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 124.97 1.308 . . . . 0.0 113.324 -172.191 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 77.0 p -79.04 -36.11 41.57 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 124.641 1.176 . . . . 0.0 112.087 -179.662 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 13.2 t -106.77 -154.68 0.53 Allowed 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 125.554 1.542 . . . . 0.0 109.319 164.438 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 26.7 pt -117.29 155.6 18.88 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.624 0 C-N-CA 125.704 1.602 . . . . 0.0 111.474 178.036 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 16.1 p -145.87 162.32 38.0 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 124.041 0.936 . . . . 0.0 111.935 171.772 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 32.6 t -101.85 156.27 17.62 Favored 'General case' 0 N--CA 1.465 0.318 0 C-N-CA 124.071 0.948 . . . . 0.0 112.74 -173.383 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 55.5 mt -59.56 -31.95 69.9 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 124.178 0.991 . . . . 0.0 111.461 174.192 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 3.5 m-30 -67.62 -25.26 65.66 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 124.307 1.043 . . . . 0.0 112.727 173.703 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 89.2 mt-30 -88.41 -31.04 19.03 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 124.405 1.082 . . . . 0.0 110.527 178.505 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 10.9 mp -57.28 -52.65 64.48 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 122.964 0.506 . . . . 0.0 110.578 161.694 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 5.6 tm-20 -58.95 -29.51 67.19 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 124.956 1.303 . . . . 0.0 113.413 -173.971 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 22.3 t30 -51.76 -30.01 21.04 Favored 'General case' 0 CA--C 1.549 0.918 0 C-N-CA 124.934 1.293 . . . . 0.0 114.29 175.087 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 95.2 m-85 -94.79 0.45 54.93 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 125.347 1.459 . . . . 0.0 113.993 -177.343 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 75.3 m -87.36 160.87 18.21 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 124.303 1.041 . . . . 0.0 113.409 177.77 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.253 1.242 0 C-N-CA 124.785 1.234 . . . . 0.0 112.62 179.913 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 94.4 m-85 . . . . . 0 N--CA 1.486 1.349 0 CA-C-O 119.089 -0.481 . . . . 0.0 110.755 . . . . . . . . . 0 0 . 1 . 036 nuclear build full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 7.2 p -165.75 121.89 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.046 0 C-N-CA 125.189 1.396 . . . . 0.0 109.522 171.344 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 40.3 m-80 -99.92 145.66 27.55 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 124.567 1.147 . . . . 0.0 113.331 -168.512 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 36.9 mt-30 -145.57 164.19 32.45 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 125.69 1.596 . . . . 0.0 110.552 177.656 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 98.9 m-70 -81.45 128.98 34.45 Favored 'General case' 0 CA--C 1.538 0.5 0 N-CA-C 108.711 -0.848 . . . . 0.0 108.711 157.889 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 89.9 mt -142.24 124.69 15.7 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 125.498 1.519 . . . . 0.0 109.169 -176.302 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 61.5 m -127.67 137.55 52.54 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 124.256 1.022 . . . . 0.0 111.251 -173.646 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 45.59 -118.85 3.25 Favored Glycine 0 N--CA 1.472 1.075 0 C-N-CA 126.04 1.781 . . . . 0.0 114.708 165.404 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 19.1 m -60.0 -33.11 71.54 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 124.33 1.052 . . . . 0.0 112.693 -178.655 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 83.0 m-70 -78.77 -29.91 45.34 Favored 'General case' 0 CA--C 1.543 0.686 0 O-C-N 121.083 -1.01 . . . . 0.0 112.659 176.885 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 54.4 tp -65.48 -45.44 83.64 Favored 'General case' 0 N--CA 1.47 0.571 0 O-C-N 121.444 -0.785 . . . . 0.0 110.991 167.909 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 77.1 t -65.89 -35.02 74.12 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.022 0 C-N-CA 123.869 0.868 . . . . 0.0 111.934 175.95 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -63.87 -50.4 68.95 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 124.799 1.239 . . . . 0.0 111.569 171.623 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -58.76 -43.55 90.36 Favored 'General case' 0 CA--C 1.54 0.567 0 O-C-N 121.895 -0.503 . . . . 0.0 111.594 176.564 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 52.9 tp -58.8 -47.74 83.71 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 124.818 1.247 . . . . 0.0 111.677 177.23 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 89.7 t80 -59.27 -40.46 86.12 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 123.613 0.765 . . . . 0.0 112.452 173.119 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 90.0 mt -75.61 -35.22 60.58 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 124.113 0.965 . . . . 0.0 113.314 -178.156 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 41.4 t -65.24 -44.22 95.16 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.958 0 C-N-CA 124.378 1.071 . . . . 0.0 110.303 174.406 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 74.4 m -98.77 -17.72 18.35 Favored 'General case' 0 N--CA 1.471 0.611 0 N-CA-C 115.094 1.516 . . . . 0.0 115.094 -169.838 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 65.14 -138.79 39.42 Favored Glycine 0 CA--C 1.53 1.016 0 C-N-CA 124.81 1.195 . . . . 0.0 113.019 176.79 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -63.07 -19.66 64.61 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 125.524 1.53 . . . . 0.0 113.553 -176.392 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 50.8 mtm180 -61.47 -36.69 81.16 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 124.042 0.937 . . . . 0.0 113.151 -178.584 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.57 -176.45 42.24 Favored Glycine 0 CA--C 1.533 1.212 0 C-N-CA 123.992 0.806 . . . . 0.0 113.565 -178.17 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 37.9 p90 -156.89 169.98 23.54 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 125.332 1.453 . . . . 0.0 113.121 -168.362 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 89.1 t80 -126.99 133.19 50.61 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 125.124 1.37 . . . . 0.0 109.051 161.577 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -152.28 141.01 20.93 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 123.512 0.725 . . . . 0.0 112.261 -171.53 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 31.1 p -142.41 155.47 64.21 Favored Pre-proline 0 N--CA 1.475 0.776 0 C-N-CA 125.88 1.672 . . . . 0.0 110.792 -174.952 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 88.9 Cg_endo -75.88 -21.67 14.05 Favored 'Trans proline' 0 C--N 1.35 0.644 0 C-N-CA 123.026 2.484 . . . . 0.0 113.09 176.578 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 40.4 ttmt -153.87 143.74 21.9 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 125.597 1.559 . . . . 0.0 110.948 -175.952 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 9.2 t . . . . . 0 C--O 1.253 1.259 0 C-N-CA 126.637 1.975 . . . . 0.0 111.413 -176.33 . . . . . . . . 0 0 . 1 . 037 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.797 0 N-CA-C 111.343 -0.703 . . . . 0.0 111.343 . . . . . . . . . 0 0 . 1 . 037 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 13.3 tt -60.42 -29.67 44.87 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.255 0 N-CA-C 114.555 1.317 . . . . 0.0 114.555 -169.069 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 55.4 t -68.61 -25.62 31.25 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.056 0 CA-C-N 119.026 0.83 . . . . 0.0 111.917 179.62 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 78.5 mt-10 -86.66 -48.06 8.62 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-N 118.946 0.794 . . . . 0.0 111.047 168.72 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 61.8 tp60 -60.46 -44.32 95.99 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 123.144 0.578 . . . . 0.0 112.176 -175.162 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -79.59 -19.61 48.91 Favored 'General case' 0 CA--C 1.536 0.408 0 N-CA-C 113.641 0.978 . . . . 0.0 113.641 -177.128 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 48.3 t -100.54 -55.46 2.59 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 124.212 1.005 . . . . 0.0 113.002 -174.706 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 50.7 m -76.17 -42.99 44.78 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 125.45 1.5 . . . . 0.0 110.217 -177.244 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 16.4 t -99.98 -150.92 0.39 Allowed 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 123.725 0.81 . . . . 0.0 109.266 158.468 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 34.9 pt -120.99 158.24 23.66 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.675 0 C-N-CA 125.402 1.481 . . . . 0.0 112.078 179.056 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -148.78 165.8 30.35 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-O 121.974 0.892 . . . . 0.0 113.035 166.411 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 16.6 t -109.81 166.97 10.5 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 123.986 0.914 . . . . 0.0 112.182 -175.717 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 49.1 mt -57.26 -31.85 66.0 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 124.575 1.15 . . . . 0.0 111.705 174.817 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 27.7 m-85 -59.66 -33.54 71.68 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.215 1.006 . . . . 0.0 113.576 171.334 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 20.7 mm100 -82.05 -32.64 30.31 Favored 'General case' 0 N--CA 1.468 0.428 0 C-N-CA 124.483 1.113 . . . . 0.0 111.069 177.472 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 73.4 mt -60.66 -43.13 97.98 Favored 'General case' 0 CA--C 1.542 0.636 0 CA-C-N 118.418 0.554 . . . . 0.0 110.603 167.78 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -65.33 -35.93 82.48 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 123.85 0.86 . . . . 0.0 112.309 174.058 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 21.6 t-20 -63.77 -29.34 70.56 Favored 'General case' 0 CA--C 1.548 0.884 0 O-C-N 120.801 -1.187 . . . . 0.0 113.065 176.964 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 4.9 m-85 -83.01 -0.84 50.74 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 125.074 1.35 . . . . 0.0 113.891 172.349 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 8.1 t -82.07 164.9 21.06 Favored 'General case' 0 CA--C 1.54 0.589 0 O-C-N 120.873 -1.142 . . . . 0.0 113.479 175.422 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 38.3 m-80 . . . . . 0 C--O 1.25 1.088 0 C-N-CA 124.81 1.244 . . . . 0.0 111.206 167.426 . . . . . . . . 0 0 . 1 . 037 nuclear build full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 80.2 m-85 . . . . . 0 N--CA 1.487 1.419 0 CA-C-O 119.359 -0.353 . . . . 0.0 110.388 . . . . . . . . . 0 0 . 1 . 037 nuclear build full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 12.9 m -147.19 144.28 19.8 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.205 0 C-N-CA 124.984 1.313 . . . . 0.0 111.994 -176.873 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 60.9 t-20 -100.76 131.7 46.52 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 126.178 1.791 . . . . 0.0 109.653 170.503 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 26.7 mm-40 -150.83 161.37 42.8 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 124.475 1.11 . . . . 0.0 113.207 -160.897 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 85.5 m-70 -80.47 123.79 28.36 Favored 'General case' 0 CA--C 1.542 0.636 0 N-CA-C 108.786 -0.82 . . . . 0.0 108.786 156.944 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 91.1 mt -138.67 127.46 23.6 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 126.133 1.773 . . . . 0.0 108.878 178.368 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 73.5 m -132.41 143.87 50.11 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 124.961 1.304 . . . . 0.0 111.066 -173.566 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 52.78 -123.77 24.85 Favored Glycine 0 N--CA 1.471 0.997 0 C-N-CA 124.907 1.242 . . . . 0.0 113.776 166.302 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 20.3 m -61.25 -33.01 72.81 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 123.958 0.903 . . . . 0.0 112.702 -179.063 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 99.5 m-70 -73.52 -35.46 65.58 Favored 'General case' 0 CA--C 1.54 0.568 0 O-C-N 121.196 -0.94 . . . . 0.0 111.81 176.65 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 56.5 tp -64.5 -46.97 80.7 Favored 'General case' 0 N--CA 1.466 0.326 0 C-N-CA 123.332 0.653 . . . . 0.0 110.706 170.509 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 76.5 t -60.77 -41.15 87.36 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 C-N-CA 123.296 0.638 . . . . 0.0 111.515 176.063 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 42.9 tt0 -63.34 -48.34 78.39 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 123.575 0.75 . . . . 0.0 111.434 177.253 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.12 -45.75 92.1 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 123.069 0.548 . . . . 0.0 111.887 177.923 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 37.2 tp -60.43 -43.68 96.53 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 125.056 1.343 . . . . 0.0 111.436 178.454 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 68.8 t80 -64.76 -34.05 77.42 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 124.079 0.952 . . . . 0.0 113.328 172.381 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 65.8 mt -74.13 -31.93 62.96 Favored 'General case' 0 N--CA 1.472 0.626 0 O-C-N 121.044 -1.035 . . . . 0.0 113.142 176.317 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 79.4 t -72.96 -44.03 58.12 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.039 0 CA-C-N 118.367 0.531 . . . . 0.0 111.135 172.6 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -148.27 11.05 0.9 Allowed 'General case' 0 N--CA 1.473 0.705 0 N-CA-C 117.065 2.246 . . . . 0.0 117.065 -161.744 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . -63.76 -23.83 67.62 Favored Glycine 0 N--CA 1.476 1.317 0 O-C-N 120.803 -1.186 . . . . 0.0 115.46 -171.86 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -73.96 -22.51 59.62 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-N 118.255 1.028 . . . . 0.0 113.755 173.436 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 29.4 mtp180 -94.09 -37.08 11.8 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 125.486 1.514 . . . . 0.0 111.835 172.99 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 94.13 142.15 11.98 Favored Glycine 0 CA--C 1.527 0.844 0 C-N-CA 126.051 1.786 . . . . 0.0 112.851 176.707 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 25.9 p90 -127.13 159.76 33.26 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 125.115 1.366 . . . . 0.0 114.221 -166.909 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 40.3 t80 -90.04 159.07 17.03 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 126.024 1.73 . . . . 0.0 110.555 164.523 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 64.9 t80 -161.7 126.54 3.44 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 125.221 1.408 . . . . 0.0 111.056 -171.174 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 14.4 t -170.01 148.1 3.01 Favored Pre-proline 0 N--CA 1.482 1.142 0 C-N-CA 125.109 1.363 . . . . 0.0 112.601 -176.879 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_endo -78.3 -26.42 6.22 Favored 'Trans proline' 0 C--N 1.35 0.632 0 C-N-CA 123.254 2.636 . . . . 0.0 112.852 163.881 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -119.48 125.79 49.73 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.415 1.086 . . . . 0.0 112.148 -163.777 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 10.3 m . . . . . 0 C--O 1.254 1.292 0 C-N-CA 125.581 1.553 . . . . 0.0 112.407 -173.865 . . . . . . . . 0 0 . 1 . 038 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.824 0 N-CA-C 110.939 -0.864 . . . . 0.0 110.939 . . . . . . . . . 0 0 . 1 . 038 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 36.7 pt -65.53 -20.36 27.29 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.272 0 N-CA-C 115.353 1.612 . . . . 0.0 115.353 -161.847 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 20.4 t -54.71 -36.7 37.33 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.262 0 C-N-CA 123.932 0.893 . . . . 0.0 110.746 169.494 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -71.6 -13.96 61.93 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 123.653 0.781 . . . . 0.0 112.796 -178.476 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 53.6 tp60 -85.63 -77.69 0.29 Allowed 'General case' 0 C--O 1.226 -0.176 0 N-CA-C 108.082 -1.081 . . . . 0.0 108.082 156.193 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 64.3 m -55.3 -27.1 44.55 Favored 'General case' 0 N--CA 1.472 0.66 0 N-CA-C 115.794 1.776 . . . . 0.0 115.794 -159.844 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 11.0 t -90.78 -23.34 20.67 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 123.929 0.891 . . . . 0.0 112.565 -176.84 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 32.3 m -107.11 -28.15 10.16 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 126.702 2.001 . . . . 0.0 112.224 -175.029 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 16.1 t -147.89 168.46 22.17 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 126.094 1.758 . . . . 0.0 110.36 172.222 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 34.6 pt -68.65 150.16 10.9 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.708 0 O-C-N 120.379 -1.451 . . . . 0.0 113.569 -170.582 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 14.8 p -147.31 163.06 37.61 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 124.783 1.233 . . . . 0.0 112.334 174.384 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 48.7 m -120.08 155.05 33.76 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 124.082 0.953 . . . . 0.0 113.089 -171.366 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 46.8 mt -60.99 -33.52 73.37 Favored 'General case' 0 N--CA 1.471 0.594 0 O-C-N 121.256 -0.903 . . . . 0.0 112.137 177.361 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 83.7 t80 -62.44 -27.0 68.81 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 124.09 0.956 . . . . 0.0 113.519 172.643 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 91.6 mt-30 -81.12 -40.61 23.78 Favored 'General case' 0 N--CA 1.467 0.396 0 C-N-CA 124.132 0.973 . . . . 0.0 110.395 172.517 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 41.8 mt -57.72 -33.32 68.3 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-N 118.921 0.782 . . . . 0.0 112.499 174.19 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 8.4 tm-20 -56.3 -34.7 66.74 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 125.086 1.354 . . . . 0.0 113.003 176.332 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 25.1 t30 -63.34 -34.27 77.33 Favored 'General case' 0 CA--C 1.543 0.711 0 O-C-N 121.203 -0.936 . . . . 0.0 112.256 175.443 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 74.5 m-85 -88.57 2.13 53.63 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 125.849 1.659 . . . . 0.0 113.762 -178.129 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 82.5 m -76.55 56.09 1.09 Allowed 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 126.146 1.778 . . . . 0.0 113.051 168.227 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 13.8 p30 . . . . . 0 C--O 1.253 1.253 0 C-N-CA 126.798 2.039 . . . . 0.0 113.037 -179.586 . . . . . . . . 0 0 . 1 . 038 nuclear build full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 84.8 m-85 . . . . . 0 N--CA 1.489 1.49 0 CA-C-O 119.979 -0.058 . . . . 0.0 110.939 . . . . . . . . . 0 0 . 1 . 038 nuclear build full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 73.8 t -78.39 135.85 25.2 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.884 0 C-N-CA 124.031 0.932 . . . . 0.0 109.547 175.982 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 24.8 t-20 -128.25 136.7 51.4 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 126.399 1.88 . . . . 0.0 110.74 179.302 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 48.5 mm-40 -156.32 167.41 30.53 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 124.771 1.228 . . . . 0.0 112.15 -167.554 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 16.8 m170 -84.78 138.43 32.6 Favored 'General case' 0 CA--C 1.542 0.636 0 N-CA-C 109.329 -0.619 . . . . 0.0 109.329 150.226 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 72.1 mt -146.41 136.44 23.5 Favored 'General case' 0 N--CA 1.465 0.314 0 C-N-CA 125.067 1.347 . . . . 0.0 109.455 -175.476 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 3.0 t -154.64 153.44 31.36 Favored 'General case' 0 N--CA 1.466 0.327 0 C-N-CA 123.502 0.721 . . . . 0.0 111.451 -176.117 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 47.76 -124.79 10.59 Favored Glycine 0 CA--C 1.529 0.928 0 C-N-CA 125.19 1.376 . . . . 0.0 113.772 176.82 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 24.3 p -60.35 -33.93 73.13 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 125.028 1.331 . . . . 0.0 113.197 179.301 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 98.2 m-70 -70.12 -39.27 75.56 Favored 'General case' 0 CA--C 1.542 0.646 0 O-C-N 121.204 -0.935 . . . . 0.0 111.583 177.025 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 63.5 tp -65.96 -45.14 82.83 Favored 'General case' 0 N--CA 1.471 0.604 0 O-C-N 121.616 -0.678 . . . . 0.0 110.869 172.735 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 24.7 t -59.59 -39.68 80.1 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.936 0 C-N-CA 124.187 0.995 . . . . 0.0 111.806 176.238 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -67.84 -46.61 71.31 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 123.879 0.872 . . . . 0.0 111.601 175.074 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.87 -46.2 90.04 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.158 0.583 . . . . 0.0 111.602 178.2 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 30.6 mt -54.74 -59.2 5.04 Favored 'General case' 0 N--CA 1.466 0.357 0 C-N-CA 124.099 0.96 . . . . 0.0 110.255 171.472 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 69.6 t80 -51.85 -38.71 57.01 Favored 'General case' 0 CA--C 1.543 0.707 0 CA-C-N 119.443 1.02 . . . . 0.0 113.234 -179.495 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 86.7 mt -72.71 -32.2 65.57 Favored 'General case' 0 N--CA 1.471 0.593 0 N-CA-C 113.914 1.079 . . . . 0.0 113.914 177.732 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 68.0 t -78.07 -38.06 23.61 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.01 0 C-N-CA 123.922 0.889 . . . . 0.0 111.316 174.384 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 44.1 m -89.48 -33.43 16.79 Favored 'General case' 0 N--CA 1.466 0.348 0 N-CA-C 114.28 1.215 . . . . 0.0 114.28 -170.633 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 60.79 -131.93 49.15 Favored Glycine 0 CA--C 1.533 1.192 0 N-CA-C 111.391 -0.684 . . . . 0.0 111.391 -172.18 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -72.46 -7.75 51.48 Favored 'General case' 0 CA--C 1.546 0.826 0 N-CA-C 114.364 1.246 . . . . 0.0 114.364 -179.311 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 68.8 mtp180 -62.95 -26.85 69.02 Favored 'General case' 0 N--CA 1.476 0.875 0 CA-C-N 119.336 0.971 . . . . 0.0 113.414 177.938 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 75.38 173.62 33.67 Favored Glycine 0 CA--C 1.531 1.075 0 C-N-CA 124.419 1.009 . . . . 0.0 112.192 -168.629 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 35.6 p90 -150.12 157.73 43.42 Favored 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 114.789 1.403 . . . . 0.0 114.789 -171.619 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 89.5 t80 -111.92 107.66 16.75 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 126.321 1.848 . . . . 0.0 109.617 171.306 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 27.9 p90 -106.37 -12.88 15.53 Favored 'General case' 0 CA--C 1.542 0.659 0 N-CA-C 115.709 1.744 . . . . 0.0 115.709 -171.219 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 41.2 p -69.59 154.3 94.93 Favored Pre-proline 0 N--CA 1.479 1.013 0 N-CA-C 114.439 1.274 . . . . 0.0 114.439 -152.838 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -76.94 -34.17 2.42 Favored 'Trans proline' 0 C--N 1.35 0.631 0 C-N-CA 123.214 2.609 . . . . 0.0 113.006 177.959 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 6.1 tttp -172.05 167.46 6.06 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 125.189 1.396 . . . . 0.0 112.714 -174.452 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 18.8 m . . . . . 0 C--O 1.251 1.164 0 C-N-CA 125.947 1.699 . . . . 0.0 112.604 179.493 . . . . . . . . 0 0 . 1 . 039 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.736 0 N-CA-C 111.218 -0.753 . . . . 0.0 111.218 . . . . . . . . . 0 0 . 1 . 039 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 10.2 tp -64.01 -33.77 64.32 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.0 0 N-CA-C 114.472 1.286 . . . . 0.0 114.472 -167.739 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 38.2 t -66.98 -37.01 78.54 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.113 0 CA-C-N 119.71 1.141 . . . . 0.0 111.535 176.878 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -71.45 -47.39 56.05 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-N 119.169 0.895 . . . . 0.0 110.491 173.906 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 65.3 tp60 -56.84 -46.24 81.84 Favored 'General case' 0 N--CA 1.467 0.393 0 C-N-CA 123.698 0.799 . . . . 0.0 111.963 179.347 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -82.85 -17.11 45.05 Favored 'General case' 0 N--CA 1.469 0.487 0 N-CA-C 114.477 1.288 . . . . 0.0 114.477 -175.056 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 29.3 t -102.89 -43.92 5.4 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 123.986 0.915 . . . . 0.0 112.807 -175.983 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 61.7 m -85.63 -37.17 19.79 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 125.476 1.511 . . . . 0.0 111.118 178.89 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 18.1 t -110.69 -149.55 0.45 Allowed 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 124.15 0.98 . . . . 0.0 109.366 160.944 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 11.9 tt -116.86 157.45 17.81 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.932 0 C-N-CA 126.099 1.759 . . . . 0.0 111.258 177.828 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 1.6 p -143.72 -171.75 3.59 Favored 'General case' 0 N--CA 1.476 0.865 0 O-C-N 121.237 -0.914 . . . . 0.0 111.719 167.663 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 59.5 p -131.72 168.93 16.93 Favored 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 124.478 1.111 . . . . 0.0 112.573 177.534 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 32.9 mt -61.41 -31.65 71.58 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 123.374 0.669 . . . . 0.0 112.103 174.164 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 87.0 t80 -65.1 -33.01 75.01 Favored 'General case' 0 CA--C 1.54 0.569 0 N-CA-C 112.946 0.721 . . . . 0.0 112.946 171.827 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 19.7 mm100 -75.83 -28.02 58.1 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-O 118.699 -0.667 . . . . 0.0 112.274 172.571 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 53.3 mt -68.9 -40.26 79.28 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-N 119.412 1.005 . . . . 0.0 111.639 168.579 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -58.49 -24.72 61.16 Favored 'General case' 0 CA--C 1.547 0.84 0 N-CA-C 113.428 0.899 . . . . 0.0 113.428 -177.414 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 25.0 t30 -54.83 -26.0 32.2 Favored 'General case' 0 CA--C 1.551 0.989 0 C-N-CA 124.567 1.147 . . . . 0.0 113.844 171.727 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 98.6 m-85 -101.83 4.31 40.2 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 126.051 1.74 . . . . 0.0 114.021 -175.468 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 61.2 m -63.56 150.89 42.95 Favored 'General case' 0 CA--C 1.543 0.674 0 O-C-N 121.352 -0.843 . . . . 0.0 111.59 166.384 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 22.5 t-20 . . . . . 0 C--O 1.253 1.267 0 C-N-CA 124.544 1.138 . . . . 0.0 113.008 -177.602 . . . . . . . . 0 0 . 1 . 039 nuclear build full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 53.3 t80 . . . . . 0 N--CA 1.484 1.263 0 CA-C-O 119.591 -0.242 . . . . 0.0 110.676 . . . . . . . . . 0 0 . 1 . 039 nuclear build full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 13.8 m -79.56 63.0 0.24 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.14 0 C-N-CA 125.8 1.64 . . . . 0.0 112.657 -176.108 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 11.5 m120 -93.54 138.23 32.03 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 126.156 1.782 . . . . 0.0 111.229 174.344 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 38.2 mt-30 -152.43 154.11 34.91 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 124.948 1.299 . . . . 0.0 110.332 -173.066 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 95.1 m-70 -87.89 123.37 32.57 Favored 'General case' 0 CA--C 1.54 0.57 0 N-CA-C 108.372 -0.973 . . . . 0.0 108.372 162.572 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 72.1 mt -140.75 142.57 34.75 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 125.541 1.536 . . . . 0.0 108.397 -171.621 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -149.15 150.91 33.45 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 123.486 0.715 . . . . 0.0 112.25 -173.609 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 43.95 -125.06 5.41 Favored Glycine 0 N--CA 1.473 1.129 0 C-N-CA 125.754 1.645 . . . . 0.0 114.316 172.427 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 20.1 m -62.13 -31.13 71.56 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 124.653 1.181 . . . . 0.0 112.803 -178.06 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 97.7 m-70 -72.38 -37.1 68.83 Favored 'General case' 0 CA--C 1.539 0.546 0 O-C-N 121.037 -1.039 . . . . 0.0 111.463 177.308 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 8.8 tt -66.27 -44.72 82.83 Favored 'General case' 0 C--N 1.344 0.346 0 O-C-N 121.719 -0.613 . . . . 0.0 110.974 169.941 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 53.9 t -61.75 -36.72 75.33 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.986 0 C-N-CA 123.212 0.605 . . . . 0.0 111.782 177.836 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -65.8 -48.47 71.62 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 123.905 0.882 . . . . 0.0 111.739 172.107 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.8 -44.07 94.15 Favored 'General case' 0 CA--C 1.543 0.678 0 O-C-N 121.633 -0.667 . . . . 0.0 111.704 176.77 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 52.3 tp -58.28 -50.94 71.83 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 125.885 1.674 . . . . 0.0 111.005 176.122 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 52.8 t80 -54.76 -42.21 71.4 Favored 'General case' 0 CA--C 1.541 0.634 0 N-CA-C 113.009 0.744 . . . . 0.0 113.009 173.434 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 89.5 mt -74.04 -33.36 63.7 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 123.925 0.89 . . . . 0.0 113.348 179.957 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 24.4 t -65.11 -47.18 88.74 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.819 0 C-N-CA 124.864 1.266 . . . . 0.0 110.361 171.457 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 84.7 m -75.74 -36.27 59.95 Favored 'General case' 0 N--CA 1.469 0.482 0 N-CA-C 112.753 0.649 . . . . 0.0 112.753 -176.436 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 62.81 -134.35 43.92 Favored Glycine 0 CA--C 1.529 0.927 0 C-N-CA 124.384 0.992 . . . . 0.0 111.412 -178.195 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -61.13 -18.4 57.86 Favored 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 114.681 1.363 . . . . 0.0 114.681 178.714 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 86.0 mtm180 -65.2 -30.45 71.35 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 124.117 0.967 . . . . 0.0 113.212 179.815 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 77.73 177.82 47.56 Favored Glycine 0 CA--C 1.533 1.212 0 C-N-CA 124.507 1.051 . . . . 0.0 112.888 -173.221 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 33.3 p90 -158.55 168.26 27.39 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 124.641 1.176 . . . . 0.0 112.64 -172.134 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 92.0 t80 -156.69 132.36 9.47 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 124.389 1.076 . . . . 0.0 111.83 164.085 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 84.4 t80 -161.53 147.84 14.15 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 126.378 1.871 . . . . 0.0 111.325 165.804 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 13.4 p -134.33 132.83 21.2 Favored Pre-proline 0 N--CA 1.474 0.739 0 C-N-CA 126.32 1.848 . . . . 0.0 109.778 173.692 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -72.63 121.34 7.32 Favored 'Trans proline' 0 C--N 1.352 0.725 0 C-N-CA 123.35 2.7 . . . . 0.0 111.565 -171.424 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 2.8 tppp? 70.6 -32.49 0.24 Allowed 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 128.23 2.612 . . . . 0.0 115.432 170.462 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 28.8 p . . . . . 0 C--O 1.254 1.303 0 C-N-CA 126.475 1.91 . . . . 0.0 113.931 -176.875 . . . . . . . . 0 0 . 1 . 040 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.612 0 N-CA-C 111.946 -0.462 . . . . 0.0 111.946 . . . . . . . . . 0 0 . 1 . 040 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 17.8 tt -98.24 -28.31 3.62 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.239 0 C-N-CA 124.298 1.039 . . . . 0.0 113.752 178.692 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 83.7 t -64.61 -34.67 71.31 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.211 0 CA-C-N 119.758 1.163 . . . . 0.0 110.412 -176.368 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 14.9 pt-20 -61.98 -36.29 81.04 Favored 'General case' 0 CA--C 1.543 0.695 0 CA-C-N 118.722 0.692 . . . . 0.0 112.296 172.566 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 28.5 tt0 -74.0 -43.92 56.37 Favored 'General case' 0 C--O 1.225 -0.223 0 C-N-CA 123.534 0.734 . . . . 0.0 110.365 -179.704 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 92.6 m -72.27 -36.3 68.97 Favored 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 113.746 1.017 . . . . 0.0 113.746 179.098 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 15.8 t -93.46 -45.61 7.69 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 123.601 0.76 . . . . 0.0 112.826 -168.447 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 25.1 m -91.47 -38.33 12.62 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 124.747 1.219 . . . . 0.0 111.488 -177.298 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.7 t -105.09 -152.32 0.46 Allowed 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 124.493 1.117 . . . . 0.0 111.393 171.221 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 24.1 mt -109.87 140.38 29.04 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.791 0 C-N-CA 126.002 1.721 . . . . 0.0 110.092 168.817 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 9.7 p -124.39 -172.9 2.65 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.74 1.216 . . . . 0.0 111.129 167.366 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 8.4 t -148.8 166.66 27.8 Favored 'General case' 0 N--CA 1.469 0.503 0 O-C-N 120.655 -1.278 . . . . 0.0 111.898 179.264 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 34.0 mt -59.86 -33.49 71.88 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 124.628 1.171 . . . . 0.0 112.143 -178.234 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 86.6 t80 -61.42 -29.91 70.23 Favored 'General case' 0 CA--C 1.546 0.792 0 N-CA-C 113.565 0.95 . . . . 0.0 113.565 171.908 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 54.0 mm-40 -80.16 -36.47 35.08 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 123.343 0.657 . . . . 0.0 110.522 174.503 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 32.5 mt -62.27 -37.86 87.09 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 118.523 0.601 . . . . 0.0 111.52 172.193 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -61.31 -32.1 71.96 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 124.878 1.271 . . . . 0.0 112.903 179.004 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 24.1 t30 -62.5 -24.24 67.37 Favored 'General case' 0 CA--C 1.548 0.901 0 O-C-N 121.405 -0.809 . . . . 0.0 112.794 176.424 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 38.8 m-85 -95.51 1.59 54.01 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 125.584 1.553 . . . . 0.0 114.475 179.785 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 70.2 m -69.27 153.99 42.75 Favored 'General case' 0 CA--C 1.544 0.74 0 O-C-N 121.002 -1.061 . . . . 0.0 113.234 173.294 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.253 1.241 0 C-N-CA 126.166 1.786 . . . . 0.0 111.302 178.626 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 17.2 p90 . . . . . 0 N--CA 1.486 1.332 0 N-CA-C 111.311 0.115 . . . . 0.0 111.311 . . . . . . . . . 0 0 . 1 . 040 nuclear build full ' B' B ' 2' ' ' VAL . . . . . 0.42 HG22 ' H ' ' B' ' 3' ' ' ASN . 14.4 p -166.27 -177.65 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.483 1.195 0 C-N-CA 127.108 2.163 . . . . 0.0 109.092 -174.958 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' B' B ' 3' ' ' ASN . . . . . 0.42 ' H ' HG22 ' B' ' 2' ' ' VAL . 10.0 p30 -61.04 127.78 33.2 Favored 'General case' 0 CA--C 1.543 0.681 0 O-C-N 120.542 -1.349 . . . . 0.0 110.498 167.441 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 30.5 mt-30 -148.3 165.82 29.87 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 124.043 0.937 . . . . 0.0 112.374 -158.888 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 93.8 m-70 -82.37 134.36 35.25 Favored 'General case' 0 CA--C 1.545 0.752 0 N-CA-C 108.968 -0.753 . . . . 0.0 108.968 157.592 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 76.4 mt -147.54 133.92 19.63 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 125.735 1.614 . . . . 0.0 108.619 -177.649 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 3.7 t -158.42 153.17 24.84 Favored 'General case' 0 N--CA 1.469 0.492 0 O-C-N 121.428 -0.795 . . . . 0.0 112.225 -177.38 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 61.01 -134.4 49.11 Favored Glycine 0 CA--C 1.53 0.992 0 C-N-CA 124.719 1.152 . . . . 0.0 113.139 179.171 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 20.3 m -60.9 -30.92 70.46 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 124.467 1.107 . . . . 0.0 112.029 -178.43 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 13.5 m80 -66.52 -41.82 88.19 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 124.543 1.137 . . . . 0.0 111.541 178.046 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 48.8 tp -69.46 -42.7 74.54 Favored 'General case' 0 N--CA 1.466 0.336 0 C-N-CA 124.284 1.033 . . . . 0.0 111.359 174.585 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 48.1 t -60.32 -41.07 85.82 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.038 0 C-N-CA 123.635 0.774 . . . . 0.0 111.349 175.458 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -66.61 -45.17 80.01 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 124.065 0.946 . . . . 0.0 111.829 174.399 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.99 -45.68 91.92 Favored 'General case' 0 CA--C 1.54 0.582 0 O-C-N 121.656 -0.652 . . . . 0.0 112.129 178.096 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 17.6 mt -54.74 -54.19 45.22 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 124.493 1.117 . . . . 0.0 110.974 172.795 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 77.8 t80 -55.45 -41.66 73.19 Favored 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 113.196 0.813 . . . . 0.0 113.196 177.177 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 85.4 mt -73.22 -35.76 66.35 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 123.9 0.88 . . . . 0.0 113.127 179.839 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 43.6 t -67.89 -42.47 85.76 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.845 0 C-N-CA 123.525 0.73 . . . . 0.0 110.903 173.842 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 82.7 m -80.75 -27.28 36.85 Favored 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 113.483 0.92 . . . . 0.0 113.483 -175.658 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 65.65 -111.96 4.59 Favored Glycine 0 CA--C 1.53 0.996 0 C-N-CA 124.298 0.951 . . . . 0.0 111.908 173.565 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -75.47 -18.91 59.72 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 124.395 1.078 . . . . 0.0 113.074 176.131 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 95.6 mtt-85 -76.9 158.16 30.9 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 124.059 0.943 . . . . 0.0 111.678 173.16 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . -74.46 179.37 43.43 Favored Glycine 0 CA--C 1.531 1.058 0 C-N-CA 123.839 0.733 . . . . 0.0 111.668 168.768 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 42.1 p90 -153.73 169.54 23.07 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.542 1.137 . . . . 0.0 112.473 -178.247 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 63.6 t80 -153.85 149.49 27.41 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 124.828 1.251 . . . . 0.0 111.983 179.406 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 42.5 p90 -134.96 149.02 50.16 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 126.762 2.025 . . . . 0.0 111.288 175.854 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 7.3 t -159.0 138.25 8.27 Favored Pre-proline 0 N--CA 1.476 0.862 0 C-N-CA 124.785 1.234 . . . . 0.0 111.745 -178.033 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 16.9 Cg_endo -90.24 -160.23 0.09 OUTLIER 'Trans proline' 0 CA--C 1.541 0.866 0 C-N-CA 125.212 3.941 . . . . 0.0 112.067 -179.137 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 22.6 ptmt -78.69 -20.85 49.18 Favored 'General case' 0 CA--C 1.547 0.861 0 N-CA-C 114.77 1.396 . . . . 0.0 114.77 177.346 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 21.6 p . . . . . 0 N--CA 1.483 1.198 0 C-N-CA 125.684 1.593 . . . . 0.0 113.745 -175.304 . . . . . . . . 0 0 . 1 . 041 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.858 0 N-CA-C 111.987 -0.445 . . . . 0.0 111.987 . . . . . . . . . 0 0 . 1 . 041 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 38.8 pt -104.0 -22.19 4.93 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.378 0 C-N-CA 127.776 2.43 . . . . 0.0 113.827 -4.805 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 85.5 t -56.84 -48.12 81.79 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.048 0 CA-C-N 119.014 0.824 . . . . 0.0 112.048 -173.124 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -59.75 -35.45 74.61 Favored 'General case' 0 N--CA 1.474 0.755 0 CA-C-N 118.958 0.799 . . . . 0.0 112.573 -178.546 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 28.7 tp60 -71.44 -32.8 68.76 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-O 118.663 -0.684 . . . . 0.0 112.02 -178.536 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -95.23 -22.0 18.1 Favored 'General case' 0 CA--C 1.539 0.557 0 N-CA-C 114.161 1.171 . . . . 0.0 114.161 177.172 . . . . . . . . 2 2 . 1 . 041 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 51.1 t -100.52 -56.08 2.43 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 124.764 1.226 . . . . 0.0 112.983 -172.976 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 26.8 m -81.06 -47.35 13.68 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 124.635 1.174 . . . . 0.0 109.894 -178.245 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 13.7 t -84.83 -158.35 0.35 Allowed 'General case' 0 CA--C 1.552 1.035 0 C-N-CA 123.045 0.538 . . . . 0.0 110.283 155.791 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 29.8 pt -128.82 150.4 34.44 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.552 0 C-N-CA 125.181 1.392 . . . . 0.0 111.974 178.842 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -145.12 166.56 25.04 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 123.962 0.905 . . . . 0.0 112.099 170.546 . . . . . . . . 2 2 . 1 . 041 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 3.4 t -118.52 167.11 11.92 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 124.064 0.946 . . . . 0.0 112.703 -173.943 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 47.7 mt -58.02 -35.65 71.58 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 124.713 1.205 . . . . 0.0 111.946 179.959 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 75.2 m-85 -62.06 -30.78 71.22 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 124.463 1.105 . . . . 0.0 113.543 173.287 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 17.6 mm100 -82.96 -33.68 26.63 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 124.328 1.051 . . . . 0.0 110.951 174.57 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 48.4 mt -62.51 -36.33 82.22 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 119.238 0.927 . . . . 0.0 111.418 170.988 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 25.5 tt0 -63.17 -27.75 69.58 Favored 'General case' 0 CA--C 1.544 0.726 0 N-CA-C 113.331 0.863 . . . . 0.0 113.331 178.894 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 30.8 t30 -59.59 -25.65 64.78 Favored 'General case' 0 CA--C 1.547 0.856 0 O-C-N 121.264 -0.897 . . . . 0.0 113.181 174.423 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 59.3 m-85 -94.55 -0.31 54.66 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 125.282 1.433 . . . . 0.0 114.117 -178.728 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 81.2 m -67.18 154.04 42.21 Favored 'General case' 0 CA--C 1.544 0.747 0 CA-C-N 119.076 0.853 . . . . 0.0 113.183 175.338 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.252 1.214 0 C-N-CA 126.619 1.967 . . . . 0.0 110.977 179.804 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 67.7 m-85 . . . . . 0 N--CA 1.488 1.426 0 N-CA-C 111.221 0.082 . . . . 0.0 111.221 . . . . . . . . . 0 0 . 1 . 041 nuclear build full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 9.3 m -141.7 151.39 19.11 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.091 0 C-N-CA 125.4 1.48 . . . . 0.0 110.916 177.424 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 40.8 m-80 77.25 135.59 0.06 Allowed 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 129.269 3.028 . . . . 0.0 113.638 -178.427 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 53.8 mm-40 -140.55 166.55 24.43 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 125.804 1.642 . . . . 0.0 110.442 -179.096 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 92.2 m-70 -84.96 116.7 23.52 Favored 'General case' 0 CA--C 1.541 0.628 0 N-CA-C 108.655 -0.869 . . . . 0.0 108.655 164.219 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 91.8 mt -132.35 126.33 33.0 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 125.743 1.617 . . . . 0.0 108.507 179.169 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 77.7 m -132.2 144.21 50.49 Favored 'General case' 0 N--CA 1.465 0.29 0 C-N-CA 124.839 1.255 . . . . 0.0 111.76 -168.01 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 53.04 -124.7 28.71 Favored Glycine 0 CA--C 1.531 1.081 0 C-N-CA 125.307 1.432 . . . . 0.0 114.271 164.647 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 22.2 p -56.85 -41.39 77.84 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 124.726 1.21 . . . . 0.0 112.238 176.968 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 19.3 m-70 -69.57 -29.89 67.54 Favored 'General case' 0 CA--C 1.541 0.628 0 O-C-N 120.613 -1.305 . . . . 0.0 112.712 177.946 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 48.0 tp -69.06 -43.06 75.4 Favored 'General case' 0 N--CA 1.47 0.564 0 O-C-N 121.544 -0.723 . . . . 0.0 111.275 169.559 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 52.1 t -60.57 -41.33 87.5 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.99 0 C-N-CA 123.927 0.891 . . . . 0.0 111.67 173.535 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -63.7 -46.5 85.17 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 124.372 1.069 . . . . 0.0 111.527 173.58 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.12 -45.06 96.22 Favored 'General case' 0 CA--C 1.544 0.734 0 CA-C-N 118.761 0.71 . . . . 0.0 111.923 178.872 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 22.2 mt -55.33 -54.36 44.54 Favored 'General case' 0 N--CA 1.467 0.416 0 C-N-CA 124.186 0.995 . . . . 0.0 111.056 173.018 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 71.1 t80 -55.61 -42.28 74.66 Favored 'General case' 0 N--CA 1.47 0.544 0 N-CA-C 113.007 0.743 . . . . 0.0 113.007 177.48 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 84.9 mt -74.88 -33.38 62.06 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 124.127 0.971 . . . . 0.0 113.341 -178.6 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 37.7 t -69.26 -44.02 80.86 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.849 0 C-N-CA 123.974 0.909 . . . . 0.0 110.684 172.498 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 72.9 m -76.79 -33.51 58.03 Favored 'General case' 0 CA--C 1.538 0.508 0 N-CA-C 113.074 0.768 . . . . 0.0 113.074 -175.936 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 68.89 -111.68 4.1 Favored Glycine 0 CA--C 1.529 0.91 0 C-N-CA 124.662 1.125 . . . . 0.0 112.044 172.166 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -69.12 -27.14 65.3 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 124.171 0.988 . . . . 0.0 112.131 173.975 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 82.8 mtm180 -72.91 153.99 40.76 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 124.803 1.241 . . . . 0.0 110.758 175.988 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . -76.22 -174.83 38.54 Favored Glycine 0 N--CA 1.474 1.175 0 C-N-CA 123.915 0.769 . . . . 0.0 111.581 168.423 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 52.5 p90 -152.46 148.09 27.01 Favored 'General case' 0 CA--C 1.536 0.442 0 N-CA-C 113.287 0.847 . . . . 0.0 113.287 179.234 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 90.7 t80 -89.89 146.32 24.5 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 125.787 1.635 . . . . 0.0 110.671 169.664 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 85.2 t80 -158.94 140.68 13.48 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 125.59 1.556 . . . . 0.0 111.527 179.69 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 11.8 t -167.78 139.33 2.45 Favored Pre-proline 0 N--CA 1.477 0.889 0 C-N-CA 125.375 1.47 . . . . 0.0 111.646 176.131 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 69.6 Cg_endo -80.67 172.44 13.34 Favored 'Trans proline' 0 C--N 1.352 0.716 0 C-N-CA 123.879 3.053 . . . . 0.0 111.531 172.411 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 22.4 ptmt -61.61 150.0 37.6 Favored 'General case' 0 CA--C 1.549 0.936 0 N-CA-C 113.146 0.795 . . . . 0.0 113.146 173.7 . . . . . . . . 1 1 . 1 . 041 nuclear build full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 12.8 t . . . . . 0 C--O 1.253 1.278 0 C-N-CA 126.652 1.981 . . . . 0.0 111.783 -175.79 . . . . . . . . 0 0 . 1 . 042 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.503 0 N-CA-C 111.184 -0.766 . . . . 0.0 111.184 . . . . . . . . . 0 0 . 1 . 042 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 46.2 pt -76.9 -23.26 14.96 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.916 0 N-CA-C 114.68 1.363 . . . . 0.0 114.68 -167.208 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 53.0 t -59.32 -37.85 71.49 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.121 0 CA-C-N 119.816 1.189 . . . . 0.0 111.6 178.699 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 44.2 mm-40 -79.14 -56.73 4.15 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-O 118.969 -0.539 . . . . 0.0 110.518 168.609 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 23.8 tt0 -61.58 -40.91 96.44 Favored 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 113.865 1.061 . . . . 0.0 113.865 -166.692 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 25.7 m -69.49 -21.69 63.67 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 119.204 0.911 . . . . 0.0 112.766 175.948 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 13.2 t -88.12 -41.52 12.98 Favored 'General case' 0 CA--C 1.538 0.513 0 O-C-N 121.393 -0.817 . . . . 0.0 111.617 179.814 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 72.7 p -82.29 -18.17 43.27 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 125.243 1.417 . . . . 0.0 114.034 179.668 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 71.3 p -148.36 172.42 14.44 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 124.919 1.288 . . . . 0.0 111.905 -179.485 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 64.9 mt -73.9 129.03 36.59 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.679 0 O-C-N 121.238 -0.914 . . . . 0.0 109.774 174.549 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 17.3 p -123.49 159.77 28.36 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 124.866 1.267 . . . . 0.0 111.727 169.629 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 18.8 m -108.97 153.52 23.46 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 124.3 1.04 . . . . 0.0 111.276 -171.667 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 36.6 mt -60.69 -31.15 70.41 Favored 'General case' 0 N--CA 1.472 0.629 0 O-C-N 120.907 -1.121 . . . . 0.0 112.357 179.678 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 86.9 m-85 -64.59 -25.89 68.17 Favored 'General case' 0 CA--C 1.543 0.711 0 N-CA-C 114.096 1.147 . . . . 0.0 114.096 171.684 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 57.5 mm-40 -88.41 -25.93 22.42 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 124.752 1.221 . . . . 0.0 111.38 175.136 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 9.2 mp -62.42 -49.27 76.15 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 119.467 1.03 . . . . 0.0 110.588 162.993 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 37.5 tt0 -59.55 -28.45 67.12 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 124.679 1.191 . . . . 0.0 113.411 -179.874 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 26.2 t30 -54.33 -30.99 53.22 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 124.582 1.153 . . . . 0.0 113.889 179.321 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 99.4 m-85 -95.95 0.44 51.85 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 124.989 1.316 . . . . 0.0 113.865 -177.88 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 83.0 m -86.36 162.09 18.36 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 124.594 1.158 . . . . 0.0 113.655 174.959 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.251 1.155 0 C-N-CA 126.2 1.8 . . . . 0.0 112.308 -179.055 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 86.6 t80 . . . . . 0 N--CA 1.487 1.382 0 CA-C-O 119.465 -0.302 . . . . 0.0 110.667 . . . . . . . . . 0 0 . 1 . 042 nuclear build full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 75.7 t -144.47 136.92 22.38 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.024 0 C-N-CA 125.626 1.57 . . . . 0.0 109.461 -179.367 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 51.7 p-10 -148.65 143.31 26.43 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 125.79 1.636 . . . . 0.0 111.328 171.434 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 42.5 mt-30 -152.3 164.93 36.44 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 124.46 1.104 . . . . 0.0 111.937 -162.946 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 21.9 m-70 -84.79 135.25 34.19 Favored 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 108.758 -0.831 . . . . 0.0 108.758 153.607 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 81.5 mt -145.09 125.16 13.61 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 126.302 1.841 . . . . 0.0 109.465 -177.671 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 58.1 m -124.74 138.1 54.3 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 125.097 1.359 . . . . 0.0 110.489 -178.141 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 51.05 -117.25 5.27 Favored Glycine 0 N--CA 1.474 1.173 0 C-N-CA 125.091 1.329 . . . . 0.0 113.947 167.352 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 19.9 m -59.84 -32.94 71.14 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 124.495 1.118 . . . . 0.0 112.786 -178.066 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 96.2 m-70 -71.25 -38.66 71.9 Favored 'General case' 0 CA--C 1.539 0.535 0 O-C-N 121.253 -0.904 . . . . 0.0 111.42 176.418 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 56.5 tp -66.68 -42.95 85.7 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 123.508 0.723 . . . . 0.0 111.241 172.913 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 42.5 t -60.61 -43.26 94.32 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.916 0 C-N-CA 124.018 0.927 . . . . 0.0 111.699 175.061 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -64.28 -45.39 88.23 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 123.74 0.816 . . . . 0.0 111.425 175.5 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.46 -46.18 91.15 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 123.068 0.547 . . . . 0.0 112.034 177.309 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 28.7 mt -56.66 -48.38 77.7 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 124.091 0.956 . . . . 0.0 111.444 175.559 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 61.9 t80 -56.84 -41.13 77.33 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 123.773 0.829 . . . . 0.0 113.095 174.774 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 90.8 mt -78.02 -35.03 50.32 Favored 'General case' 0 N--CA 1.47 0.554 0 N-CA-C 113.426 0.898 . . . . 0.0 113.426 -179.455 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 40.8 t -67.23 -44.89 87.31 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 C-N-CA 124.645 1.178 . . . . 0.0 110.415 175.94 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 74.3 m -95.34 -25.84 16.14 Favored 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 113.628 0.973 . . . . 0.0 113.628 -170.758 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 63.08 -109.37 2.67 Favored Glycine 0 CA--C 1.531 1.052 0 C-N-CA 124.361 0.982 . . . . 0.0 112.72 168.509 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 39.1 mm-40 -69.8 -24.93 63.56 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 124.418 1.087 . . . . 0.0 112.86 175.818 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 96.0 mtt-85 -77.48 141.31 39.75 Favored 'General case' 0 N--CA 1.467 0.382 0 C-N-CA 124.046 0.938 . . . . 0.0 110.617 172.768 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . -74.0 152.48 45.58 Favored Glycine 0 N--CA 1.469 0.843 0 C-N-CA 124.652 1.12 . . . . 0.0 111.6 175.192 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 45.3 p90 -131.02 166.2 21.53 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 124.867 1.267 . . . . 0.0 112.508 -173.967 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 50.3 t80 -151.55 142.03 22.56 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 124.215 1.006 . . . . 0.0 111.557 170.441 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 8.5 p90 -104.31 98.12 7.97 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 126.869 2.068 . . . . 0.0 109.966 179.443 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 30.6 p -68.47 137.8 91.13 Favored Pre-proline 0 N--CA 1.478 0.932 0 CA-C-O 118.23 -0.89 . . . . 0.0 111.166 -176.976 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_endo -78.62 -152.76 0.04 OUTLIER 'Trans proline' 0 CA--C 1.544 0.979 0 C-N-CA 124.749 3.632 . . . . 0.0 111.878 -169.422 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -56.04 -38.56 70.73 Favored 'General case' 0 CA--C 1.547 0.843 0 O-C-N 120.548 -1.345 . . . . 0.0 112.036 173.586 . . . . . . . . 1 1 . 1 . 042 nuclear build full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 23.7 m . . . . . 0 C--O 1.251 1.142 0 C-N-CA 125.738 1.615 . . . . 0.0 111.357 171.09 . . . . . . . . 0 0 . 1 . 043 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.497 0 N-CA-C 110.854 -0.899 . . . . 0.0 110.854 . . . . . . . . . 0 0 . 1 . 043 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 20.7 pt -59.5 -31.59 47.04 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.277 0 N-CA-C 115.584 1.698 . . . . 0.0 115.584 -163.866 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 93.4 t -67.77 -28.68 42.48 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.217 0 CA-C-N 119.408 1.004 . . . . 0.0 111.996 -179.242 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 33.4 mm-40 -89.38 -54.74 3.95 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 123.149 0.579 . . . . 0.0 110.093 169.034 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 64.4 tt0 -62.75 -44.19 96.83 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 124.77 1.228 . . . . 0.0 112.865 -168.511 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 2.7 t -81.16 -12.43 59.21 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-N 118.847 0.749 . . . . 0.0 112.777 -179.658 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 13.6 t -89.12 -40.04 13.2 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 124.227 1.011 . . . . 0.0 111.684 178.034 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 2.4 t -89.98 -36.15 15.13 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 124.813 1.245 . . . . 0.0 112.804 178.001 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 14.3 t -120.56 -149.95 0.44 Allowed 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 126.034 1.733 . . . . 0.0 109.42 172.349 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 47.7 pt -113.09 159.84 12.89 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.704 0 C-N-CA 125.099 1.36 . . . . 0.0 112.338 179.924 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 17.0 p -142.03 163.02 34.02 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 124.758 1.223 . . . . 0.0 112.166 167.194 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 13.8 m -104.93 152.48 22.61 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 125.056 1.342 . . . . 0.0 111.363 -176.052 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 33.9 mt -60.21 -34.4 73.59 Favored 'General case' 0 N--CA 1.47 0.526 0 O-C-N 120.999 -1.063 . . . . 0.0 111.549 176.42 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 85.4 t80 -60.06 -32.55 71.04 Favored 'General case' 0 CA--C 1.547 0.834 0 N-CA-C 113.213 0.82 . . . . 0.0 113.213 172.658 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 84.4 mt-30 -77.17 -36.75 54.85 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 123.773 0.829 . . . . 0.0 110.767 175.762 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 57.3 mt -60.93 -40.74 94.39 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-N 118.538 0.608 . . . . 0.0 111.729 170.416 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -62.31 -39.15 92.07 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 124.534 1.134 . . . . 0.0 112.03 175.076 . . . . . . . . 2 2 . 1 . 043 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 31.3 t30 -63.41 -26.22 68.64 Favored 'General case' 0 CA--C 1.549 0.918 0 N-CA-C 113.363 0.875 . . . . 0.0 113.363 178.091 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 7.7 m-85 -77.5 -12.39 59.96 Favored 'General case' 0 CA--C 1.545 0.775 0 N-CA-C 114.247 1.203 . . . . 0.0 114.247 173.629 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 74.0 m -90.67 158.93 16.66 Favored 'General case' 0 CA--C 1.544 0.746 0 N-CA-C 114.181 1.178 . . . . 0.0 114.181 -178.102 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 23.5 t-20 . . . . . 0 C--O 1.253 1.253 0 C-N-CA 126.795 2.038 . . . . 0.0 112.364 -174.924 . . . . . . . . 0 0 . 1 . 043 nuclear build full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 69.9 t80 . . . . . 0 N--CA 1.483 1.182 0 CA-C-O 119.486 -0.292 . . . . 0.0 110.916 . . . . . . . . . 0 0 . 1 . 043 nuclear build full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 10.0 p -165.68 151.22 2.01 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.118 0 C-N-CA 125.443 1.497 . . . . 0.0 111.178 178.706 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -133.01 145.04 50.49 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 125.934 1.694 . . . . 0.0 111.768 173.469 . . . . . . . . 2 2 . 1 . 043 nuclear build full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 42.4 mt-30 -146.9 165.63 29.18 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 124.301 1.04 . . . . 0.0 111.668 -166.89 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 96.6 m-70 -84.2 134.09 34.57 Favored 'General case' 0 CA--C 1.541 0.61 0 N-CA-C 108.948 -0.76 . . . . 0.0 108.948 156.882 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 92.0 mt -150.31 136.69 18.84 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 125.39 1.476 . . . . 0.0 108.995 -175.715 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 3.7 t -155.53 151.86 28.16 Favored 'General case' 0 N--CA 1.467 0.377 0 C-N-CA 123.294 0.638 . . . . 0.0 112.05 -177.241 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 54.62 -127.95 41.33 Favored Glycine 0 CA--C 1.531 1.06 0 C-N-CA 124.868 1.223 . . . . 0.0 113.338 178.851 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 24.8 m -62.58 -29.67 70.76 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 124.434 1.093 . . . . 0.0 111.988 -178.247 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 16.7 m80 -70.53 -39.39 74.08 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 124.065 0.946 . . . . 0.0 111.247 179.485 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 59.6 tp -67.9 -43.47 79.22 Favored 'General case' 0 N--CA 1.467 0.393 0 C-N-CA 123.998 0.919 . . . . 0.0 111.153 172.866 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 44.8 t -62.4 -39.17 83.3 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.941 0 C-N-CA 123.59 0.756 . . . . 0.0 111.812 176.028 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -66.3 -45.99 78.51 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 124.185 0.994 . . . . 0.0 111.541 173.985 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.0 -48.87 80.04 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 122.917 0.487 . . . . 0.0 111.766 177.109 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 23.4 mt -51.39 -53.27 38.21 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 124.882 1.273 . . . . 0.0 111.627 173.058 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 69.6 t80 -58.12 -42.88 86.72 Favored 'General case' 0 CA--C 1.54 0.592 0 N-CA-C 113.359 0.874 . . . . 0.0 113.359 177.846 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 89.5 mt -75.58 -32.07 60.22 Favored 'General case' 0 N--CA 1.47 0.55 0 N-CA-C 113.119 0.785 . . . . 0.0 113.119 -178.276 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 25.3 t -69.25 -44.42 80.6 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.746 0 C-N-CA 124.526 1.13 . . . . 0.0 110.795 174.175 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 80.9 m -94.74 -24.62 17.03 Favored 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 114.333 1.234 . . . . 0.0 114.333 -169.409 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 61.5 -109.11 2.28 Favored Glycine 0 CA--C 1.53 0.995 0 C-N-CA 124.327 0.965 . . . . 0.0 112.433 174.971 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -73.59 -24.19 60.03 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 124.079 0.951 . . . . 0.0 113.099 177.892 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 38.5 mtp85 -73.05 139.33 46.48 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 123.703 0.801 . . . . 0.0 110.496 172.895 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . -84.23 128.53 8.67 Favored Glycine 0 N--CA 1.467 0.743 0 C-N-CA 124.908 1.242 . . . . 0.0 111.269 -174.393 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 53.1 p90 -90.97 166.05 13.23 Favored 'General case' 0 CA--C 1.536 0.416 0 N-CA-C 113.446 0.906 . . . . 0.0 113.446 -177.73 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 70.9 t80 -148.74 109.91 4.36 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 124.987 1.315 . . . . 0.0 110.219 174.59 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 54.9 p90 -86.03 146.31 26.7 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 124.501 1.12 . . . . 0.0 111.118 171.207 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 7.3 t -163.44 146.23 8.01 Favored Pre-proline 0 N--CA 1.474 0.761 0 C-N-CA 125.002 1.321 . . . . 0.0 111.69 -178.398 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 87.9 Cg_endo -78.14 -17.47 13.39 Favored 'Trans proline' 0 C--N 1.349 0.599 0 C-N-CA 123.513 2.809 . . . . 0.0 112.758 170.68 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 85.7 tttt -114.67 141.98 47.08 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 124.675 1.19 . . . . 0.0 112.488 -164.319 . . . . . . . . 1 1 . 1 . 043 nuclear build full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 24.4 m . . . . . 0 C--O 1.251 1.174 0 C-N-CA 125.318 1.447 . . . . 0.0 111.647 -176.898 . . . . . . . . 0 0 . 1 . 044 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.72 0 N-CA-C 111.293 -0.723 . . . . 0.0 111.293 . . . . . . . . . 0 0 . 1 . 044 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -55.97 -48.3 78.85 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.334 0 C-N-CA 124.419 1.088 . . . . 0.0 113.537 -171.056 . . . . . . . . 2 2 . 1 . 044 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 93.1 t -64.05 -45.47 96.55 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.852 0 CA-C-N 118.643 0.656 . . . . 0.0 110.834 -175.853 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -64.36 -43.35 94.82 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-O 119.078 -0.487 . . . . 0.0 111.345 177.902 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 42.9 tt0 -61.35 -52.61 63.92 Favored 'General case' 0 CA--C 1.533 0.302 0 CA-C-N 118.633 0.651 . . . . 0.0 111.076 176.56 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 59.7 m -60.08 -32.76 71.26 Favored 'General case' 0 N--CA 1.467 0.38 0 N-CA-C 112.906 0.706 . . . . 0.0 112.906 -176.383 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 68.8 m -76.42 -57.39 3.89 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 123.78 0.832 . . . . 0.0 111.871 176.517 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 69.7 p -81.62 -20.61 39.36 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 124.641 1.176 . . . . 0.0 113.91 -169.168 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 10.5 t -140.86 -162.58 1.38 Allowed 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 126.73 2.012 . . . . 0.0 109.575 177.891 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 38.6 pt -93.88 147.06 5.82 Favored 'Isoleucine or valine' 0 C--O 1.236 0.362 0 O-C-N 120.932 -1.105 . . . . 0.0 112.034 176.492 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 17.2 p -137.87 165.11 27.3 Favored 'General case' 0 N--CA 1.466 0.355 0 C-N-CA 125.06 1.344 . . . . 0.0 110.231 166.747 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 13.5 t -115.96 161.67 18.5 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-O 121.604 0.716 . . . . 0.0 112.419 -179.076 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 53.0 mt -58.89 -33.39 70.45 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 125.009 1.324 . . . . 0.0 111.558 174.772 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 29.0 m-85 -58.79 -33.79 70.75 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 123.788 0.835 . . . . 0.0 113.223 171.304 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 63.4 mm-40 -83.18 -29.37 28.64 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 124.226 1.01 . . . . 0.0 111.327 177.869 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 41.1 mt -64.65 -39.96 94.6 Favored 'General case' 0 N--CA 1.471 0.608 0 CA-C-N 119.148 0.886 . . . . 0.0 111.046 168.593 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 26.9 tt0 -60.84 -27.16 67.87 Favored 'General case' 0 CA--C 1.545 0.751 0 N-CA-C 113.586 0.958 . . . . 0.0 113.586 -179.561 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 21.8 t30 -58.8 -26.29 63.95 Favored 'General case' 0 CA--C 1.548 0.882 0 O-C-N 121.062 -1.024 . . . . 0.0 113.1 173.656 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 89.7 m-85 -100.8 5.95 43.66 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 125.597 1.559 . . . . 0.0 113.967 -178.046 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 63.8 m -65.24 149.57 49.71 Favored 'General case' 0 CA--C 1.542 0.66 0 O-C-N 120.999 -1.063 . . . . 0.0 111.995 166.081 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 5.9 t30 . . . . . 0 C--O 1.252 1.192 0 C-N-CA 125.709 1.604 . . . . 0.0 112.287 176.551 . . . . . . . . 0 0 . 1 . 044 nuclear build full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 67.0 m-85 . . . . . 0 N--CA 1.487 1.386 0 CA-C-O 119.327 -0.368 . . . . 0.0 110.32 . . . . . . . . . 0 0 . 1 . 044 nuclear build full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 17.3 m -149.01 156.32 7.77 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.206 0 C-N-CA 125.143 1.377 . . . . 0.0 112.293 -173.528 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 8.7 m120 -88.2 143.82 26.82 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 125.245 1.418 . . . . 0.0 111.696 169.082 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 42.7 mt-30 -150.93 161.12 43.32 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 125.45 1.5 . . . . 0.0 111.031 -178.493 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 37.1 m-70 -80.51 136.54 36.31 Favored 'General case' 0 CA--C 1.544 0.74 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 152.122 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 90.1 mt -150.07 127.17 11.24 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 125.86 1.664 . . . . 0.0 107.727 -172.917 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 4.2 t -152.19 156.64 40.17 Favored 'General case' 0 CA--C 1.535 0.404 0 O-C-N 121.44 -0.787 . . . . 0.0 112.586 -172.375 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 61.47 -138.6 47.11 Favored Glycine 0 CA--C 1.528 0.888 0 C-N-CA 125.002 1.287 . . . . 0.0 112.941 177.386 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 23.8 p -57.01 -39.2 74.28 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 123.915 0.886 . . . . 0.0 112.516 174.996 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 17.2 m-70 -65.12 -29.17 70.01 Favored 'General case' 0 CA--C 1.545 0.763 0 O-C-N 121.131 -0.981 . . . . 0.0 113.364 -179.4 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 55.9 tp -69.49 -41.76 75.69 Favored 'General case' 0 N--CA 1.469 0.476 0 O-C-N 121.476 -0.765 . . . . 0.0 111.527 170.115 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 94.6 t -64.25 -38.7 83.19 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.901 0 C-N-CA 123.098 0.559 . . . . 0.0 110.942 175.976 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 49.7 mt-10 -64.02 -48.08 77.72 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 124.485 1.114 . . . . 0.0 111.421 173.02 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.29 -45.51 93.11 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-N 119.158 0.89 . . . . 0.0 111.752 178.233 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 53.2 tp -57.45 -51.87 67.68 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 124.403 1.081 . . . . 0.0 110.933 175.077 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 54.8 t80 -56.67 -40.59 75.81 Favored 'General case' 0 CA--C 1.539 0.548 0 N-CA-C 113.42 0.896 . . . . 0.0 113.42 175.283 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 76.7 mt -73.04 -32.2 64.92 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 124.088 0.955 . . . . 0.0 112.934 179.641 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 37.1 t -68.41 -45.88 81.51 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.752 0 C-N-CA 123.739 0.816 . . . . 0.0 110.739 171.039 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 85.0 m -75.94 -36.07 59.49 Favored 'General case' 0 CA--C 1.535 0.398 0 N-CA-C 113.389 0.885 . . . . 0.0 113.389 -175.575 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 63.64 -134.56 41.39 Favored Glycine 0 CA--C 1.531 1.069 0 C-N-CA 124.433 1.016 . . . . 0.0 111.632 -176.136 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -62.94 -17.59 62.09 Favored 'General case' 0 CA--C 1.543 0.703 0 N-CA-C 114.741 1.385 . . . . 0.0 114.741 179.06 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 84.0 mtm180 -62.96 -32.0 73.23 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 124.418 1.087 . . . . 0.0 113.344 -179.152 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 80.32 -178.9 53.68 Favored Glycine 0 CA--C 1.532 1.148 0 C-N-CA 124.707 1.146 . . . . 0.0 112.431 -171.358 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 51.7 p90 -156.04 164.77 38.02 Favored 'General case' 0 N--CA 1.469 0.493 0 N-CA-C 113.531 0.937 . . . . 0.0 113.531 -172.506 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 40.1 t80 -127.76 99.89 5.73 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 126.139 1.776 . . . . 0.0 109.502 174.5 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 84.6 t80 -82.02 129.39 34.78 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 124.986 1.314 . . . . 0.0 111.662 -178.737 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 38.9 p -127.93 80.98 71.23 Favored Pre-proline 0 N--CA 1.482 1.165 0 C-N-CA 124.737 1.215 . . . . 0.0 112.487 -170.538 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 63.0 Cg_endo -81.0 164.43 19.97 Favored 'Trans proline' 0 CA--C 1.539 0.727 0 C-N-CA 123.935 3.09 . . . . 0.0 111.013 171.585 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 89.1 mttt -75.53 151.13 38.0 Favored 'General case' 0 CA--C 1.547 0.846 0 N-CA-C 112.579 0.585 . . . . 0.0 112.579 168.341 . . . . . . . . 1 1 . 1 . 044 nuclear build full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 24.9 m . . . . . 0 N--CA 1.488 1.431 0 C-N-CA 128.684 2.794 . . . . 0.0 112.043 175.246 . . . . . . . . 0 0 . 1 . 045 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.186 0 N-CA-C 112.288 -0.325 . . . . 0.0 112.288 . . . . . . . . . 0 0 . 1 . 045 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 35.0 pt -107.9 -39.38 4.36 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.139 0 C-N-CA 127.289 2.236 . . . . 0.0 113.478 -2.286 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 73.0 t -63.07 -36.94 77.96 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.126 0 CA-C-N 119.96 1.254 . . . . 0.0 112.036 -166.711 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -84.76 -6.05 59.34 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 125.286 1.434 . . . . 0.0 113.907 179.535 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 64.1 tt0 -106.38 -57.24 2.08 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 124.904 1.282 . . . . 0.0 110.099 -178.891 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 89.7 m -66.22 -28.23 68.59 Favored 'General case' 0 N--CA 1.465 0.322 0 C-N-CA 124.881 1.273 . . . . 0.0 113.931 -178.276 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 8.4 t -80.48 -42.91 21.72 Favored 'General case' 0 CA--C 1.541 0.622 0 O-C-N 121.636 -0.665 . . . . 0.0 110.733 178.526 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 20.1 m -77.02 -33.45 57.46 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 127.386 2.274 . . . . 0.0 112.924 -173.763 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.5 t -146.07 -173.62 4.21 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 124.879 1.272 . . . . 0.0 111.142 -179.305 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 65.0 mt -74.28 134.22 29.98 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.58 0 O-C-N 120.613 -1.304 . . . . 0.0 110.256 175.192 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 8.3 p -128.6 173.1 10.57 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 124.86 1.264 . . . . 0.0 111.142 166.103 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 5.7 m -123.58 149.24 45.54 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 123.728 0.811 . . . . 0.0 110.917 -169.938 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 39.8 mt -59.49 -33.07 70.88 Favored 'General case' 0 N--CA 1.471 0.617 0 O-C-N 120.89 -1.131 . . . . 0.0 111.856 173.345 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 79.9 t80 -60.11 -28.24 67.69 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 124.366 1.066 . . . . 0.0 113.612 171.729 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 58.4 mm-40 -84.32 -36.26 22.7 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 124.131 0.973 . . . . 0.0 110.644 174.402 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 49.7 mt -60.33 -30.93 69.83 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-N 119.723 1.147 . . . . 0.0 112.278 172.13 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -59.26 -27.39 65.76 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 124.376 1.07 . . . . 0.0 113.512 176.18 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 33.3 t30 -65.74 -24.24 66.92 Favored 'General case' 0 CA--C 1.55 0.945 0 O-C-N 121.1 -1.0 . . . . 0.0 113.057 174.129 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 87.6 m-85 -99.7 5.01 45.8 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 126.081 1.752 . . . . 0.0 113.368 -176.154 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 56.5 m -63.96 154.12 35.0 Favored 'General case' 0 CA--C 1.544 0.712 0 O-C-N 121.408 -0.807 . . . . 0.0 112.025 163.575 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 21.7 t30 . . . . . 0 C--O 1.252 1.193 0 C-N-CA 126.478 1.911 . . . . 0.0 112.151 176.076 . . . . . . . . 0 0 . 1 . 045 nuclear build full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 95.4 m-85 . . . . . 0 N--CA 1.489 1.503 0 CA-C-O 119.654 -0.212 . . . . 0.0 110.759 . . . . . . . . . 0 0 . 1 . 045 nuclear build full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 7.3 p -91.68 143.03 12.15 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.001 0 C-N-CA 124.612 1.165 . . . . 0.0 110.388 170.995 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 30.5 m-20 -120.67 133.55 55.35 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 124.806 1.243 . . . . 0.0 109.745 -179.439 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 44.3 mt-30 -151.51 165.08 35.31 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 124.593 1.157 . . . . 0.0 112.181 -168.564 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 17.5 m-70 -77.07 137.22 38.81 Favored 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 108.631 -0.877 . . . . 0.0 108.631 150.951 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 70.0 mt -146.02 129.26 16.69 Favored 'General case' 0 C--N 1.331 -0.2 0 C-N-CA 125.612 1.565 . . . . 0.0 108.295 -176.565 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 4.2 t -148.67 154.36 39.55 Favored 'General case' 0 N--CA 1.465 0.316 0 C-N-CA 123.238 0.615 . . . . 0.0 111.716 -175.863 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 52.06 -129.46 35.54 Favored Glycine 0 CA--C 1.529 0.923 0 C-N-CA 125.336 1.446 . . . . 0.0 113.056 176.975 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 19.9 m -57.86 -34.62 69.94 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 124.251 1.02 . . . . 0.0 112.737 -179.32 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 75.1 m-70 -75.11 -28.96 60.44 Favored 'General case' 0 CA--C 1.541 0.602 0 O-C-N 121.073 -1.017 . . . . 0.0 113.017 177.797 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 50.1 tp -70.68 -42.63 70.47 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 119.037 0.835 . . . . 0.0 111.058 169.008 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 82.1 t -59.48 -42.45 87.88 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.106 0 CA-C-N 118.477 0.58 . . . . 0.0 111.442 172.548 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -61.83 -48.85 78.72 Favored 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 125.439 1.496 . . . . 0.0 111.843 176.458 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -64.29 -45.26 88.76 Favored 'General case' 0 CA--C 1.54 0.572 0 O-C-N 121.681 -0.637 . . . . 0.0 111.733 179.818 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 45.8 tp -59.76 -46.32 89.52 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 123.868 0.867 . . . . 0.0 110.816 175.994 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 39.1 t80 -58.8 -39.81 82.24 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 123.875 0.87 . . . . 0.0 113.183 172.965 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 68.5 mt -69.59 -31.93 70.37 Favored 'General case' 0 N--CA 1.469 0.516 0 O-C-N 121.482 -0.761 . . . . 0.0 112.952 177.993 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 70.2 t -77.35 -40.04 28.69 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.887 0 C-N-CA 124.238 1.015 . . . . 0.0 111.564 174.693 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 85.4 m -108.34 4.92 25.02 Favored 'General case' 0 N--CA 1.47 0.556 0 N-CA-C 115.246 1.573 . . . . 0.0 115.246 -167.269 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . -60.45 -24.17 61.29 Favored Glycine 0 N--CA 1.478 1.446 0 N-CA-C 116.837 1.495 . . . . 0.0 116.837 -161.469 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -77.06 -27.08 54.22 Favored 'General case' 0 CA--C 1.549 0.94 0 CA-C-N 118.406 1.103 . . . . 0.0 112.834 173.714 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 66.1 mtp180 -100.37 -35.4 9.6 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 126.238 1.815 . . . . 0.0 113.497 -174.695 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 88.88 174.43 46.82 Favored Glycine 0 CA--C 1.533 1.192 0 C-N-CA 124.738 1.161 . . . . 0.0 111.44 -159.953 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 40.4 p90 -151.17 167.76 26.77 Favored 'General case' 0 N--CA 1.475 0.775 0 N-CA-C 114.466 1.284 . . . . 0.0 114.466 -172.37 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 45.1 t80 -122.33 97.43 5.46 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 126.005 1.722 . . . . 0.0 110.401 172.406 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 71.8 t80 -74.81 130.73 39.97 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 124.942 1.297 . . . . 0.0 110.506 172.614 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 8.8 t -163.76 142.33 6.12 Favored Pre-proline 0 N--CA 1.479 0.979 0 N-CA-C 114.947 1.462 . . . . 0.0 114.947 -167.906 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 88.9 Cg_endo -86.5 142.06 6.92 Favored 'Trans proline' 0 C--N 1.35 0.615 0 C-N-CA 124.24 3.293 . . . . 0.0 110.574 157.105 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 24.4 ttpp -63.43 -46.65 85.35 Favored 'General case' 0 CA--C 1.543 0.688 0 O-C-N 121.146 -0.971 . . . . 0.0 112.448 171.344 . . . . . . . . 1 1 . 1 . 045 nuclear build full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 23.1 m . . . . . 0 C--O 1.252 1.197 0 C-N-CA 125.837 1.655 . . . . 0.0 112.245 -167.474 . . . . . . . . 0 0 . 1 . 046 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.389 0 N-CA-C 111.687 -0.565 . . . . 0.0 111.687 . . . . . . . . . 0 0 . 1 . 046 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -54.85 -35.92 35.51 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.202 0 C-N-CA 125.246 1.418 . . . . 0.0 113.994 -173.205 . . . . . . . . 2 2 . 1 . 046 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 75.8 t -62.41 -34.45 64.6 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.377 0 CA-C-N 119.296 0.953 . . . . 0.0 112.981 177.96 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 43.3 tt0 -76.98 -50.77 12.42 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-N 118.171 0.441 . . . . 0.0 110.131 169.621 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 61.2 tt0 -61.37 -40.48 94.49 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 113.483 0.92 . . . . 0.0 113.483 -169.587 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 7.5 m -64.99 -23.16 67.14 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 113.634 0.976 . . . . 0.0 113.634 174.388 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 26.6 t -94.03 -39.8 10.43 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 124.12 0.968 . . . . 0.0 112.811 -177.544 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 73.2 p -85.41 -40.7 16.15 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 124.856 1.262 . . . . 0.0 112.57 179.116 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 47.8 m -105.32 -170.23 1.72 Allowed 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 125.597 1.559 . . . . 0.0 110.152 170.515 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 11.7 tt -103.43 146.86 10.52 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.8 0 C-N-CA 124.979 1.312 . . . . 0.0 110.025 175.971 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 14.2 p -142.04 162.04 36.47 Favored 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 113.613 0.968 . . . . 0.0 113.613 -178.304 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 19.4 m -112.96 150.1 32.34 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 124.386 1.075 . . . . 0.0 111.994 -170.234 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 28.2 mt -61.1 -33.37 73.25 Favored 'General case' 0 N--CA 1.473 0.713 0 O-C-N 121.275 -0.891 . . . . 0.0 111.858 177.461 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 57.5 m-85 -62.03 -31.85 72.28 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 124.538 1.135 . . . . 0.0 113.082 173.121 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 22.6 mm100 -81.81 -31.18 31.89 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 124.407 1.083 . . . . 0.0 111.684 174.021 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 53.7 mt -62.07 -38.76 90.03 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-N 119.644 1.111 . . . . 0.0 111.397 168.472 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 28.7 tt0 -61.3 -26.02 67.51 Favored 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 113.45 0.907 . . . . 0.0 113.45 -179.396 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 16.1 t-20 -59.72 -22.96 62.76 Favored 'General case' 0 CA--C 1.551 1.015 0 O-C-N 121.156 -0.965 . . . . 0.0 113.547 173.004 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 96.2 m-85 -97.61 1.22 48.52 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 125.61 1.564 . . . . 0.0 114.033 179.574 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 59.6 m -66.88 153.58 43.13 Favored 'General case' 0 CA--C 1.543 0.706 0 O-C-N 121.144 -0.973 . . . . 0.0 111.962 168.402 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 25.6 t-20 . . . . . 0 C--O 1.255 1.389 0 C-N-CA 124.715 1.206 . . . . 0.0 112.667 178.142 . . . . . . . . 0 0 . 1 . 046 nuclear build full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 68.1 t80 . . . . . 0 N--CA 1.487 1.397 0 CA-C-O 119.97 -0.062 . . . . 0.0 110.89 . . . . . . . . . 0 0 . 1 . 046 nuclear build full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 28.6 m -74.37 155.62 6.5 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.957 0 C-N-CA 124.535 1.134 . . . . 0.0 113.454 -174.836 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 10.1 p30 -75.42 148.15 39.37 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 126.051 1.74 . . . . 0.0 111.712 170.022 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 34.3 mm-40 -150.89 162.12 41.39 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 124.282 1.033 . . . . 0.0 112.32 -162.28 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 98.1 m-70 -85.91 130.07 34.65 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 123.612 0.765 . . . . 0.0 109.046 164.185 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 90.3 mt -142.83 128.51 19.23 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 125.16 1.384 . . . . 0.0 109.445 -172.112 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 62.7 m -131.62 143.2 50.15 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 124.932 1.293 . . . . 0.0 111.046 -176.246 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 54.51 -127.44 39.83 Favored Glycine 0 N--CA 1.475 1.287 0 C-N-CA 124.846 1.212 . . . . 0.0 114.363 165.275 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 20.3 m -61.09 -33.67 73.72 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 124.152 0.981 . . . . 0.0 112.223 -177.749 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 27.2 m170 -70.93 -37.6 72.89 Favored 'General case' 0 CA--C 1.544 0.716 0 O-C-N 121.353 -0.842 . . . . 0.0 111.391 177.83 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 54.7 tp -66.38 -45.78 78.9 Favored 'General case' 0 N--CA 1.466 0.339 0 C-N-CA 123.697 0.799 . . . . 0.0 111.543 171.398 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 62.4 t -63.0 -36.44 75.8 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.785 0 C-N-CA 123.121 0.569 . . . . 0.0 111.465 177.421 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -66.14 -47.34 74.4 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 123.924 0.89 . . . . 0.0 112.046 172.278 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.47 -46.14 89.63 Favored 'General case' 0 CA--C 1.538 0.505 0 O-C-N 121.554 -0.716 . . . . 0.0 111.754 177.007 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 50.8 tp -58.5 -49.93 75.6 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 124.849 1.26 . . . . 0.0 110.997 174.828 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 52.1 t80 -56.17 -41.04 74.85 Favored 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 113.11 0.782 . . . . 0.0 113.11 174.329 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 80.1 mt -72.24 -35.51 68.85 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 123.91 0.884 . . . . 0.0 112.818 179.083 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 37.8 t -64.01 -46.14 94.73 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.912 0 C-N-CA 123.793 0.837 . . . . 0.0 110.827 171.333 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 81.5 m -78.18 -30.96 49.33 Favored 'General case' 0 N--CA 1.469 0.493 0 N-CA-C 113.437 0.902 . . . . 0.0 113.437 -175.743 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 63.92 -137.76 41.53 Favored Glycine 0 CA--C 1.531 1.057 0 C-N-CA 123.843 0.735 . . . . 0.0 111.417 -174.924 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 28.2 tt0 -67.71 -15.22 63.53 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 124.428 1.091 . . . . 0.0 113.907 -178.573 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 81.7 mtm180 -57.69 -41.11 80.96 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 124.126 0.971 . . . . 0.0 112.574 178.441 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 81.71 -178.29 53.75 Favored Glycine 0 CA--C 1.532 1.108 0 C-N-CA 124.133 0.873 . . . . 0.0 112.1 -168.591 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 52.5 p90 -159.71 167.68 27.76 Favored 'General case' 0 CA--C 1.539 0.548 0 N-CA-C 113.76 1.022 . . . . 0.0 113.76 -167.258 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 86.3 t80 -154.33 110.6 3.26 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 126.134 1.773 . . . . 0.0 109.76 166.672 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 20.8 p90 -82.42 161.37 22.49 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 125.219 1.408 . . . . 0.0 113.391 177.254 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 31.2 m -91.38 125.14 59.11 Favored Pre-proline 0 N--CA 1.477 0.894 0 C-N-CA 124.201 1.0 . . . . 0.0 108.529 164.258 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_endo -75.48 -164.14 0.22 Allowed 'Trans proline' 0 CA--C 1.543 0.933 0 C-N-CA 123.623 2.882 . . . . 0.0 112.158 -172.724 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 23.1 pttp -71.3 11.14 0.48 Allowed 'General case' 0 CA--C 1.555 1.137 0 N-CA-C 115.575 1.695 . . . . 0.0 115.575 -179.572 . . . . . . . . 1 1 . 1 . 046 nuclear build full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 20.4 p . . . . . 0 C--O 1.254 1.32 0 C-N-CA 126.332 1.853 . . . . 0.0 113.661 175.2 . . . . . . . . 0 0 . 1 . 047 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.525 0 N-CA-C 111.589 -0.604 . . . . 0.0 111.589 . . . . . . . . . 0 0 . 1 . 047 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 10.9 tp -157.6 -43.47 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.476 0.856 0 O-C-N 118.476 -2.779 . . . . 0.0 113.407 3.38 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 44.2 t -63.46 -51.3 72.39 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.385 0 CA-C-N 120.873 1.67 . . . . 0.0 112.87 -169.853 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -84.17 -32.04 24.83 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 123.395 0.678 . . . . 0.0 111.465 177.969 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 63.9 tt0 -65.88 -40.21 91.39 Favored 'General case' 0 CA--C 1.537 0.446 0 O-C-N 121.516 -0.74 . . . . 0.0 112.091 179.666 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 13.2 t -77.03 -15.95 59.45 Favored 'General case' 0 CA--C 1.539 0.543 0 N-CA-C 113.405 0.891 . . . . 0.0 113.405 174.872 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 33.8 t -82.14 -40.1 22.33 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 124.715 1.206 . . . . 0.0 112.123 174.128 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 25.8 p -85.84 -49.37 7.95 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 125.991 1.716 . . . . 0.0 112.047 179.817 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 63.3 m -97.73 -139.05 0.29 Allowed 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 125.586 1.555 . . . . 0.0 109.673 166.308 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 32.8 pt -136.06 161.15 38.24 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.783 0 C-N-CA 125.558 1.543 . . . . 0.0 111.643 -177.705 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 14.9 p -154.71 159.18 40.54 Favored 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 124.758 1.223 . . . . 0.0 112.08 170.576 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 2.3 t -106.01 165.58 11.11 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 124.104 0.962 . . . . 0.0 111.938 177.193 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.541 HD22 ' H ' ' A' ' 13' ' ' LEU . 2.0 mm? -59.99 -32.44 70.86 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.958 1.303 . . . . 0.0 111.422 178.161 . . . . . . . . 2 2 . 1 . 047 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 80.3 t80 -63.79 -26.61 68.71 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 124.56 1.144 . . . . 0.0 113.425 172.838 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 72.9 mt-30 -87.82 -31.7 19.43 Favored 'General case' 0 N--CA 1.467 0.386 0 C-N-CA 124.511 1.124 . . . . 0.0 111.17 175.518 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 70.9 mt -59.6 -38.41 81.2 Favored 'General case' 0 N--CA 1.472 0.656 0 CA-C-N 119.322 0.964 . . . . 0.0 111.171 166.018 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 27.2 tt0 -58.1 -25.83 61.83 Favored 'General case' 0 CA--C 1.548 0.885 0 N-CA-C 113.85 1.055 . . . . 0.0 113.85 179.424 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 32.0 t30 -60.78 -26.27 67.13 Favored 'General case' 0 CA--C 1.547 0.86 0 O-C-N 121.024 -1.047 . . . . 0.0 113.205 174.081 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 92.8 m-85 -100.08 5.17 44.97 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 125.75 1.62 . . . . 0.0 114.285 -175.348 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 68.8 m -64.96 160.77 19.96 Favored 'General case' 0 N--CA 1.473 0.7 0 N-CA-C 113.583 0.957 . . . . 0.0 113.583 167.818 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.253 1.267 0 C-N-CA 127.784 2.434 . . . . 0.0 112.102 175.016 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 91.5 m-85 . . . . . 0 N--CA 1.486 1.351 0 N-CA-C 110.735 -0.098 . . . . 0.0 110.735 . . . . . . . . . 0 0 . 1 . 047 nuclear build full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 9.6 p -130.07 148.58 33.17 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.059 0 C-N-CA 129.194 2.998 . . . . 0.0 110.536 3.561 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . 0.279 0.5 OUTLIER 34.96 95.95 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 128.804 2.842 . . . . 0.0 116.259 177.665 . . . . . . . . 3 3 . 1 . 047 nuclear build full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 71.3 mm-40 -123.31 168.6 12.28 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 125.242 1.417 . . . . 0.0 111.394 -168.446 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 98.4 m-70 -82.9 125.76 31.73 Favored 'General case' 0 CA--C 1.537 0.462 0 O-C-N 121.296 -0.878 . . . . 0.0 108.667 165.804 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 93.7 mt -142.62 137.08 29.76 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 125.255 1.422 . . . . 0.0 108.118 -179.668 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 4.5 t -143.68 151.83 40.57 Favored 'General case' 0 N--CA 1.466 0.374 0 N-CA-C 112.836 0.68 . . . . 0.0 112.836 -171.797 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 46.14 -128.66 10.13 Favored Glycine 0 CA--C 1.529 0.915 0 C-N-CA 125.985 1.755 . . . . 0.0 114.377 170.378 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 20.0 m -59.48 -33.12 70.93 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 124.777 1.231 . . . . 0.0 112.549 -178.619 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 97.4 m-70 -71.48 -39.81 70.63 Favored 'General case' 0 CA--C 1.541 0.605 0 O-C-N 121.088 -1.008 . . . . 0.0 111.472 178.555 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 8.2 tt -65.57 -44.35 87.0 Favored 'General case' 0 N--CA 1.466 0.329 0 C-N-CA 123.171 0.588 . . . . 0.0 111.003 170.8 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 53.3 t -64.31 -34.34 68.54 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.964 0 CA-C-N 118.406 0.548 . . . . 0.0 111.758 179.012 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -67.53 -48.09 68.02 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 123.95 0.9 . . . . 0.0 111.562 171.864 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -58.99 -44.8 91.65 Favored 'General case' 0 CA--C 1.542 0.668 0 O-C-N 121.736 -0.602 . . . . 0.0 111.775 176.141 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 61.4 tp -56.41 -52.5 64.42 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 125.603 1.561 . . . . 0.0 110.753 173.825 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 48.7 t80 -56.14 -39.78 72.82 Favored 'General case' 0 CA--C 1.543 0.69 0 N-CA-C 113.334 0.864 . . . . 0.0 113.334 174.715 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 82.7 mt -72.75 -32.53 65.72 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 123.87 0.868 . . . . 0.0 113.071 178.613 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 34.2 t -67.76 -44.56 85.64 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.995 0 C-N-CA 124.651 1.18 . . . . 0.0 110.594 171.736 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 62.4 m -83.31 -30.23 27.7 Favored 'General case' 0 N--CA 1.471 0.576 0 N-CA-C 114.375 1.25 . . . . 0.0 114.375 -173.888 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 65.32 -151.29 51.68 Favored Glycine 0 CA--C 1.533 1.203 0 C-N-CA 124.464 1.03 . . . . 0.0 112.355 -173.004 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -61.48 -13.65 22.58 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 125.535 1.534 . . . . 0.0 114.246 -178.286 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 59.1 ttm-85 -63.2 -25.43 68.33 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 125.022 1.329 . . . . 0.0 113.013 175.135 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 78.32 -171.63 55.15 Favored Glycine 0 N--CA 1.471 0.992 0 C-N-CA 124.582 1.087 . . . . 0.0 113.036 -178.785 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 50.3 p90 -162.0 166.67 25.68 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 125.028 1.331 . . . . 0.0 113.143 -170.544 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 83.9 t80 -153.51 115.52 4.32 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 125.63 1.572 . . . . 0.0 109.766 167.81 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 11.7 p90 -94.99 171.61 8.66 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 125.48 1.512 . . . . 0.0 114.356 -175.129 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 21.0 p -132.22 158.12 76.43 Favored Pre-proline 0 N--CA 1.477 0.92 0 C-N-CA 127.227 2.211 . . . . 0.0 110.284 172.385 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -72.8 -55.42 0.1 Allowed 'Trans proline' 0 CA--C 1.537 0.654 0 C-N-CA 122.331 2.02 . . . . 0.0 112.038 -177.477 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 16.2 ptpt -161.01 20.63 0.13 Allowed 'General case' 0 CA--C 1.553 1.069 0 C-N-CA 125.415 1.486 . . . . 0.0 113.331 -171.005 . . . . . . . . 1 1 . 1 . 047 nuclear build full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 25.8 m . . . . . 0 C--O 1.251 1.167 0 C-N-CA 127.829 2.451 . . . . 0.0 112.683 -175.395 . . . . . . . . 0 0 . 1 . 048 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.988 0 N-CA-C 111.74 -0.544 . . . . 0.0 111.74 . . . . . . . . . 0 0 . 1 . 048 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 24.7 pt -63.06 -27.47 43.23 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.427 0 O-C-N 121.1 -1.235 . . . . 0.0 114.192 -173.286 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 78.1 t -61.01 -31.04 48.84 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.293 0 C-N-CA 123.413 0.685 . . . . 0.0 111.86 173.743 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 -79.09 -56.89 4.04 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 123.267 0.627 . . . . 0.0 109.957 169.632 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 23.0 tt0 -67.28 -40.3 86.12 Favored 'General case' 0 N--CA 1.467 0.409 0 N-CA-C 112.823 0.675 . . . . 0.0 112.823 -164.483 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 64.5 m -66.81 -24.08 66.12 Favored 'General case' 0 CA--C 1.534 0.334 0 N-CA-C 113.666 0.987 . . . . 0.0 113.666 178.635 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 33.3 t -98.66 -37.5 9.48 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 124.015 0.926 . . . . 0.0 112.76 -175.376 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 76.8 p -88.63 -33.51 17.6 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 125.077 1.351 . . . . 0.0 113.108 178.978 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 49.0 m -117.39 -168.45 1.49 Allowed 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 125.883 1.673 . . . . 0.0 109.85 170.446 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 12.0 tt -96.66 148.07 5.73 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.659 0 O-C-N 120.834 -1.166 . . . . 0.0 109.821 171.034 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 11.0 p -138.83 166.79 23.51 Favored 'General case' 0 N--CA 1.475 0.785 0 O-C-N 121.251 -0.906 . . . . 0.0 112.828 177.714 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 22.7 t -108.99 157.89 18.23 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-O 121.786 0.803 . . . . 0.0 112.936 -177.927 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 44.4 mt -60.86 -31.12 70.59 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 123.572 0.749 . . . . 0.0 111.44 169.437 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 85.1 t80 -62.96 -28.99 70.46 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.31 1.044 . . . . 0.0 113.223 172.439 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 64.9 mt-30 -80.28 -38.18 31.31 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 123.494 0.718 . . . . 0.0 110.702 174.164 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 42.1 mt -60.49 -37.24 80.44 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-N 118.639 0.654 . . . . 0.0 112.016 170.75 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -61.31 -30.62 70.61 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 124.329 1.052 . . . . 0.0 112.923 178.881 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 14.5 t-20 -65.14 -20.75 66.61 Favored 'General case' 0 CA--C 1.55 0.963 0 O-C-N 121.461 -0.774 . . . . 0.0 112.931 177.134 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 45.4 m-85 -98.91 0.89 45.03 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 125.699 1.599 . . . . 0.0 113.74 179.964 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 60.3 m -65.13 155.51 34.66 Favored 'General case' 0 CA--C 1.544 0.747 0 O-C-N 120.942 -1.099 . . . . 0.0 112.872 172.829 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.247 0.964 0 C-N-CA 126.184 1.794 . . . . 0.0 110.476 167.819 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 84.8 m-85 . . . . . 0 N--CA 1.487 1.403 0 N-CA-C 111.285 0.106 . . . . 0.0 111.285 . . . . . . . . . 0 0 . 1 . 048 nuclear build full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 95.8 t -137.36 135.32 47.02 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.044 0 C-N-CA 125.468 1.507 . . . . 0.0 108.329 176.567 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 8.5 p30 -132.52 142.25 49.11 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 124.63 1.172 . . . . 0.0 112.516 179.701 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 54.0 mm-40 -153.42 161.18 42.55 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 125.412 1.485 . . . . 0.0 111.228 -164.985 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 92.9 m-70 -87.93 129.56 35.2 Favored 'General case' 0 CA--C 1.539 0.55 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 159.871 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 87.3 mt -142.96 123.47 13.98 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 125.304 1.442 . . . . 0.0 109.895 -172.952 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 68.5 m -127.87 142.39 51.29 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 125.449 1.499 . . . . 0.0 110.177 178.164 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 51.78 -117.03 5.46 Favored Glycine 0 N--CA 1.472 1.041 0 C-N-CA 125.221 1.391 . . . . 0.0 113.941 167.031 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 20.2 t -60.05 -37.38 79.66 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 123.769 0.828 . . . . 0.0 112.266 -178.65 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 92.6 m-70 -68.0 -40.37 83.03 Favored 'General case' 0 CA--C 1.541 0.605 0 O-C-N 120.975 -1.078 . . . . 0.0 111.4 177.21 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 52.5 tp -64.4 -46.03 85.03 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 123.763 0.825 . . . . 0.0 110.949 174.09 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 33.1 t -61.05 -38.91 80.6 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.797 0 C-N-CA 124.453 1.101 . . . . 0.0 111.988 176.475 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -64.97 -48.04 75.46 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 123.45 0.7 . . . . 0.0 111.094 174.61 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.17 -43.38 98.96 Favored 'General case' 0 CA--C 1.542 0.646 0 O-C-N 121.638 -0.664 . . . . 0.0 112.116 178.246 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 19.1 mt -56.31 -48.76 76.02 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 124.162 0.985 . . . . 0.0 111.302 172.707 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 64.1 t80 -64.91 -30.71 71.72 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 119.207 0.912 . . . . 0.0 113.095 176.845 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 73.8 mt -72.52 -36.17 68.27 Favored 'General case' 0 N--CA 1.471 0.578 0 O-C-N 121.091 -1.006 . . . . 0.0 112.981 174.799 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 73.3 t -77.14 -39.12 28.52 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.004 0 C-N-CA 123.851 0.86 . . . . 0.0 111.715 176.351 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 66.6 m -111.27 -4.3 15.01 Favored 'General case' 0 N--CA 1.476 0.843 0 N-CA-C 114.993 1.479 . . . . 0.0 114.993 -167.459 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . -74.04 145.67 35.32 Favored Glycine 0 CA--C 1.535 1.325 0 O-C-N 120.776 -1.203 . . . . 0.0 112.258 -177.246 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -86.39 -0.13 55.28 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 128.041 2.537 . . . . 0.0 113.608 0.326 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 35.7 mtp180 -63.32 -34.84 78.56 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 125.044 1.338 . . . . 0.0 113.407 -173.641 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 93.74 -179.48 38.53 Favored Glycine 0 N--CA 1.472 1.094 0 C-N-CA 125.097 1.332 . . . . 0.0 113.437 178.895 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 39.8 p90 -150.97 161.82 42.01 Favored 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 114.012 1.116 . . . . 0.0 114.012 -169.311 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 47.0 m-85 -119.74 30.93 6.8 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 126.684 1.994 . . . . 0.0 113.123 -172.346 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -52.73 150.73 4.96 Favored 'General case' 0 CA--C 1.547 0.834 0 N-CA-C 114.829 1.418 . . . . 0.0 114.829 -178.139 . . . . . . . . 2 2 . 1 . 048 nuclear build full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 5.0 t -171.71 151.22 2.79 Favored Pre-proline 0 N--CA 1.475 0.784 0 C-N-CA 124.819 1.248 . . . . 0.0 111.728 -171.216 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 93.6 Cg_endo -79.25 -17.39 11.7 Favored 'Trans proline' 0 C--N 1.353 0.794 0 C-N-CA 123.611 2.874 . . . . 0.0 112.58 165.847 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 49.5 mtpt 67.69 3.97 3.68 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 127.581 2.352 . . . . 0.0 114.575 -177.369 . . . . . . . . 1 1 . 1 . 048 nuclear build full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 22.4 p . . . . . 0 N--CA 1.483 1.199 0 C-N-CA 126.53 1.932 . . . . 0.0 113.298 177.002 . . . . . . . . 0 0 . 1 . 049 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.925 0 N-CA-C 111.519 -0.632 . . . . 0.0 111.519 . . . . . . . . . 0 0 . 1 . 049 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 29.0 pt -57.65 -31.83 40.68 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.409 0 N-CA-C 115.726 1.75 . . . . 0.0 115.726 -163.393 . . . . . . . . 1 1 . 1 . 049 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 41.8 t -64.46 -36.34 77.01 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.132 0 CA-C-N 119.139 0.881 . . . . 0.0 112.443 -174.762 . . . . . . . . 1 1 . 1 . 049 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -89.71 -49.14 6.82 Favored 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 123.263 0.625 . . . . 0.0 110.376 169.408 . . . . . . . . 1 1 . 1 . 049 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 65.3 tt0 -66.45 -40.49 89.44 Favored 'General case' 0 N--CA 1.464 0.234 0 C-N-CA 124.6 1.16 . . . . 0.0 113.013 -168.013 . . . . . . . . 1 1 . 1 . 049 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 4.3 t -82.08 -15.29 53.99 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 119.096 0.862 . . . . 0.0 112.688 -178.526 . . . . . . . . 1 1 . 1 . 049 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 49.1 t -92.16 -40.71 10.86 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 124.6 1.16 . . . . 0.0 112.363 178.423 . . . . . . . . 1 1 . 1 . 049 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 63.0 p -84.01 -44.67 13.91 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 124.996 1.318 . . . . 0.0 112.007 177.6 . . . . . . . . 1 1 . 1 . 049 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 50.5 m -106.85 -141.73 0.37 Allowed 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 125.473 1.509 . . . . 0.0 109.529 167.028 . . . . . . . . 1 1 . 1 . 049 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 45.0 pt -127.02 165.64 25.24 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.667 0 C-N-CA 125.078 1.351 . . . . 0.0 111.396 179.77 . . . . . . . . 1 1 . 1 . 049 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 16.1 p -147.09 160.61 42.2 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 123.886 0.874 . . . . 0.0 112.543 168.286 . . . . . . . . 1 1 . 1 . 049 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 25.4 t -95.97 160.05 14.66 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 124.826 1.25 . . . . 0.0 112.451 176.802 . . . . . . . . 1 1 . 1 . 049 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 52.7 mt -60.6 -34.57 74.41 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 124.07 0.948 . . . . 0.0 111.101 171.089 . . . . . . . . 1 1 . 1 . 049 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 82.6 t80 -62.63 -26.72 68.77 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 124.596 1.158 . . . . 0.0 113.091 173.197 . . . . . . . . 1 1 . 1 . 049 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 83.0 mt-30 -86.46 -38.01 17.73 Favored 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 123.887 0.875 . . . . 0.0 110.856 175.524 . . . . . . . . 1 1 . 1 . 049 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 79.6 mt -56.64 -36.66 69.76 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-N 119.315 0.961 . . . . 0.0 111.893 170.821 . . . . . . . . 1 1 . 1 . 049 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 30.1 tt0 -57.11 -25.76 59.35 Favored 'General case' 0 CA--C 1.547 0.84 0 N-CA-C 113.618 0.97 . . . . 0.0 113.618 177.908 . . . . . . . . 1 1 . 1 . 049 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 14.5 t-20 -65.65 -24.29 66.99 Favored 'General case' 0 CA--C 1.548 0.895 0 O-C-N 120.947 -1.095 . . . . 0.0 113.319 176.018 . . . . . . . . 1 1 . 1 . 049 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 89.7 m-85 -95.91 -0.32 51.02 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 126.001 1.72 . . . . 0.0 113.369 -177.268 . . . . . . . . 1 1 . 1 . 049 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 60.1 m -69.0 156.61 38.32 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 124.147 0.979 . . . . 0.0 113.127 170.073 . . . . . . . . 1 1 . 1 . 049 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.253 1.273 0 C-N-CA 124.965 1.306 . . . . 0.0 111.866 175.186 . . . . . . . . 1 1 . 1 . 049 nuclear build full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 9.6 p90 . . . . . 0 N--CA 1.486 1.327 0 N-CA-C 112.182 0.438 . . . . 0.0 112.182 . . . . . . . . . 0 0 . 1 . 049 nuclear build full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 98.3 t -83.3 131.95 32.56 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.948 0 C-N-CA 128.161 2.584 . . . . 0.0 109.178 -8.109 . . . . . . . . 1 1 . 1 . 049 nuclear build full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 1.7 p-10 -139.41 139.59 37.16 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 125.018 1.327 . . . . 0.0 111.697 -177.504 . . . . . . . . 1 1 . 1 . 049 nuclear build full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 38.6 mt-30 -148.96 163.19 38.22 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 123.858 0.863 . . . . 0.0 111.987 -161.69 . . . . . . . . 1 1 . 1 . 049 nuclear build full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 97.9 m-70 -82.7 131.6 35.2 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 108.914 -0.772 . . . . 0.0 108.914 156.282 . . . . . . . . 1 1 . 1 . 049 nuclear build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 86.7 mt -145.41 129.02 17.11 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 125.263 1.425 . . . . 0.0 110.042 -178.647 . . . . . . . . 1 1 . 1 . 049 nuclear build full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 68.8 m -130.61 142.3 50.45 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 125.614 1.565 . . . . 0.0 110.099 179.744 . . . . . . . . 1 1 . 1 . 049 nuclear build full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 52.33 -121.05 12.8 Favored Glycine 0 N--CA 1.47 0.929 0 C-N-CA 124.704 1.145 . . . . 0.0 114.087 166.588 . . . . . . . . 1 1 . 1 . 049 nuclear build full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 21.5 m -59.53 -33.49 71.45 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 124.222 1.009 . . . . 0.0 112.558 -178.214 . . . . . . . . 1 1 . 1 . 049 nuclear build full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 94.7 m-70 -71.06 -39.13 72.41 Favored 'General case' 0 CA--C 1.538 0.494 0 O-C-N 121.421 -0.799 . . . . 0.0 111.441 176.768 . . . . . . . . 1 1 . 1 . 049 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 48.1 tp -66.16 -42.53 88.87 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 123.653 0.781 . . . . 0.0 111.235 173.569 . . . . . . . . 1 1 . 1 . 049 nuclear build full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 54.7 t -60.31 -45.0 97.01 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.888 0 C-N-CA 123.784 0.833 . . . . 0.0 111.471 173.714 . . . . . . . . 1 1 . 1 . 049 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -62.67 -46.92 85.95 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 123.869 0.867 . . . . 0.0 111.313 178.074 . . . . . . . . 1 1 . 1 . 049 nuclear build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.66 -46.66 87.16 Favored 'General case' 0 CA--C 1.54 0.56 0 O-C-N 121.674 -0.641 . . . . 0.0 111.778 178.733 . . . . . . . . 1 1 . 1 . 049 nuclear build full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 49.6 tp -59.6 -49.29 78.33 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 123.94 0.896 . . . . 0.0 111.091 177.526 . . . . . . . . 1 1 . 1 . 049 nuclear build full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 53.9 t80 -52.46 -44.91 65.85 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 123.813 0.845 . . . . 0.0 112.902 173.403 . . . . . . . . 1 1 . 1 . 049 nuclear build full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 82.3 mt -70.57 -32.49 69.91 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 123.813 0.845 . . . . 0.0 113.05 179.896 . . . . . . . . 1 1 . 1 . 049 nuclear build full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 42.2 t -69.51 -43.12 80.87 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.814 0 C-N-CA 124.264 1.026 . . . . 0.0 111.238 172.5 . . . . . . . . 1 1 . 1 . 049 nuclear build full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 64.7 m -83.23 -26.38 30.83 Favored 'General case' 0 N--CA 1.469 0.51 0 N-CA-C 114.392 1.256 . . . . 0.0 114.392 -173.987 . . . . . . . . 1 1 . 1 . 049 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 63.29 -134.73 42.47 Favored Glycine 0 CA--C 1.532 1.108 0 C-N-CA 124.283 0.944 . . . . 0.0 112.252 -177.912 . . . . . . . . 1 1 . 1 . 049 nuclear build full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 32.4 mm-40 -66.92 -15.21 63.52 Favored 'General case' 0 CA--C 1.545 0.762 0 N-CA-C 114.06 1.133 . . . . 0.0 114.06 -176.913 . . . . . . . . 1 1 . 1 . 049 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 86.3 mtt-85 -61.25 -41.73 97.41 Favored 'General case' 0 N--CA 1.473 0.712 0 N-CA-C 113.571 0.952 . . . . 0.0 113.571 -178.768 . . . . . . . . 1 1 . 1 . 049 nuclear build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 79.0 -175.48 55.09 Favored Glycine 0 CA--C 1.534 1.28 0 C-N-CA 123.248 0.452 . . . . 0.0 111.997 -160.697 . . . . . . . . 1 1 . 1 . 049 nuclear build full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 33.9 p90 -160.46 165.79 30.35 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 124.662 1.185 . . . . 0.0 113.18 -166.452 . . . . . . . . 1 1 . 1 . 049 nuclear build full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 50.2 m-85 -99.68 -32.49 11.04 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 125.403 1.481 . . . . 0.0 113.336 -177.108 . . . . . . . . 1 1 . 1 . 049 nuclear build full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 91.7 t80 67.34 -39.68 0.38 Allowed 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 129.031 2.932 . . . . 0.0 116.394 174.259 . . . . . . . . 1 1 . 1 . 049 nuclear build full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 38.2 p -57.58 148.16 57.33 Favored Pre-proline 0 N--CA 1.476 0.851 0 C-N-CA 125.723 1.609 . . . . 0.0 112.855 -171.062 . . . . . . . . 1 1 . 1 . 049 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 92.1 Cg_endo -74.69 -21.91 16.11 Favored 'Trans proline' 0 C--N 1.353 0.767 0 C-N-CA 123.104 2.536 . . . . 0.0 113.175 -177.416 . . . . . . . . 1 1 . 1 . 049 nuclear build full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 22.5 ptmt -171.26 -25.61 0.01 OUTLIER 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 126.712 2.005 . . . . 0.0 113.574 -179.121 . . . . . . . . 1 1 . 1 . 049 nuclear build full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 4.0 m . . . . . 0 C--O 1.251 1.136 0 C-N-CA 127.094 2.158 . . . . 0.0 113.103 -179.528 . . . . . . . . 0 0 . 1 . 050 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.676 0 N-CA-C 110.993 -0.843 . . . . 0.0 110.993 . . . . . . . . . 0 0 . 1 . 050 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 11.4 tp -60.09 -39.56 80.78 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.01 0 N-CA-C 113.86 1.059 . . . . 0.0 113.86 -165.506 . . . . . . . . 1 1 . 1 . 050 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 85.3 t -68.7 -34.27 64.0 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.009 0 CA-C-N 119.047 0.839 . . . . 0.0 111.693 -176.595 . . . . . . . . 1 1 . 1 . 050 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 21.0 mm-40 -74.61 -46.24 39.79 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-N 118.315 0.507 . . . . 0.0 111.015 173.117 . . . . . . . . 1 1 . 1 . 050 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 73.4 tp60 -59.48 -44.8 92.97 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 123.662 0.785 . . . . 0.0 111.653 -178.673 . . . . . . . . 1 1 . 1 . 050 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 62.5 m -70.44 -25.92 63.42 Favored 'General case' 0 N--CA 1.466 0.366 0 N-CA-C 114.758 1.392 . . . . 0.0 114.758 179.715 . . . . . . . . 1 1 . 1 . 050 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 17.3 t -106.74 -36.61 6.65 Favored 'General case' 0 CA--C 1.541 0.611 0 N-CA-C 113.701 1.001 . . . . 0.0 113.701 -168.937 . . . . . . . . 1 1 . 1 . 050 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 46.7 p -85.43 -33.02 22.02 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 124.637 1.175 . . . . 0.0 112.055 175.51 . . . . . . . . 1 1 . 1 . 050 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 65.6 m -121.42 -161.62 0.92 Allowed 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 126.68 1.992 . . . . 0.0 109.63 171.303 . . . . . . . . 1 1 . 1 . 050 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 48.4 pt -97.06 157.9 3.26 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.518 0 O-C-N 121.203 -0.935 . . . . 0.0 111.243 168.038 . . . . . . . . 1 1 . 1 . 050 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 21.4 p -137.55 163.83 30.23 Favored 'General case' 0 N--CA 1.466 0.359 0 C-N-CA 124.235 1.014 . . . . 0.0 111.498 170.431 . . . . . . . . 1 1 . 1 . 050 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 32.2 m -104.86 149.18 25.89 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 123.932 0.893 . . . . 0.0 111.215 -177.353 . . . . . . . . 1 1 . 1 . 050 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 56.3 mt -58.71 -32.12 68.89 Favored 'General case' 0 N--CA 1.471 0.611 0 O-C-N 121.358 -0.839 . . . . 0.0 111.686 174.876 . . . . . . . . 1 1 . 1 . 050 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 72.7 t80 -62.22 -27.98 69.37 Favored 'General case' 0 CA--C 1.542 0.646 0 N-CA-C 113.817 1.043 . . . . 0.0 113.817 171.649 . . . . . . . . 1 1 . 1 . 050 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 20.9 mm100 -83.5 -34.2 25.39 Favored 'General case' 0 N--CA 1.465 0.301 0 C-N-CA 124.124 0.97 . . . . 0.0 111.088 175.911 . . . . . . . . 1 1 . 1 . 050 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 10.9 mp -56.1 -49.14 74.68 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-N 118.692 0.678 . . . . 0.0 110.385 165.961 . . . . . . . . 1 1 . 1 . 050 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 4.0 tm-20 -61.99 -39.65 92.93 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 124.898 1.279 . . . . 0.0 112.39 178.694 . . . . . . . . 1 1 . 1 . 050 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 21.6 t30 -64.93 -35.12 80.15 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 123.989 0.916 . . . . 0.0 113.239 175.605 . . . . . . . . 1 1 . 1 . 050 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -74.37 -20.86 59.92 Favored 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 114.116 1.154 . . . . 0.0 114.116 178.969 . . . . . . . . 1 1 . 1 . 050 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 77.2 m -66.52 159.07 28.09 Favored 'General case' 0 CA--C 1.54 0.596 0 N-CA-C 114.407 1.262 . . . . 0.0 114.407 178.13 . . . . . . . . 1 1 . 1 . 050 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.251 1.141 0 C-N-CA 125.604 1.561 . . . . 0.0 114.147 -166.718 . . . . . . . . 1 1 . 1 . 050 nuclear build full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 60.1 m-85 . . . . . 0 N--CA 1.487 1.415 0 CA-C-O 119.845 -0.121 . . . . 0.0 111.268 . . . . . . . . . 0 0 . 1 . 050 nuclear build full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 83.5 t -78.55 135.63 25.58 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.971 0 C-N-CA 123.792 0.837 . . . . 0.0 108.886 170.448 . . . . . . . . 1 1 . 1 . 050 nuclear build full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -133.05 141.14 48.07 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 124.512 1.125 . . . . 0.0 112.345 177.905 . . . . . . . . 2 2 . 1 . 050 nuclear build full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 27.7 mm-40 -148.88 164.22 35.14 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 124.968 1.307 . . . . 0.0 111.19 -165.438 . . . . . . . . 1 1 . 1 . 050 nuclear build full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 94.7 m-70 -85.59 132.17 34.22 Favored 'General case' 0 CA--C 1.538 0.516 0 N-CA-C 108.991 -0.744 . . . . 0.0 108.991 155.407 . . . . . . . . 1 1 . 1 . 050 nuclear build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 97.3 mt -144.55 130.6 19.44 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 125.706 1.603 . . . . 0.0 109.154 -178.216 . . . . . . . . 1 1 . 1 . 050 nuclear build full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 86.0 m -137.67 147.51 44.94 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 125.06 1.344 . . . . 0.0 110.389 -176.436 . . . . . . . . 1 1 . 1 . 050 nuclear build full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 55.66 -131.53 49.43 Favored Glycine 0 N--CA 1.472 1.052 0 C-N-CA 124.278 0.942 . . . . 0.0 113.658 166.178 . . . . . . . . 1 1 . 1 . 050 nuclear build full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 21.1 m -61.28 -31.07 70.89 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 124.603 1.161 . . . . 0.0 112.524 -178.415 . . . . . . . . 1 1 . 1 . 050 nuclear build full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 94.2 m-70 -70.09 -39.33 75.62 Favored 'General case' 0 CA--C 1.539 0.547 0 O-C-N 121.365 -0.835 . . . . 0.0 111.359 176.854 . . . . . . . . 1 1 . 1 . 050 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 51.4 tp -65.94 -44.4 85.19 Favored 'General case' 0 C--N 1.343 0.317 0 CA-C-O 118.594 -0.717 . . . . 0.0 111.043 170.964 . . . . . . . . 1 1 . 1 . 050 nuclear build full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 71.3 t -57.96 -44.94 87.8 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.102 0 CA-C-N 118.884 0.766 . . . . 0.0 111.624 176.171 . . . . . . . . 1 1 . 1 . 050 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -63.55 -47.58 80.98 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 123.702 0.801 . . . . 0.0 111.248 177.664 . . . . . . . . 1 1 . 1 . 050 nuclear build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.71 -48.44 81.78 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 123.3 0.64 . . . . 0.0 111.409 178.524 . . . . . . . . 1 1 . 1 . 050 nuclear build full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 50.1 tp -58.49 -47.41 84.17 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 125.683 1.593 . . . . 0.0 111.622 179.24 . . . . . . . . 1 1 . 1 . 050 nuclear build full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 82.0 t80 -59.16 -42.18 90.15 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 123.948 0.899 . . . . 0.0 113.2 174.032 . . . . . . . . 1 1 . 1 . 050 nuclear build full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 89.4 mt -75.89 -33.04 59.93 Favored 'General case' 0 N--CA 1.471 0.614 0 N-CA-C 113.191 0.812 . . . . 0.0 113.191 -179.743 . . . . . . . . 1 1 . 1 . 050 nuclear build full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 23.7 t -65.38 -45.54 92.86 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.734 0 C-N-CA 124.619 1.168 . . . . 0.0 110.598 173.792 . . . . . . . . 1 1 . 1 . 050 nuclear build full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 71.5 m -90.72 -27.36 19.01 Favored 'General case' 0 N--CA 1.47 0.542 0 N-CA-C 114.349 1.241 . . . . 0.0 114.349 -172.467 . . . . . . . . 1 1 . 1 . 050 nuclear build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . -53.31 133.68 42.14 Favored Glycine 0 CA--C 1.536 1.379 0 C-N-CA 124.193 0.902 . . . . 0.0 112.851 -171.977 . . . . . . . . 1 1 . 1 . 050 nuclear build full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -77.71 -11.48 59.88 Favored 'General case' 0 CA--C 1.551 0.996 0 C-N-CA 128.501 2.72 . . . . 0.0 115.006 10.843 . . . . . . . . 1 1 . 1 . 050 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 55.0 ttp85 -65.67 140.9 58.52 Favored 'General case' 0 N--CA 1.473 0.708 0 O-C-N 120.826 -1.171 . . . . 0.0 111.87 178.669 . . . . . . . . 1 1 . 1 . 050 nuclear build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . -80.94 151.01 31.38 Favored Glycine 0 N--CA 1.47 0.931 0 C-N-CA 125.342 1.449 . . . . 0.0 112.648 -173.877 . . . . . . . . 1 1 . 1 . 050 nuclear build full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 45.3 p90 -105.83 166.92 10.13 Favored 'General case' 0 CA--C 1.536 0.439 0 N-CA-C 114.57 1.322 . . . . 0.0 114.57 -173.393 . . . . . . . . 1 1 . 1 . 050 nuclear build full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 45.1 t80 -137.0 136.81 38.8 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 126.35 1.86 . . . . 0.0 109.206 171.553 . . . . . . . . 1 1 . 1 . 050 nuclear build full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 66.5 t80 -135.6 125.6 25.93 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 125.613 1.565 . . . . 0.0 110.627 -164.847 . . . . . . . . 1 1 . 1 . 050 nuclear build full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 8.8 t -162.45 143.77 7.97 Favored Pre-proline 0 N--CA 1.477 0.925 0 C-N-CA 123.96 0.904 . . . . 0.0 113.07 -171.295 . . . . . . . . 1 1 . 1 . 050 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 93.0 Cg_endo -77.1 -17.05 15.41 Favored 'Trans proline' 0 C--N 1.352 0.741 0 C-N-CA 123.44 2.76 . . . . 0.0 113.229 168.355 . . . . . . . . 1 1 . 1 . 050 nuclear build full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 18.1 ttpp -114.91 139.42 49.81 Favored 'General case' 0 CA--C 1.543 0.673 0 C-N-CA 124.102 0.961 . . . . 0.0 112.588 -164.699 . . . . . . . . 1 1 . 1 . 050 nuclear build full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 20.6 m . . . . . 0 C--O 1.254 1.295 0 C-N-CA 125.023 1.329 . . . . 0.0 111.273 173.752 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 44.6 t . . . . . 0 N--CA 1.481 1.119 0 N-CA-C 112.315 0.487 . . . . 0.0 112.315 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -95.19 -52.95 3.97 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-N 119.478 1.035 . . . . 0.0 111.702 164.399 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 68.9 tp60 -64.18 -33.81 76.65 Favored 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 113.087 0.773 . . . . 0.0 113.087 -169.268 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 98.2 m -85.78 -28.17 24.72 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 119.5 1.045 . . . . 0.0 113.387 176.46 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 45.4 t -97.38 -60.1 1.65 Allowed 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 123.385 0.674 . . . . 0.0 112.65 -171.382 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 35.6 m -73.49 -41.71 62.75 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 125.748 1.619 . . . . 0.0 110.141 -179.157 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.4 t -102.49 -163.39 1.0 Allowed 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 124.045 0.938 . . . . 0.0 111.189 165.328 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 35.0 mt -108.25 145.1 15.73 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.743 0 C-N-CA 125.8 1.64 . . . . 0.0 110.499 175.916 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 10.2 p -133.32 163.83 28.45 Favored 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 112.957 0.725 . . . . 0.0 112.957 169.186 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 65.6 p -101.52 161.97 13.24 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 124.514 1.126 . . . . 0.0 113.703 176.519 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 52.5 mt -62.56 -34.37 76.81 Favored 'General case' 0 CA--C 1.539 0.532 0 O-C-N 121.308 -0.87 . . . . 0.0 111.696 171.0 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 91.2 t80 -63.61 -32.84 74.44 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 124.056 0.942 . . . . 0.0 112.748 173.356 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 91.6 mt-30 -73.62 -39.82 64.25 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-O 118.293 -0.861 . . . . 0.0 111.682 171.673 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 84.7 mt -59.82 -34.08 72.61 Favored 'General case' 0 N--CA 1.476 0.857 0 CA-C-N 119.825 1.193 . . . . 0.0 112.175 173.448 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 26.5 tt0 -60.56 -24.29 65.3 Favored 'General case' 0 CA--C 1.548 0.892 0 N-CA-C 113.326 0.861 . . . . 0.0 113.326 178.854 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 30.7 t30 -65.59 -25.65 67.5 Favored 'General case' 0 CA--C 1.546 0.799 0 O-C-N 121.046 -1.034 . . . . 0.0 113.058 173.837 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 97.0 m-85 -99.11 2.5 46.06 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 125.404 1.482 . . . . 0.0 113.899 -174.515 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 57.6 m . . . . . 0 CA--C 1.543 0.683 0 C-N-CA 123.871 0.868 . . . . 0.0 112.768 165.358 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 2.9 p-10 . . . . . 0 CA--C 1.538 0.512 0 N-CA-C 112.548 0.573 . . . . 0.0 112.548 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 30.2 mm-40 -153.79 168.58 25.82 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 125.084 1.354 . . . . 0.0 112.007 -168.147 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 80.0 m-70 -82.61 129.06 34.87 Favored 'General case' 0 CA--C 1.545 0.765 0 N-CA-C 109.241 -0.652 . . . . 0.0 109.241 155.289 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 79.7 mt -142.37 125.19 16.03 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 126.74 2.016 . . . . 0.0 108.977 -177.355 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 79.0 m -132.43 143.98 50.17 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 124.943 1.297 . . . . 0.0 111.392 -174.222 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 55.42 -122.52 26.77 Favored Glycine 0 N--CA 1.474 1.218 0 C-N-CA 124.923 1.249 . . . . 0.0 113.861 168.037 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 22.2 m -61.73 -33.43 74.02 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 123.747 0.819 . . . . 0.0 111.554 -179.644 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 20.9 m80 -72.69 -37.65 67.78 Favored 'General case' 0 CA--C 1.538 0.502 0 O-C-N 121.249 -0.907 . . . . 0.0 111.279 178.826 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 51.9 tp -63.12 -48.37 78.81 Favored 'General case' 0 N--CA 1.467 0.416 0 C-N-CA 124.056 0.943 . . . . 0.0 111.003 170.801 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 55.4 t -63.49 -37.74 80.38 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.87 0 C-N-CA 123.473 0.709 . . . . 0.0 111.946 178.743 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -66.5 -47.77 71.92 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 124.169 0.987 . . . . 0.0 111.839 174.207 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.69 -44.71 96.19 Favored 'General case' 0 CA--C 1.536 0.436 0 O-C-N 121.772 -0.58 . . . . 0.0 111.892 178.077 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 48.6 tp -58.55 -50.88 72.18 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 124.408 1.083 . . . . 0.0 110.858 174.932 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 50.8 t80 -56.92 -39.02 73.69 Favored 'General case' 0 CA--C 1.544 0.725 0 N-CA-C 113.286 0.847 . . . . 0.0 113.286 174.652 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 77.1 mt -71.12 -33.58 70.25 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 123.725 0.81 . . . . 0.0 112.878 177.94 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 42.5 t -68.31 -43.13 84.65 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.967 0 C-N-CA 124.067 0.947 . . . . 0.0 111.093 172.144 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 66.6 m -83.9 -29.31 27.27 Favored 'General case' 0 N--CA 1.471 0.625 0 N-CA-C 114.304 1.224 . . . . 0.0 114.304 -174.063 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 70.47 -159.23 53.63 Favored Glycine 0 CA--C 1.532 1.114 0 C-N-CA 124.653 1.12 . . . . 0.0 112.281 -170.721 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -64.1 -10.63 23.65 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 124.851 1.261 . . . . 0.0 114.185 -179.506 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 23.1 ttp85 -58.26 -31.62 67.6 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 125.287 1.435 . . . . 0.0 112.993 173.105 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 86.29 -176.65 48.59 Favored Glycine 0 CA--C 1.532 1.147 0 C-N-CA 124.412 1.006 . . . . 0.0 114.148 -179.671 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 49.5 p90 -163.91 172.67 13.65 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 124.654 1.181 . . . . 0.0 112.938 -164.091 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 91.5 t80 . . . . . 0 CA--C 1.538 0.486 0 C-N-CA 125.417 1.487 . . . . 0.0 110.048 166.219 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . 0.508 HG13 ' H ' ' B' ' 8' ' ' GLY . 78.3 t . . . . . 0 N--CA 1.477 0.907 0 CA-C-O 119.432 -0.318 . . . . 0.0 111.454 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -67.42 -48.57 66.92 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 118.343 0.519 . . . . 0.0 110.222 -178.886 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 22.2 tt0 -61.16 -55.84 27.64 Favored 'General case' 0 N--CA 1.466 0.357 0 C-N-CA 124.775 1.23 . . . . 0.0 111.284 -179.716 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 78.1 m -68.76 -19.76 64.34 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 114.271 1.211 . . . . 0.0 114.271 -175.129 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 17.9 t -90.44 -41.24 11.56 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 124.398 1.079 . . . . 0.0 112.893 176.946 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 1.4 t -79.61 -37.68 35.6 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 123.632 0.773 . . . . 0.0 112.413 179.15 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 10.3 t -107.63 -149.96 0.44 Allowed 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 125.907 1.683 . . . . 0.0 109.637 169.098 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 27.1 pt -123.08 149.35 26.81 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.444 0 C-N-CA 125.61 1.564 . . . . 0.0 111.481 177.092 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 58.2 m -128.18 162.86 25.96 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 125.399 1.48 . . . . 0.0 111.005 172.453 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 99.5 p -114.47 165.29 12.89 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 124.748 1.219 . . . . 0.0 112.698 -178.415 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 61.1 mt -62.0 -33.41 74.27 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 123.245 0.618 . . . . 0.0 111.756 173.522 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 88.7 t80 -67.26 -34.46 77.47 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 123.566 0.746 . . . . 0.0 113.0 172.806 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 38.9 mt-30 -72.19 -38.17 69.14 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-O 118.768 -0.634 . . . . 0.0 111.052 173.321 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 85.9 mt -60.58 -40.82 93.1 Favored 'General case' 0 CA--C 1.538 0.498 0 CA-C-N 119.128 0.877 . . . . 0.0 111.476 169.03 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 25.7 tt0 -65.45 -33.62 76.36 Favored 'General case' 0 CA--C 1.543 0.709 0 CA-C-N 118.517 0.598 . . . . 0.0 112.406 177.844 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 34.3 t30 -65.15 -22.94 66.99 Favored 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 123.755 0.822 . . . . 0.0 113.032 173.228 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 13.9 m-85 -87.41 -6.59 58.38 Favored 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 124.908 1.283 . . . . 0.0 113.636 176.069 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 70.2 m . . . . . 0 N--CA 1.473 0.71 0 O-C-N 120.914 -1.116 . . . . 0.0 113.518 177.302 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 7.4 m-80 . . . . . 0 CA--C 1.537 0.452 0 CA-C-O 121.135 0.493 . . . . 0.0 111.536 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 38.3 mt-30 -145.58 158.71 43.81 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 125.565 1.546 . . . . 0.0 110.617 -173.877 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 99.5 m-70 -82.34 130.19 35.04 Favored 'General case' 0 CA--C 1.539 0.535 0 N-CA-C 108.289 -1.004 . . . . 0.0 108.289 158.305 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 85.2 mt -138.02 121.53 17.25 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 124.582 1.153 . . . . 0.0 109.732 -173.8 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 33.5 m -131.22 135.19 47.16 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.741 1.216 . . . . 0.0 110.476 -172.91 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 8' ' ' GLY . . . . . 0.508 ' H ' HG13 ' A' ' 3' ' ' VAL . . . 50.42 -120.7 8.92 Favored Glycine 0 CA--C 1.529 0.914 0 C-N-CA 125.163 1.363 . . . . 0.0 114.526 168.54 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 25.2 p -62.02 -32.52 73.02 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 124.484 1.114 . . . . 0.0 113.063 -179.686 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 94.0 m-70 -68.98 -38.62 79.45 Favored 'General case' 0 CA--C 1.538 0.519 0 O-C-N 121.172 -0.955 . . . . 0.0 111.385 175.269 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 8.7 tt -64.0 -48.98 74.25 Favored 'General case' 0 C--N 1.344 0.355 0 CA-C-O 118.875 -0.583 . . . . 0.0 110.552 171.459 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 53.9 t -59.85 -40.5 82.91 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.994 0 C-N-CA 123.234 0.614 . . . . 0.0 111.841 179.864 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -63.4 -49.9 71.96 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 123.676 0.79 . . . . 0.0 111.807 175.404 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.01 -45.98 91.23 Favored 'General case' 0 CA--C 1.539 0.523 0 O-C-N 121.79 -0.569 . . . . 0.0 111.564 178.957 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 40.4 tp -58.26 -51.53 69.4 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 125.619 1.567 . . . . 0.0 111.395 177.857 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 68.7 t80 -55.44 -42.59 74.41 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 123.762 0.825 . . . . 0.0 112.652 174.454 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 87.7 mt -73.7 -32.19 63.8 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 123.951 0.9 . . . . 0.0 113.179 -179.31 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 34.5 t -69.1 -45.25 80.17 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.885 0 C-N-CA 124.025 0.93 . . . . 0.0 110.341 171.883 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 74.0 m -77.06 -35.39 56.71 Favored 'General case' 0 N--CA 1.468 0.44 0 N-CA-C 113.385 0.883 . . . . 0.0 113.385 -175.181 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 62.58 -129.79 42.61 Favored Glycine 0 CA--C 1.532 1.094 0 C-N-CA 123.982 0.801 . . . . 0.0 111.254 -175.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -66.57 -14.36 62.26 Favored 'General case' 0 CA--C 1.546 0.802 0 N-CA-C 114.073 1.138 . . . . 0.0 114.073 179.344 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 84.5 mtm180 -69.09 -24.64 64.16 Favored 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 113.672 0.989 . . . . 0.0 113.672 -177.457 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 69.09 -175.48 31.86 Favored Glycine 0 N--CA 1.472 1.064 0 C-N-CA 124.027 0.822 . . . . 0.0 112.446 -170.697 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 44.2 p90 -154.11 157.66 39.26 Favored 'General case' 0 CA--C 1.539 0.545 0 N-CA-C 115.187 1.551 . . . . 0.0 115.187 -174.367 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 91.6 t80 . . . . . 0 CA--C 1.538 0.486 0 C-N-CA 126.476 1.911 . . . . 0.0 109.981 161.514 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 70.5 t . . . . . 0 N--CA 1.479 1.016 0 N-CA-C 111.781 0.289 . . . . 0.0 111.781 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -83.18 -50.23 8.66 Favored 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 123.779 0.832 . . . . 0.0 110.898 171.357 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 31.7 tt0 -64.7 -45.93 84.53 Favored 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 123.6 0.76 . . . . 0.0 112.298 -169.386 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 11.6 m -67.36 -17.89 64.93 Favored 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 113.501 0.926 . . . . 0.0 113.501 175.983 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 28.1 t -95.21 -42.56 8.5 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 124.396 1.078 . . . . 0.0 112.293 -176.506 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 54.3 p -87.2 -33.21 19.42 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 126.002 1.721 . . . . 0.0 112.571 -178.823 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 7.8 t -109.79 -170.25 1.62 Allowed 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 124.805 1.242 . . . . 0.0 110.103 165.797 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 11.8 tt -101.76 147.04 9.01 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.629 0 C-N-CA 125.28 1.432 . . . . 0.0 110.093 173.614 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 16.7 p -140.61 157.91 44.76 Favored 'General case' 0 N--CA 1.474 0.772 0 N-CA-C 112.974 0.731 . . . . 0.0 112.974 176.985 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 83.8 p -104.29 157.57 17.05 Favored 'General case' 0 N--CA 1.469 0.492 0 N-CA-C 114.361 1.245 . . . . 0.0 114.361 -173.916 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 62.5 mt -58.26 -32.53 68.46 Favored 'General case' 0 N--CA 1.47 0.526 0 O-C-N 121.633 -0.667 . . . . 0.0 111.675 173.203 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 84.6 t80 -66.21 -29.68 70.0 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 124.379 1.072 . . . . 0.0 113.685 172.754 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 89.0 mt-30 -81.23 -32.25 33.49 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 124.08 0.952 . . . . 0.0 111.07 174.636 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 8.4 mp -62.88 -42.67 99.85 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 123.437 0.695 . . . . 0.0 111.491 167.75 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 29.4 tt0 -62.64 -25.02 67.91 Favored 'General case' 0 CA--C 1.545 0.766 0 N-CA-C 113.532 0.938 . . . . 0.0 113.532 -177.357 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 24.8 t30 -55.03 -27.51 45.05 Favored 'General case' 0 CA--C 1.547 0.827 0 C-N-CA 124.281 1.032 . . . . 0.0 113.22 173.805 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 97.8 m-85 -97.58 0.87 48.14 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 125.443 1.497 . . . . 0.0 114.487 -176.458 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 65.2 m . . . . . 0 N--CA 1.474 0.726 0 O-C-N 121.369 -0.832 . . . . 0.0 112.818 174.261 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 52.3 p-10 . . . . . 0 CA--C 1.543 0.704 0 N-CA-C 112.975 0.732 . . . . 0.0 112.975 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 41.3 mt-30 -151.05 161.34 42.91 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 125.532 1.533 . . . . 0.0 110.845 -167.018 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 98.4 m-70 -89.85 128.72 36.23 Favored 'General case' 0 CA--C 1.54 0.57 0 N-CA-C 109.297 -0.631 . . . . 0.0 109.297 159.691 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 90.8 mt -141.1 126.6 18.82 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 125.246 1.418 . . . . 0.0 109.577 -172.653 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 39.9 m -128.65 135.9 49.93 Favored 'General case' 0 N--CA 1.466 0.334 0 C-N-CA 124.516 1.126 . . . . 0.0 110.967 -175.218 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 49.68 -117.02 4.19 Favored Glycine 0 CA--C 1.529 0.916 0 C-N-CA 125.415 1.484 . . . . 0.0 113.694 168.365 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 22.3 m -59.56 -32.92 70.79 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 124.609 1.164 . . . . 0.0 112.931 -179.389 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 94.0 m-70 -72.26 -37.64 69.04 Favored 'General case' 0 CA--C 1.539 0.547 0 O-C-N 121.23 -0.919 . . . . 0.0 111.423 177.129 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 59.8 tp -67.11 -43.12 83.26 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 123.155 0.582 . . . . 0.0 110.99 171.981 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 40.4 t -60.17 -42.76 91.32 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.907 0 C-N-CA 124.335 1.054 . . . . 0.0 111.915 175.589 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -63.42 -47.31 82.5 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 123.65 0.78 . . . . 0.0 111.337 173.717 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.6 -42.83 99.42 Favored 'General case' 0 CA--C 1.541 0.606 0 O-C-N 121.303 -0.873 . . . . 0.0 112.446 178.439 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 28.7 mt -57.75 -50.56 72.83 Favored 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 124.124 0.969 . . . . 0.0 110.931 174.453 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 80.5 t80 -55.94 -41.16 74.21 Favored 'General case' 0 CA--C 1.541 0.632 0 N-CA-C 112.997 0.74 . . . . 0.0 112.997 175.007 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 88.2 mt -73.8 -35.97 64.97 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 123.834 0.854 . . . . 0.0 113.234 179.73 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 26.1 t -66.96 -44.29 88.67 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.948 0 C-N-CA 124.687 1.195 . . . . 0.0 110.542 173.84 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 71.0 m -77.62 -32.15 53.3 Favored 'General case' 0 CA--C 1.537 0.449 0 N-CA-C 112.803 0.668 . . . . 0.0 112.803 -176.235 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 68.62 -113.88 5.57 Favored Glycine 0 CA--C 1.529 0.926 0 C-N-CA 124.406 1.003 . . . . 0.0 111.814 173.055 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 37.6 mm-40 -71.09 -21.55 62.21 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 123.853 0.861 . . . . 0.0 112.711 174.882 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 83.6 mtm180 -75.18 155.49 36.86 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 124.923 1.289 . . . . 0.0 111.215 174.534 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . -74.89 179.63 44.37 Favored Glycine 0 CA--C 1.53 1.017 0 C-N-CA 124.246 0.927 . . . . 0.0 111.253 168.087 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 32.2 p90 -154.42 171.24 19.65 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 124.416 1.086 . . . . 0.0 112.61 -177.255 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 76.9 t80 . . . . . 0 CA--C 1.539 0.544 0 C-N-CA 125.348 1.459 . . . . 0.0 111.582 178.59 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 54.8 t . . . . . 0 N--CA 1.48 1.066 0 CA-C-O 119.17 -0.443 . . . . 0.0 110.782 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -62.77 -43.99 97.35 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 118.705 0.684 . . . . 0.0 110.572 178.925 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 16.9 tt0 -56.78 -55.68 31.24 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 123.961 0.904 . . . . 0.0 111.25 175.44 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -80.03 -16.92 54.08 Favored 'General case' 0 CA--C 1.541 0.608 0 N-CA-C 114.558 1.318 . . . . 0.0 114.558 -172.209 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 38.4 t -99.33 -50.47 4.11 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 124.127 0.971 . . . . 0.0 112.513 -176.817 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 29.8 m -78.99 -39.83 33.16 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 124.611 1.164 . . . . 0.0 110.726 -178.059 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 10.5 t -104.24 -154.54 0.51 Allowed 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 124.236 1.014 . . . . 0.0 109.908 159.419 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 29.8 pt -112.4 161.47 11.17 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.651 0 C-N-CA 126.117 1.767 . . . . 0.0 111.595 175.953 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 1.6 p -147.08 169.34 19.46 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 123.457 0.703 . . . . 0.0 112.477 165.015 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 70.5 m -112.32 154.19 26.07 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 124.048 0.939 . . . . 0.0 112.956 -170.104 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 62.2 mt -59.09 -29.95 67.73 Favored 'General case' 0 N--CA 1.468 0.456 0 O-C-N 121.197 -0.94 . . . . 0.0 112.189 176.757 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 79.2 t80 -67.48 -26.37 66.33 Favored 'General case' 0 CA--C 1.545 0.77 0 N-CA-C 113.889 1.07 . . . . 0.0 113.889 171.97 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 59.9 mt-30 -77.85 -40.43 40.23 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 123.517 0.727 . . . . 0.0 109.655 171.719 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 9.2 mp -57.47 -39.93 77.45 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 118.401 0.546 . . . . 0.0 111.459 169.571 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -64.7 -37.35 87.31 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 124.307 1.043 . . . . 0.0 112.34 175.854 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 21.8 t30 -66.76 -27.63 67.75 Favored 'General case' 0 CA--C 1.545 0.762 0 O-C-N 121.213 -0.929 . . . . 0.0 112.732 172.721 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 18.9 m-85 -85.31 -4.02 59.02 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 125.14 1.376 . . . . 0.0 113.638 177.699 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 79.2 m . . . . . 0 CA--C 1.541 0.619 0 O-C-N 120.8 -1.188 . . . . 0.0 112.718 172.596 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 5.4 p-10 . . . . . 0 N--CA 1.469 0.513 0 CA-C-O 120.671 0.272 . . . . 0.0 111.618 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 38.9 mt-30 -149.25 163.63 37.1 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 124.429 1.091 . . . . 0.0 111.045 -171.625 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 96.0 m-70 -88.49 126.38 35.22 Favored 'General case' 0 CA--C 1.542 0.641 0 N-CA-C 107.991 -1.114 . . . . 0.0 107.991 154.411 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 85.1 mt -136.64 129.21 30.38 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 125.383 1.473 . . . . 0.0 109.008 -179.979 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 60.2 m -131.67 137.09 48.17 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 124.434 1.094 . . . . 0.0 110.788 -173.614 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 49.37 -120.23 7.21 Favored Glycine 0 N--CA 1.47 0.935 0 C-N-CA 125.06 1.315 . . . . 0.0 113.897 169.648 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 26.9 m -59.28 -31.3 68.99 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 124.81 1.244 . . . . 0.0 112.668 -178.167 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 96.8 m-70 -73.35 -35.96 66.07 Favored 'General case' 0 CA--C 1.541 0.603 0 O-C-N 121.317 -0.864 . . . . 0.0 111.561 177.697 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 32.9 tp -70.3 -40.8 74.04 Favored 'General case' 0 CA--C 1.536 0.44 0 O-C-N 121.667 -0.646 . . . . 0.0 111.392 171.237 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 56.1 t -58.61 -43.48 87.46 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.159 0 C-N-CA 123.569 0.748 . . . . 0.0 111.546 173.093 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -64.41 -45.92 85.48 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 123.703 0.801 . . . . 0.0 111.572 175.194 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.06 -44.31 96.95 Favored 'General case' 0 CA--C 1.541 0.606 0 O-C-N 121.592 -0.693 . . . . 0.0 112.141 178.438 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 34.5 mt -58.51 -48.13 81.82 Favored 'General case' 0 N--CA 1.464 0.253 0 C-N-CA 124.264 1.025 . . . . 0.0 110.876 174.257 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 90.7 t80 -57.63 -38.9 75.78 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-N 118.821 0.737 . . . . 0.0 112.495 175.465 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 84.6 mt -75.78 -36.75 59.71 Favored 'General case' 0 CA--C 1.538 0.483 0 N-CA-C 113.405 0.891 . . . . 0.0 113.405 179.573 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 55.2 t -70.74 -40.4 76.8 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.007 0 C-N-CA 123.695 0.798 . . . . 0.0 110.954 175.796 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 63.3 m -92.95 -23.81 18.6 Favored 'General case' 0 N--CA 1.471 0.604 0 N-CA-C 114.465 1.283 . . . . 0.0 114.465 -172.911 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 63.15 -142.26 47.25 Favored Glycine 0 CA--C 1.531 1.087 0 C-N-CA 124.118 0.866 . . . . 0.0 112.365 -175.829 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -63.52 -12.9 35.97 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 125.626 1.57 . . . . 0.0 114.46 -177.459 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 75.2 mtp180 -59.57 -38.81 82.13 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 124.28 1.032 . . . . 0.0 113.128 178.752 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 82.1 -179.62 53.19 Favored Glycine 0 CA--C 1.536 1.358 0 C-N-CA 124.484 1.04 . . . . 0.0 112.193 -161.994 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 34.9 p90 -157.74 157.92 34.33 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 124.339 1.056 . . . . 0.0 113.653 -169.945 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 81.5 t80 . . . . . 0 CA--C 1.537 0.47 0 C-N-CA 126.084 1.754 . . . . 0.0 110.84 166.187 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 60.0 t . . . . . 0 N--CA 1.475 0.823 0 CA-C-O 119.922 -0.085 . . . . 0.0 111.05 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 35.7 mm-40 -71.94 -44.75 63.09 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-O 118.684 -0.674 . . . . 0.0 111.041 173.281 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 5.5 tt0 -59.43 -53.6 56.33 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 119.253 0.933 . . . . 0.0 111.281 -178.914 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 57.2 m -60.17 -27.6 67.24 Favored 'General case' 0 CA--C 1.535 0.395 0 N-CA-C 113.793 1.035 . . . . 0.0 113.793 -177.571 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 24.9 t -102.37 -41.0 6.48 Favored 'General case' 0 CA--C 1.538 0.508 0 N-CA-C 113.622 0.971 . . . . 0.0 113.622 -170.772 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 59.4 p -84.62 -25.55 28.49 Favored 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 124.166 0.986 . . . . 0.0 112.683 176.989 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 79.8 p -126.06 -139.54 0.27 Allowed 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 125.669 1.588 . . . . 0.0 109.194 166.369 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 38.4 pt -123.46 161.4 25.56 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.524 0 C-N-CA 125.017 1.327 . . . . 0.0 110.844 177.184 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 29.0 p -141.54 156.04 45.74 Favored 'General case' 0 C--O 1.237 0.422 0 C-N-CA 123.354 0.662 . . . . 0.0 112.67 172.421 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 58.5 p -96.42 160.55 14.35 Favored 'General case' 0 N--CA 1.467 0.377 0 N-CA-C 113.343 0.868 . . . . 0.0 113.343 -176.314 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 65.7 mt -61.76 -33.38 73.96 Favored 'General case' 0 CA--C 1.539 0.522 0 O-C-N 121.366 -0.834 . . . . 0.0 111.843 173.066 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 89.5 t80 -66.68 -32.12 73.22 Favored 'General case' 0 CA--C 1.543 0.702 0 N-CA-C 113.066 0.765 . . . . 0.0 113.066 172.665 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 80.4 mt-30 -73.12 -37.76 66.55 Favored 'General case' 0 N--CA 1.466 0.352 0 O-C-N 121.442 -0.786 . . . . 0.0 111.186 171.671 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 46.5 mt -60.4 -40.01 89.4 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 119.413 1.006 . . . . 0.0 111.227 169.824 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -63.98 -40.12 95.68 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 124.285 1.034 . . . . 0.0 112.316 176.16 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 18.5 t30 -60.98 -28.57 69.1 Favored 'General case' 0 CA--C 1.548 0.873 0 O-C-N 121.226 -0.921 . . . . 0.0 112.797 174.538 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 22.4 m-85 -92.38 4.15 53.99 Favored 'General case' 0 CA--C 1.547 0.827 0 C-N-CA 125.063 1.345 . . . . 0.0 114.316 177.438 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 83.4 m . . . . . 0 N--CA 1.471 0.617 0 O-C-N 120.737 -1.227 . . . . 0.0 112.526 166.327 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 12.7 m-80 . . . . . 0 CA--C 1.536 0.431 0 CA-C-O 120.905 0.383 . . . . 0.0 111.638 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 41.0 mt-30 -147.15 160.35 42.54 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 124.834 1.254 . . . . 0.0 111.283 -178.528 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 92.8 m-70 -79.97 130.1 35.01 Favored 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 108.399 -0.963 . . . . 0.0 108.399 153.139 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 88.4 mt -143.36 126.21 16.17 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 125.213 1.405 . . . . 0.0 109.661 -176.892 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 66.4 m -135.41 144.15 46.36 Favored 'General case' 0 N--CA 1.468 0.428 0 C-N-CA 125.337 1.455 . . . . 0.0 110.35 -178.034 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 55.4 -124.55 33.59 Favored Glycine 0 N--CA 1.473 1.102 0 C-N-CA 124.495 1.045 . . . . 0.0 113.953 165.843 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 22.5 p -59.02 -37.12 76.19 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 124.765 1.226 . . . . 0.0 112.755 179.064 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 26.3 m80 -67.36 -38.77 85.31 Favored 'General case' 0 CA--C 1.54 0.576 0 O-C-N 121.171 -0.956 . . . . 0.0 111.577 177.219 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 51.5 tp -68.92 -43.24 75.54 Favored 'General case' 0 N--CA 1.465 0.325 0 O-C-N 121.667 -0.646 . . . . 0.0 111.388 173.387 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 6.4 t -56.88 -43.74 80.86 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.908 0 C-N-CA 124.463 1.105 . . . . 0.0 111.393 174.369 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 30.2 mm-40 -66.75 -44.56 81.15 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 124.1 0.96 . . . . 0.0 111.979 175.169 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -63.43 -45.1 92.49 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-N 118.969 0.804 . . . . 0.0 112.32 179.652 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 40.8 mt -57.44 -52.33 65.83 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 124.145 0.978 . . . . 0.0 110.408 172.058 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 87.9 t80 -55.8 -38.76 70.38 Favored 'General case' 0 CA--C 1.546 0.813 0 CA-C-N 119.321 0.964 . . . . 0.0 113.268 176.989 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 74.2 mt -72.2 -36.14 69.11 Favored 'General case' 0 N--CA 1.47 0.545 0 N-CA-C 113.224 0.824 . . . . 0.0 113.224 178.085 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 58.3 t -74.01 -38.73 49.93 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.133 0 C-N-CA 123.365 0.666 . . . . 0.0 111.53 175.307 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 60.8 m -90.34 -22.75 21.37 Favored 'General case' 0 N--CA 1.473 0.689 0 N-CA-C 114.666 1.358 . . . . 0.0 114.666 -172.906 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 65.99 -145.2 47.65 Favored Glycine 0 CA--C 1.532 1.129 0 C-N-CA 124.171 0.891 . . . . 0.0 112.202 -173.66 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -67.21 -12.37 59.88 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 124.602 1.161 . . . . 0.0 114.044 -178.642 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 76.2 mtp85 -63.85 -33.87 76.67 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 124.17 0.988 . . . . 0.0 113.235 178.832 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 77.01 -170.42 55.13 Favored Glycine 0 CA--C 1.531 1.033 0 C-N-CA 124.476 1.036 . . . . 0.0 113.096 -170.747 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 45.9 p90 -154.66 170.66 21.02 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 125.079 1.352 . . . . 0.0 112.729 -169.109 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 43.3 p90 . . . . . 0 CA--C 1.542 0.667 0 C-N-CA 125.263 1.425 . . . . 0.0 111.042 169.011 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 38.3 t . . . . . 0 N--CA 1.48 1.067 0 N-CA-C 111.793 0.294 . . . . 0.0 111.793 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -68.72 -8.65 44.71 Favored 'General case' 0 CA--C 1.545 0.764 0 N-CA-C 114.5 1.296 . . . . 0.0 114.5 178.379 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 71.5 tp60 -101.46 -55.74 2.46 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 124.191 0.996 . . . . 0.0 110.101 168.695 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 72.5 m -68.66 -28.69 67.1 Favored 'General case' 0 N--CA 1.468 0.436 0 N-CA-C 115.084 1.513 . . . . 0.0 115.084 -171.483 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 22.1 t -90.34 -45.2 9.18 Favored 'General case' 0 N--CA 1.476 0.839 0 N-CA-C 112.989 0.737 . . . . 0.0 112.989 -167.055 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 18.2 p -89.07 -53.97 4.33 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 126.001 1.721 . . . . 0.0 110.986 -177.785 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.9 t -87.69 -160.6 0.63 Allowed 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 124.65 1.18 . . . . 0.0 110.535 164.523 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 2.1 pp -105.03 167.81 2.79 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.535 0 C-N-CA 124.728 1.211 . . . . 0.0 111.98 175.494 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 20.5 p -147.99 160.09 43.2 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 123.71 0.804 . . . . 0.0 112.198 166.576 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 12.5 m -106.57 154.57 20.7 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 124.419 1.088 . . . . 0.0 111.988 -171.488 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 30.4 mt -61.32 -33.45 73.63 Favored 'General case' 0 N--CA 1.47 0.531 0 O-C-N 121.346 -0.846 . . . . 0.0 112.026 178.896 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 59.3 m-85 -60.73 -32.45 71.72 Favored 'General case' 0 CA--C 1.541 0.609 0 N-CA-C 113.565 0.95 . . . . 0.0 113.565 171.976 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 21.3 mm100 -81.6 -31.79 32.34 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 124.373 1.069 . . . . 0.0 110.992 176.707 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 64.1 mt -64.85 -37.73 88.62 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-N 119.23 0.923 . . . . 0.0 111.692 169.186 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 26.7 tt0 -63.07 -27.05 69.13 Favored 'General case' 0 CA--C 1.546 0.825 0 N-CA-C 113.194 0.813 . . . . 0.0 113.194 179.245 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 25.1 t30 -58.73 -24.88 62.32 Favored 'General case' 0 CA--C 1.547 0.841 0 O-C-N 121.103 -0.998 . . . . 0.0 112.91 172.963 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 85.7 m-85 -102.7 9.36 39.23 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 126.074 1.749 . . . . 0.0 113.464 -178.726 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 69.1 m . . . . . 0 CA--C 1.539 0.551 0 O-C-N 120.916 -1.115 . . . . 0.0 111.558 164.337 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 7.3 p30 . . . . . 0 CA--C 1.536 0.42 0 CA-C-O 120.768 0.318 . . . . 0.0 110.773 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 49.4 mm-40 -153.72 163.56 39.81 Favored 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 123.842 0.857 . . . . 0.0 111.882 -162.787 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 99.2 m-70 -78.86 129.28 34.39 Favored 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 109.088 -0.708 . . . . 0.0 109.088 161.823 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 79.6 mt -144.97 132.64 20.99 Favored 'General case' 0 N--CA 1.465 0.294 0 C-N-CA 125.743 1.617 . . . . 0.0 109.079 -174.674 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 2.7 t -153.16 152.96 31.84 Favored 'General case' 0 N--CA 1.467 0.382 0 O-C-N 121.488 -0.757 . . . . 0.0 111.893 -176.898 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 49.69 -126.05 19.89 Favored Glycine 0 N--CA 1.47 0.954 0 C-N-CA 124.794 1.188 . . . . 0.0 113.596 177.751 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 15.1 m -60.28 -31.53 70.32 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 124.765 1.226 . . . . 0.0 112.761 -179.637 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 98.2 m-70 -73.87 -35.53 64.74 Favored 'General case' 0 CA--C 1.539 0.537 0 O-C-N 120.994 -1.066 . . . . 0.0 111.667 178.18 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 33.9 tp -68.81 -43.26 75.96 Favored 'General case' 0 N--CA 1.467 0.405 0 O-C-N 121.485 -0.759 . . . . 0.0 110.753 171.844 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 50.6 t -58.54 -41.38 81.76 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.018 0 C-N-CA 123.81 0.844 . . . . 0.0 111.595 173.249 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -66.26 -44.4 83.73 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 123.885 0.874 . . . . 0.0 112.295 175.336 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.66 -44.72 96.42 Favored 'General case' 0 CA--C 1.54 0.578 0 O-C-N 121.614 -0.679 . . . . 0.0 112.088 177.171 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 30.3 mt -56.16 -50.89 69.88 Favored 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 124.204 1.002 . . . . 0.0 111.169 172.177 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 67.5 t80 -56.24 -40.53 74.28 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 113.081 0.771 . . . . 0.0 113.081 176.017 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 89.7 mt -76.99 -33.5 57.58 Favored 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 113.546 0.943 . . . . 0.0 113.546 -179.408 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 38.7 t -69.95 -44.74 78.34 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.879 0 C-N-CA 124.189 0.995 . . . . 0.0 110.828 173.033 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 76.2 m -85.25 -33.18 22.24 Favored 'General case' 0 N--CA 1.466 0.371 0 N-CA-C 113.4 0.889 . . . . 0.0 113.4 -172.76 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 64.44 -135.25 39.06 Favored Glycine 0 CA--C 1.531 1.071 0 C-N-CA 124.229 0.919 . . . . 0.0 111.659 -177.928 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 30.0 tt0 -64.5 -16.81 63.16 Favored 'General case' 0 CA--C 1.549 0.906 0 C-N-CA 124.9 1.28 . . . . 0.0 113.503 -179.511 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 82.6 mtm180 -61.06 -32.51 72.15 Favored 'General case' 0 N--CA 1.473 0.69 0 N-CA-C 113.642 0.979 . . . . 0.0 113.642 179.965 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 85.39 173.36 49.64 Favored Glycine 0 CA--C 1.533 1.175 0 C-N-CA 124.748 1.166 . . . . 0.0 112.21 -169.388 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 51.1 p90 -159.0 166.81 30.92 Favored 'General case' 0 N--CA 1.47 0.545 0 N-CA-C 113.886 1.069 . . . . 0.0 113.886 -170.432 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 31.3 m-85 . . . . . 0 CA--C 1.541 0.608 0 C-N-CA 127.078 2.151 . . . . 0.0 110.711 178.467 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 4.5 t . . . . . 0 N--CA 1.48 1.059 0 N-CA-C 112.252 0.464 . . . . 0.0 112.252 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -74.3 -11.05 60.16 Favored 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 113.856 1.058 . . . . 0.0 113.856 -179.69 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 60.5 tp60 -98.74 -53.61 3.25 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 123.811 0.844 . . . . 0.0 109.8 166.268 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 32.9 m -61.37 -33.54 73.82 Favored 'General case' 0 N--CA 1.466 0.333 0 N-CA-C 114.542 1.312 . . . . 0.0 114.542 -171.242 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 23.6 t -91.98 -41.92 10.29 Favored 'General case' 0 CA--C 1.537 0.448 0 O-C-N 121.955 -0.465 . . . . 0.0 111.681 -176.632 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 21.4 m -69.27 -34.77 75.26 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 126.409 1.884 . . . . 0.0 112.532 179.942 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 11.6 t -145.14 -162.56 1.53 Allowed 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 125.525 1.53 . . . . 0.0 110.593 -178.287 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 82.1 mt -80.76 135.93 24.24 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.614 0 O-C-N 120.691 -1.255 . . . . 0.0 109.958 172.38 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 21.0 p -119.13 157.2 28.37 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-O 121.718 0.77 . . . . 0.0 111.255 161.641 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 62.2 m -102.97 153.9 19.76 Favored 'General case' 0 N--CA 1.466 0.36 0 C-N-CA 123.659 0.784 . . . . 0.0 112.726 -173.86 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 57.1 mt -59.96 -32.73 71.08 Favored 'General case' 0 N--CA 1.467 0.416 0 O-C-N 121.388 -0.82 . . . . 0.0 112.034 178.995 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 84.6 m-85 -67.55 -29.08 68.37 Favored 'General case' 0 CA--C 1.54 0.594 0 N-CA-C 113.909 1.077 . . . . 0.0 113.909 172.962 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 92.6 mt-30 -75.87 -39.87 55.64 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 123.707 0.803 . . . . 0.0 110.292 172.829 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 94.2 mt -58.54 -41.31 85.24 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-N 118.454 0.57 . . . . 0.0 110.964 170.127 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -65.28 -40.48 93.91 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 124.575 1.15 . . . . 0.0 112.174 177.27 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 35.1 t30 -63.72 -23.88 67.55 Favored 'General case' 0 CA--C 1.548 0.903 0 O-C-N 121.246 -0.909 . . . . 0.0 112.69 172.949 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -90.05 3.95 51.74 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 125.587 1.555 . . . . 0.0 114.658 175.976 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 83.1 m . . . . . 0 CA--C 1.541 0.605 0 C-N-CA 123.533 0.733 . . . . 0.0 112.807 169.718 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 15.2 m-20 . . . . . 0 CA--C 1.544 0.727 0 CA-C-O 121.021 0.439 . . . . 0.0 111.983 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 68.4 mm-40 -152.19 166.87 30.38 Favored 'General case' 0 N--CA 1.471 0.604 0 O-C-N 121.232 -0.918 . . . . 0.0 113.068 -158.462 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 17.5 m-70 -78.6 133.46 37.29 Favored 'General case' 0 CA--C 1.544 0.741 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 154.915 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 77.7 mt -145.83 127.39 15.11 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 126.743 2.017 . . . . 0.0 109.137 -176.009 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 84.2 m -132.74 147.41 52.32 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 124.629 1.172 . . . . 0.0 110.696 -177.683 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 55.39 -128.26 43.93 Favored Glycine 0 N--CA 1.469 0.876 0 C-N-CA 124.832 1.206 . . . . 0.0 113.965 165.474 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 14.3 m -58.42 -34.22 70.54 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 124.395 1.078 . . . . 0.0 112.641 179.916 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 79.2 m-70 -77.44 -27.06 52.04 Favored 'General case' 0 CA--C 1.54 0.562 0 O-C-N 121.292 -0.88 . . . . 0.0 112.918 177.566 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 38.9 tp -71.85 -43.4 65.57 Favored 'General case' 0 N--CA 1.47 0.567 0 O-C-N 121.135 -0.978 . . . . 0.0 111.124 167.386 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 42.1 t -57.8 -41.64 80.19 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.992 0 C-N-CA 123.556 0.743 . . . . 0.0 111.603 172.971 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 44.2 tt0 -62.33 -49.32 76.07 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 125.395 1.478 . . . . 0.0 111.822 173.324 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -63.46 -45.19 91.96 Favored 'General case' 0 CA--C 1.541 0.606 0 O-C-N 121.681 -0.637 . . . . 0.0 112.391 -179.269 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 52.0 mt -54.45 -56.37 19.4 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 124.135 0.974 . . . . 0.0 110.392 171.95 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 74.0 t80 -52.9 -41.38 64.34 Favored 'General case' 0 CA--C 1.542 0.669 0 N-CA-C 113.371 0.878 . . . . 0.0 113.371 177.38 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 86.3 mt -73.46 -34.53 65.43 Favored 'General case' 0 CA--C 1.537 0.479 0 N-CA-C 113.884 1.068 . . . . 0.0 113.884 179.569 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 54.2 t -72.25 -39.97 64.94 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.049 0 CA-C-N 118.7 0.682 . . . . 0.0 110.834 173.417 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 73.4 m -79.85 -28.68 40.03 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 124.38 1.072 . . . . 0.0 113.72 -176.089 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 65.1 -111.43 4.18 Favored Glycine 0 CA--C 1.528 0.899 0 C-N-CA 124.472 1.035 . . . . 0.0 112.082 175.504 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -71.93 -21.0 61.67 Favored 'General case' 0 CA--C 1.544 0.73 0 N-CA-C 113.82 1.045 . . . . 0.0 113.82 175.101 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 84.6 mtp180 -78.63 157.79 28.59 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 124.752 1.221 . . . . 0.0 111.272 175.449 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . -81.83 -167.23 38.85 Favored Glycine 0 CA--C 1.529 0.921 0 C-N-CA 124.092 0.853 . . . . 0.0 111.778 170.676 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 43.7 p90 -156.64 152.17 26.82 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 125.384 1.474 . . . . 0.0 112.162 178.067 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 58.9 m-85 . . . . . 0 CA--C 1.543 0.698 0 N-CA-C 114.313 1.227 . . . . 0.0 114.313 -172.414 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 61.4 t . . . . . 0 N--CA 1.48 1.07 0 CA-C-O 119.614 -0.231 . . . . 0.0 111.562 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -72.49 -45.49 59.19 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 118.499 0.591 . . . . 0.0 110.311 173.404 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 70.6 tp60 -59.88 -47.76 84.43 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 123.127 0.571 . . . . 0.0 111.745 178.979 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 73.1 m -72.0 -30.86 65.67 Favored 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 114.794 1.405 . . . . 0.0 114.794 -177.778 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 22.3 t -103.46 -41.77 5.89 Favored 'General case' 0 N--CA 1.47 0.574 0 N-CA-C 113.711 1.004 . . . . 0.0 113.711 -169.638 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 33.8 m -81.93 -38.01 25.9 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 124.127 0.971 . . . . 0.0 110.911 177.591 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 11.0 t -111.35 -152.58 0.5 Allowed 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 125.055 1.342 . . . . 0.0 110.422 166.073 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 45.3 pt -108.81 158.43 8.64 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.543 0 C-N-CA 125.474 1.51 . . . . 0.0 111.104 170.388 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 21.1 p -137.86 156.09 48.28 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 123.791 0.836 . . . . 0.0 112.588 171.233 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 59.7 p -93.56 165.41 12.75 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 124.456 1.103 . . . . 0.0 112.979 173.942 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 72.7 mt -63.61 -34.05 76.96 Favored 'General case' 0 CA--C 1.537 0.454 0 O-C-N 121.369 -0.832 . . . . 0.0 111.798 171.976 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 91.4 t80 -64.07 -34.97 79.24 Favored 'General case' 0 CA--C 1.544 0.721 0 O-C-N 121.598 -0.689 . . . . 0.0 112.687 171.893 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 91.4 mt-30 -73.77 -32.91 64.04 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-O 118.537 -0.744 . . . . 0.0 112.218 174.022 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 92.4 mt -57.96 -48.84 78.75 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-N 119.612 1.096 . . . . 0.0 110.283 165.989 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 29.3 tt0 -63.75 -30.83 71.88 Favored 'General case' 0 CA--C 1.544 0.74 0 N-CA-C 113.338 0.866 . . . . 0.0 113.338 179.904 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 18.0 t30 -60.29 -27.76 67.55 Favored 'General case' 0 CA--C 1.544 0.74 0 O-C-N 121.131 -0.981 . . . . 0.0 113.231 178.346 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 40.8 m-85 -93.96 8.04 42.83 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 125.604 1.561 . . . . 0.0 113.223 176.071 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 56.2 m . . . . . 0 CA--C 1.541 0.628 0 C-N-CA 125.51 1.524 . . . . 0.0 112.619 174.713 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.537 0.471 0 CA-C-O 120.614 0.245 . . . . 0.0 111.394 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 21.5 mm100 -146.28 163.94 33.92 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 124.542 1.137 . . . . 0.0 111.244 -159.81 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 96.7 m-70 -80.79 131.75 35.44 Favored 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 108.885 -0.783 . . . . 0.0 108.885 157.743 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 77.0 mt -144.37 128.58 17.73 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 125.878 1.671 . . . . 0.0 108.895 -178.937 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 85.4 m -137.08 148.0 46.45 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 125.067 1.347 . . . . 0.0 110.569 -177.614 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 56.03 -128.54 45.78 Favored Glycine 0 CA--C 1.531 1.047 0 C-N-CA 124.762 1.172 . . . . 0.0 114.245 165.095 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 25.5 p -56.54 -42.78 79.08 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 124.524 1.129 . . . . 0.0 112.599 179.935 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 73.4 m-70 -70.57 -29.61 66.1 Favored 'General case' 0 CA--C 1.541 0.616 0 O-C-N 121.142 -0.974 . . . . 0.0 113.304 176.473 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 55.0 tp -67.7 -47.14 70.25 Favored 'General case' 0 N--CA 1.469 0.507 0 O-C-N 121.299 -0.876 . . . . 0.0 111.215 169.265 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 76.4 t -60.25 -39.62 81.26 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.016 0 C-N-CA 123.248 0.619 . . . . 0.0 111.211 175.931 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 44.3 tt0 -62.02 -50.06 73.57 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 125.464 1.506 . . . . 0.0 111.594 174.759 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -63.94 -45.36 89.53 Favored 'General case' 0 N--CA 1.469 0.501 0 O-C-N 121.628 -0.67 . . . . 0.0 112.066 178.985 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 33.5 tp -60.12 -44.56 94.78 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 124.722 1.209 . . . . 0.0 111.234 177.133 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 74.4 t80 -61.65 -37.36 83.72 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 124.126 0.97 . . . . 0.0 113.011 171.359 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 65.5 mt -71.11 -28.38 64.26 Favored 'General case' 0 N--CA 1.471 0.602 0 O-C-N 120.754 -1.216 . . . . 0.0 113.1 177.396 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 96.7 t -80.6 -39.74 18.7 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.152 0 C-N-CA 123.703 0.801 . . . . 0.0 111.478 173.283 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 72.6 m -124.06 -1.02 8.31 Favored 'General case' 0 N--CA 1.479 0.987 0 N-CA-C 116.281 1.956 . . . . 0.0 116.281 -162.216 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . -63.0 -22.15 64.45 Favored Glycine 0 N--CA 1.476 1.308 0 CA-C-N 119.707 1.14 . . . . 0.0 115.837 -165.167 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 35.2 mm-40 -74.47 -23.91 58.96 Favored 'General case' 0 CA--C 1.547 0.837 0 CA-C-N 118.416 1.108 . . . . 0.0 112.897 172.574 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 74.3 mtt180 -102.48 -39.36 7.16 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 125.857 1.663 . . . . 0.0 113.132 -177.503 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 99.97 148.49 22.72 Favored Glycine 0 CA--C 1.534 1.278 0 C-N-CA 125.775 1.655 . . . . 0.0 112.159 -166.694 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 39.8 p90 -133.49 167.88 19.64 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 125.288 1.435 . . . . 0.0 113.238 -175.053 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 98.1 m-85 . . . . . 0 CA--C 1.538 0.515 0 C-N-CA 125.89 1.676 . . . . 0.0 110.713 173.734 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 27.2 t . . . . . 0 N--CA 1.482 1.166 0 N-CA-C 112.449 0.537 . . . . 0.0 112.449 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 3.5 pm0 -72.15 -5.17 33.65 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 125.37 1.468 . . . . 0.0 113.957 -177.789 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 57.1 tp60 -104.18 -53.93 2.64 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 124.508 1.123 . . . . 0.0 110.076 165.849 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 1.8 t -81.12 -17.73 48.9 Favored 'General case' 0 N--CA 1.469 0.477 0 N-CA-C 114.67 1.359 . . . . 0.0 114.67 -165.457 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 27.4 t -87.93 -37.48 16.39 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 123.231 0.612 . . . . 0.0 112.139 -179.947 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 16.7 p -88.94 -52.65 4.98 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 126.71 2.004 . . . . 0.0 111.363 -178.916 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 14.2 t -102.37 -149.91 0.4 Allowed 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 125.778 1.631 . . . . 0.0 109.889 168.044 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 48.0 pt -113.12 160.89 12.44 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.659 0 C-N-CA 125.165 1.386 . . . . 0.0 111.882 178.995 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 15.5 p -139.48 163.2 33.15 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 123.99 0.916 . . . . 0.0 112.108 164.358 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 6.9 t -108.25 162.02 14.47 Favored 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 124.214 1.006 . . . . 0.0 112.925 179.852 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 6.7 mp -61.69 -32.3 72.49 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 124.412 1.085 . . . . 0.0 110.783 176.542 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 86.1 m-85 -65.3 -25.85 67.81 Favored 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 113.45 0.907 . . . . 0.0 113.45 173.932 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 75.2 mt-30 -82.32 -38.79 23.77 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 124.408 1.083 . . . . 0.0 110.921 172.887 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 85.3 mt -59.75 -38.07 80.72 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 119.257 0.935 . . . . 0.0 111.364 170.349 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 -64.95 -21.47 66.84 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 124.778 1.231 . . . . 0.0 113.022 173.184 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 21.9 t30 -82.91 -28.47 29.93 Favored 'General case' 0 CA--C 1.547 0.843 0 O-C-N 121.06 -1.025 . . . . 0.0 112.995 172.419 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 23.5 m-85 -78.36 -23.31 46.98 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 124.133 0.973 . . . . 0.0 113.198 171.234 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 14.0 t . . . . . 0 N--CA 1.47 0.527 0 C-N-CA 124.537 1.135 . . . . 0.0 111.434 160.529 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.542 0.654 0 N-CA-C 112.228 0.455 . . . . 0.0 112.228 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 39.9 mt-30 -145.42 161.52 39.48 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 123.747 0.819 . . . . 0.0 111.769 -163.43 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 97.8 m-70 -81.29 130.57 35.09 Favored 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 108.45 -0.944 . . . . 0.0 108.45 157.235 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 89.8 mt -147.37 138.42 23.69 Favored 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 125.133 1.373 . . . . 0.0 108.501 -177.604 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 3.6 t -149.64 154.85 39.27 Favored 'General case' 0 C--O 1.236 0.351 0 O-C-N 121.575 -0.703 . . . . 0.0 112.25 -178.462 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 54.11 -129.81 43.23 Favored Glycine 0 CA--C 1.53 0.986 0 C-N-CA 125.711 1.624 . . . . 0.0 113.668 174.334 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 33.4 p -57.75 -40.19 79.13 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 124.41 1.084 . . . . 0.0 112.821 -179.621 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 73.7 m-70 -71.57 -28.99 64.22 Favored 'General case' 0 CA--C 1.54 0.585 0 O-C-N 120.951 -1.093 . . . . 0.0 113.108 178.308 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 45.7 tp -70.22 -44.73 67.98 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 119.037 0.835 . . . . 0.0 111.449 169.9 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 76.3 t -62.55 -37.99 80.29 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.056 0 C-N-CA 122.961 0.504 . . . . 0.0 111.558 174.932 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -62.37 -51.0 69.33 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 125.593 1.557 . . . . 0.0 111.149 173.95 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.88 -45.44 93.76 Favored 'General case' 0 CA--C 1.542 0.635 0 O-C-N 121.809 -0.557 . . . . 0.0 111.74 179.264 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 31.0 tp -59.44 -47.48 85.31 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 124.835 1.254 . . . . 0.0 111.228 176.762 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 56.2 t80 -58.24 -43.04 87.62 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 123.978 0.911 . . . . 0.0 113.109 172.304 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 77.1 mt -70.65 -34.45 72.05 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 113.154 0.798 . . . . 0.0 113.154 -179.502 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 41.2 t -70.27 -43.27 78.69 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.011 0 C-N-CA 123.787 0.835 . . . . 0.0 111.146 172.099 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 44.6 t -81.0 -30.23 35.01 Favored 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 114.394 1.257 . . . . 0.0 114.394 -173.157 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 67.93 -147.1 47.52 Favored Glycine 0 CA--C 1.533 1.173 0 C-N-CA 124.604 1.097 . . . . 0.0 112.348 -172.992 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -69.7 -13.57 62.36 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 124.879 1.271 . . . . 0.0 113.616 -177.744 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 40.6 mtp85 -59.05 -37.24 76.54 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 124.773 1.229 . . . . 0.0 113.948 -173.67 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 90.98 150.4 24.87 Favored Glycine 0 CA--C 1.536 1.365 0 C-N-CA 124.94 1.257 . . . . 0.0 113.515 -176.141 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 35.2 p90 -137.46 159.94 40.53 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 125.086 1.354 . . . . 0.0 112.605 -171.448 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 69.5 t80 . . . . . 0 CA--C 1.539 0.555 0 C-N-CA 124.811 1.245 . . . . 0.0 110.125 165.791 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 98.5 t . . . . . 0 N--CA 1.477 0.905 0 CA-C-O 118.411 -0.804 . . . . 0.0 111.425 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -57.86 -46.54 84.67 Favored 'General case' 0 N--CA 1.472 0.674 0 CA-C-N 119.894 1.225 . . . . 0.0 110.398 174.546 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 8.3 tp-100 -64.2 -56.31 15.6 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 124.051 0.94 . . . . 0.0 111.04 178.96 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 4.2 t -79.62 -15.12 58.19 Favored 'General case' 0 N--CA 1.469 0.518 0 N-CA-C 114.777 1.399 . . . . 0.0 114.777 -169.027 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 14.0 t -92.99 -31.09 15.01 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 123.602 0.761 . . . . 0.0 112.606 178.347 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 56.4 p -94.44 -43.2 8.48 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 124.076 0.95 . . . . 0.0 112.144 175.856 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 60.4 m -108.64 -140.69 0.38 Allowed 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 126.203 1.801 . . . . 0.0 109.162 167.486 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 30.2 pt -127.81 163.04 32.38 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.974 0 C-N-CA 124.945 1.298 . . . . 0.0 112.508 -174.96 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 18.7 p -145.76 165.71 28.02 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 125.399 1.479 . . . . 0.0 110.88 167.297 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 95.3 p -111.56 164.1 13.35 Favored 'General case' 0 N--CA 1.467 0.416 0 C-N-CA 124.474 1.11 . . . . 0.0 112.093 177.461 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 70.7 mt -59.64 -32.49 70.49 Favored 'General case' 0 CA--C 1.537 0.447 0 O-C-N 121.576 -0.703 . . . . 0.0 111.489 170.56 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 62.2 m-85 -69.69 -29.09 66.43 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 125.21 1.404 . . . . 0.0 113.047 175.541 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 16.8 mm100 -75.6 -39.65 57.64 Favored 'General case' 0 N--CA 1.467 0.419 0 O-C-N 121.703 -0.623 . . . . 0.0 111.339 168.873 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 87.5 mt -62.15 -34.63 76.75 Favored 'General case' 0 N--CA 1.473 0.702 0 CA-C-N 119.492 1.042 . . . . 0.0 111.693 172.558 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -61.19 -30.11 70.21 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 124.199 0.999 . . . . 0.0 112.335 174.6 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 13.8 t-20 -72.7 -22.56 60.88 Favored 'General case' 0 CA--C 1.548 0.892 0 O-C-N 121.401 -0.812 . . . . 0.0 112.857 175.394 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 27.8 m-85 -85.25 -9.56 57.58 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 124.833 1.253 . . . . 0.0 113.736 173.188 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 61.3 m . . . . . 0 CA--C 1.543 0.699 0 CA-C-N 119.543 1.065 . . . . 0.0 112.409 172.186 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 11.4 p30 . . . . . 0 CA--C 1.539 0.53 0 CA-C-O 121.304 0.573 . . . . 0.0 111.709 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 40.4 mt-30 -150.25 164.58 35.37 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.615 1.166 . . . . 0.0 111.09 -165.712 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 98.7 m-70 -86.78 132.54 33.82 Favored 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 108.462 -0.94 . . . . 0.0 108.462 153.527 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 89.2 mt -145.82 143.16 29.47 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 125.566 1.546 . . . . 0.0 108.767 -179.211 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 2.0 t -148.3 149.51 31.97 Favored 'General case' 0 N--CA 1.466 0.344 0 N-CA-C 112.608 0.595 . . . . 0.0 112.608 -173.185 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 44.2 -125.9 5.99 Favored Glycine 0 N--CA 1.471 1.006 0 C-N-CA 126.271 1.891 . . . . 0.0 114.349 173.641 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 19.8 m -60.13 -30.75 69.49 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 124.549 1.139 . . . . 0.0 113.021 -178.249 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 78.7 m-70 -78.63 -28.11 45.53 Favored 'General case' 0 CA--C 1.538 0.516 0 O-C-N 120.891 -1.131 . . . . 0.0 112.661 176.631 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 6.8 tt -68.21 -45.24 73.88 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 119.445 1.02 . . . . 0.0 110.644 165.884 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 73.3 t -57.56 -41.31 78.76 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.007 0 C-N-CA 123.631 0.772 . . . . 0.0 111.749 174.985 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 45.4 tt0 -61.56 -51.08 70.05 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 125.236 1.414 . . . . 0.0 111.279 174.293 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.43 -46.44 90.08 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 123.275 0.63 . . . . 0.0 111.547 179.09 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 51.5 tp -57.48 -53.52 57.19 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 126.185 1.794 . . . . 0.0 111.118 177.246 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 52.4 t80 -53.91 -43.56 69.81 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 123.656 0.783 . . . . 0.0 112.531 174.166 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 81.7 mt -70.24 -35.03 73.55 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 124.002 0.921 . . . . 0.0 113.065 179.726 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 37.1 t -65.09 -44.64 95.65 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.908 0 C-N-CA 124.369 1.068 . . . . 0.0 110.669 170.987 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 64.3 m -75.52 -28.61 59.18 Favored 'General case' 0 CA--C 1.541 0.607 0 N-CA-C 113.539 0.94 . . . . 0.0 113.539 -177.226 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 68.69 -116.5 7.43 Favored Glycine 0 CA--C 1.528 0.888 0 C-N-CA 124.646 1.117 . . . . 0.0 111.792 175.793 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 1.7 pm0 -73.21 -20.28 60.91 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 124.2 1.0 . . . . 0.0 113.474 174.196 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 76.9 mtp180 -74.32 147.27 42.42 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 124.227 1.011 . . . . 0.0 110.346 173.974 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . -76.78 -173.81 38.46 Favored Glycine 0 CA--C 1.53 1.013 0 C-N-CA 123.496 0.57 . . . . 0.0 111.937 167.607 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 42.8 p90 -149.01 153.74 38.32 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.192 0.997 . . . . 0.0 113.651 178.752 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 61.3 t80 . . . . . 0 CA--C 1.54 0.575 0 C-N-CA 125.394 1.478 . . . . 0.0 109.645 159.699 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 53.1 t . . . . . 0 N--CA 1.48 1.036 0 N-CA-C 112.608 0.596 . . . . 0.0 112.608 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -88.47 -43.45 11.44 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 118.568 0.622 . . . . 0.0 111.3 169.419 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 43.3 tp60 -63.91 -40.72 97.14 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 123.354 0.662 . . . . 0.0 112.725 -171.022 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 11.9 t -77.87 -13.39 59.9 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 118.953 0.797 . . . . 0.0 112.982 175.527 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 17.1 t -84.77 -40.08 17.67 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.05 0.94 . . . . 0.0 112.25 175.059 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 47.1 p -87.25 -48.41 8.04 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 124.937 1.295 . . . . 0.0 111.928 178.194 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 10.3 t -97.92 -146.89 0.31 Allowed 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 125.55 1.54 . . . . 0.0 109.996 166.753 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 31.0 pt -124.31 164.27 22.92 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.865 0 C-N-CA 125.915 1.686 . . . . 0.0 112.488 -177.522 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 19.7 p -149.26 173.33 13.6 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 125.264 1.425 . . . . 0.0 110.993 166.05 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 2.8 m -131.14 164.11 26.2 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 124.225 1.01 . . . . 0.0 111.473 -170.929 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 30.4 mt -62.33 -39.44 93.08 Favored 'General case' 0 N--CA 1.468 0.458 0 O-C-N 121.292 -0.88 . . . . 0.0 111.755 -175.521 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 20.2 p90 -65.68 -31.26 72.17 Favored 'General case' 0 N--CA 1.471 0.581 0 O-C-N 121.277 -0.889 . . . . 0.0 113.27 173.685 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 49.4 mt-30 -76.48 -31.16 57.6 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 123.475 0.71 . . . . 0.0 111.516 176.617 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 80.5 mt -66.52 -43.7 84.52 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 123.996 0.918 . . . . 0.0 111.062 168.459 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 31.8 tt0 -61.3 -23.64 65.84 Favored 'General case' 0 CA--C 1.547 0.83 0 N-CA-C 113.536 0.939 . . . . 0.0 113.536 -178.22 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 22.1 t30 -55.14 -28.43 52.68 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 124.404 1.082 . . . . 0.0 113.539 171.867 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 97.8 m-85 -93.35 5.71 50.63 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.819 1.648 . . . . 0.0 113.646 -178.404 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 68.7 m . . . . . 0 N--CA 1.469 0.512 0 C-N-CA 125.862 1.665 . . . . 0.0 113.886 178.724 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 5.9 p-10 . . . . . 0 N--CA 1.469 0.522 0 N-CA-C 112.611 0.597 . . . . 0.0 112.611 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 43.2 mt-30 -148.2 165.26 31.45 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 125.45 1.5 . . . . 0.0 110.77 -177.578 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 96.1 m-70 -89.02 128.31 35.71 Favored 'General case' 0 CA--C 1.542 0.655 0 N-CA-C 108.178 -1.045 . . . . 0.0 108.178 156.236 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 74.5 mt -140.53 131.49 26.11 Favored 'General case' 0 N--CA 1.466 0.356 0 C-N-CA 124.738 1.215 . . . . 0.0 109.414 -176.884 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 57.0 m -125.94 136.82 53.46 Favored 'General case' 0 N--CA 1.467 0.4 0 C-N-CA 124.72 1.208 . . . . 0.0 110.726 -175.667 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 47.3 -118.02 3.67 Favored Glycine 0 N--CA 1.473 1.145 0 C-N-CA 125.404 1.478 . . . . 0.0 114.564 164.976 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 21.0 p -57.95 -35.9 71.78 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 124.563 1.145 . . . . 0.0 113.254 178.932 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 86.6 m-70 -76.33 -27.93 56.71 Favored 'General case' 0 CA--C 1.542 0.645 0 O-C-N 120.756 -1.215 . . . . 0.0 112.775 176.353 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 8.2 tt -67.03 -46.1 75.47 Favored 'General case' 0 N--CA 1.468 0.434 0 O-C-N 121.24 -0.912 . . . . 0.0 110.78 166.385 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 55.0 t -62.95 -36.39 75.5 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.142 0 C-N-CA 123.622 0.769 . . . . 0.0 111.638 177.543 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 44.2 tt0 -62.48 -51.03 69.07 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 125.503 1.521 . . . . 0.0 111.217 172.548 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.94 -46.42 90.77 Favored 'General case' 0 CA--C 1.539 0.542 0 O-C-N 121.777 -0.577 . . . . 0.0 111.797 177.543 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 53.8 tp -56.29 -49.25 74.78 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 125.688 1.595 . . . . 0.0 111.432 177.069 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 44.6 t80 -58.61 -42.55 88.41 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 123.628 0.771 . . . . 0.0 113.003 173.436 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 83.1 mt -74.6 -31.4 62.02 Favored 'General case' 0 N--CA 1.473 0.682 0 N-CA-C 113.208 0.818 . . . . 0.0 113.208 -177.845 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 41.4 t -67.27 -46.85 83.06 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.877 0 C-N-CA 124.333 1.053 . . . . 0.0 110.474 171.913 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 72.1 m -93.31 -24.96 17.95 Favored 'General case' 0 N--CA 1.469 0.497 0 N-CA-C 114.587 1.329 . . . . 0.0 114.587 -168.147 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 64.65 -136.46 38.87 Favored Glycine 0 CA--C 1.532 1.147 0 C-N-CA 124.478 1.037 . . . . 0.0 112.696 177.444 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -63.3 -17.47 62.56 Favored 'General case' 0 CA--C 1.544 0.728 0 N-CA-C 114.659 1.355 . . . . 0.0 114.659 -177.727 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 83.3 mtm180 -61.71 -31.52 71.68 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 124.506 1.122 . . . . 0.0 113.301 -177.952 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 79.41 166.87 33.01 Favored Glycine 0 CA--C 1.533 1.205 0 C-N-CA 124.403 1.002 . . . . 0.0 113.515 -177.03 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 47.7 p90 -152.7 165.47 35.18 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 124.584 1.154 . . . . 0.0 113.694 -168.15 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 87.4 t80 . . . . . 0 CA--C 1.542 0.638 0 C-N-CA 125.15 1.38 . . . . 0.0 110.287 166.543 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 84.5 t . . . . . 0 N--CA 1.481 1.114 0 CA-C-O 119.347 -0.359 . . . . 0.0 111.539 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 44.1 tt0 -83.99 -53.7 5.38 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 118.431 0.559 . . . . 0.0 110.262 168.429 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 31.7 tt0 -64.81 -41.38 95.83 Favored 'General case' 0 CA--C 1.535 0.367 0 N-CA-C 113.275 0.842 . . . . 0.0 113.275 -165.448 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 4.5 t -85.24 -10.37 56.62 Favored 'General case' 0 N--CA 1.476 0.851 0 CA-C-N 119.907 1.231 . . . . 0.0 113.298 179.768 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 21.7 t -89.98 -34.55 15.95 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 124.863 1.265 . . . . 0.0 111.907 176.243 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 46.2 p -95.94 -45.33 6.98 Favored 'General case' 0 N--CA 1.478 0.925 0 C-N-CA 126.106 1.762 . . . . 0.0 112.518 179.151 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.6 t -104.42 -161.11 0.8 Allowed 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 125.177 1.391 . . . . 0.0 110.029 166.394 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 7.8 tt -113.45 154.06 14.9 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.903 0 C-N-CA 125.685 1.594 . . . . 0.0 111.289 -177.63 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 14.8 p -141.6 162.33 35.75 Favored 'General case' 0 N--CA 1.475 0.779 0 O-C-N 121.259 -0.9 . . . . 0.0 113.154 173.436 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 83.3 p -104.87 166.91 10.06 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 125.429 1.492 . . . . 0.0 113.1 -177.846 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 62.2 mt -63.83 -37.99 89.45 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 123.72 0.808 . . . . 0.0 111.87 174.419 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 20.8 p90 -68.4 -32.56 72.71 Favored 'General case' 0 N--CA 1.469 0.499 0 N-CA-C 113.296 0.85 . . . . 0.0 113.296 175.048 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 16.7 mm100 -70.57 -35.06 72.85 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-O 119.069 -0.491 . . . . 0.0 111.885 172.314 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 88.9 mt -66.94 -37.07 83.63 Favored 'General case' 0 N--CA 1.472 0.674 0 CA-C-N 119.15 0.886 . . . . 0.0 112.226 170.926 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -62.69 -25.6 68.24 Favored 'General case' 0 CA--C 1.543 0.694 0 N-CA-C 113.335 0.865 . . . . 0.0 113.335 -178.73 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 25.9 t30 -53.93 -28.5 37.38 Favored 'General case' 0 CA--C 1.548 0.877 0 C-N-CA 124.287 1.035 . . . . 0.0 113.347 171.74 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 98.7 m-85 -96.77 2.89 52.44 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 125.8 1.64 . . . . 0.0 114.19 -175.43 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 70.0 m . . . . . 0 CA--C 1.544 0.748 0 N-CA-C 113.418 0.895 . . . . 0.0 113.418 174.194 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 3.3 m120 . . . . . 0 N--CA 1.469 0.5 0 CA-C-O 120.797 0.332 . . . . 0.0 111.654 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 90.4 mt-30 -146.15 157.92 43.85 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 124.921 1.288 . . . . 0.0 110.569 -177.767 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 96.8 m-70 -86.26 131.08 34.31 Favored 'General case' 0 CA--C 1.541 0.615 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 162.67 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 83.5 mt -145.53 134.2 22.21 Favored 'General case' 0 N--CA 1.464 0.244 0 C-N-CA 124.899 1.28 . . . . 0.0 109.493 -168.652 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 2.0 t -151.12 153.31 34.77 Favored 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 123.857 0.863 . . . . 0.0 111.517 -176.601 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 48.14 -126.11 14.02 Favored Glycine 0 CA--C 1.532 1.116 0 C-N-CA 125.115 1.341 . . . . 0.0 113.707 176.137 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 19.4 m -60.19 -31.49 70.18 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 124.359 1.064 . . . . 0.0 112.938 -179.001 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 99.2 m-70 -74.41 -35.46 63.42 Favored 'General case' 0 CA--C 1.54 0.589 0 O-C-N 121.157 -0.964 . . . . 0.0 111.918 178.021 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 60.0 tp -67.32 -43.03 82.62 Favored 'General case' 0 N--CA 1.47 0.551 0 O-C-N 121.749 -0.594 . . . . 0.0 111.23 170.43 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 42.7 t -59.91 -42.16 88.38 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.951 0 C-N-CA 124.151 0.98 . . . . 0.0 111.583 174.448 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -64.66 -46.1 83.9 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 124.215 1.006 . . . . 0.0 111.828 174.596 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.3 -46.27 90.45 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 123.27 0.628 . . . . 0.0 112.319 177.641 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 42.3 mt -56.55 -51.95 66.63 Favored 'General case' 0 N--CA 1.466 0.34 0 C-N-CA 124.003 0.921 . . . . 0.0 111.191 173.584 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 59.1 t80 -54.25 -43.18 70.69 Favored 'General case' 0 CA--C 1.542 0.658 0 N-CA-C 112.767 0.655 . . . . 0.0 112.767 176.298 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 91.2 mt -74.05 -36.66 64.39 Favored 'General case' 0 N--CA 1.469 0.494 0 N-CA-C 113.516 0.932 . . . . 0.0 113.516 -179.664 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 33.4 t -66.65 -43.96 90.02 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.958 0 C-N-CA 124.358 1.063 . . . . 0.0 110.637 174.206 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 79.1 m -79.78 -30.61 40.71 Favored 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 113.262 0.838 . . . . 0.0 113.262 -175.291 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 69.21 -113.32 5.08 Favored Glycine 0 CA--C 1.53 0.989 0 C-N-CA 124.489 1.042 . . . . 0.0 111.836 173.041 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 39.7 mm-40 -71.54 -22.38 61.77 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 123.884 0.874 . . . . 0.0 112.819 174.882 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 84.0 mtm180 -75.27 154.25 37.54 Favored 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 124.749 1.22 . . . . 0.0 110.954 175.137 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . -77.72 -174.21 41.71 Favored Glycine 0 N--CA 1.472 1.047 0 C-N-CA 123.814 0.721 . . . . 0.0 111.692 169.321 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 55.1 p90 -157.73 165.5 35.23 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 124.835 1.254 . . . . 0.0 112.7 178.912 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 88.6 t80 . . . . . 0 N--CA 1.466 0.333 0 C-N-CA 124.867 1.267 . . . . 0.0 111.504 170.25 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 91.0 t . . . . . 0 N--CA 1.479 0.986 0 N-CA-C 109.73 -0.47 . . . . 0.0 109.73 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 59.8 tt0 -55.8 -47.9 76.33 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 123.976 0.91 . . . . 0.0 111.355 174.831 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 20.6 tt0 -62.75 -48.33 79.63 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 123.01 0.524 . . . . 0.0 111.492 -179.238 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 65.9 m -63.63 -34.37 77.68 Favored 'General case' 0 N--CA 1.466 0.373 0 N-CA-C 113.766 1.024 . . . . 0.0 113.766 178.643 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 74.7 m -77.25 -38.61 50.7 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.753 0.821 . . . . 0.0 112.277 -179.013 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 78.9 p -95.97 -23.08 17.01 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 124.87 1.268 . . . . 0.0 113.74 -174.186 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.2 t -141.95 -169.3 2.89 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 125.599 1.56 . . . . 0.0 111.154 -177.844 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 38.0 mm -86.24 133.93 28.57 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.704 0 O-C-N 120.696 -1.253 . . . . 0.0 109.793 175.87 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 16.1 p -127.11 163.53 23.6 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 124.193 0.997 . . . . 0.0 112.163 170.908 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 96.5 p -108.28 158.64 17.3 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 124.259 1.024 . . . . 0.0 112.959 -177.581 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 55.6 mt -64.22 -34.18 77.51 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 123.738 0.815 . . . . 0.0 111.391 173.402 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 82.5 t80 -62.66 -35.83 80.89 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 123.756 0.823 . . . . 0.0 113.149 172.474 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 37.1 mt-30 -73.72 -32.76 64.04 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-O 118.502 -0.761 . . . . 0.0 112.121 173.775 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 81.7 mt -65.16 -40.4 94.27 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 119.594 1.088 . . . . 0.0 111.707 168.526 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -60.81 -26.93 67.66 Favored 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 113.478 0.918 . . . . 0.0 113.478 -177.1 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 18.9 t30 -55.34 -27.76 49.33 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 123.921 0.888 . . . . 0.0 113.323 172.522 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 97.0 m-85 -98.79 5.48 47.47 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 125.838 1.655 . . . . 0.0 114.251 -175.451 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 73.5 m . . . . . 0 CA--C 1.543 0.68 0 C-N-CA 123.719 0.808 . . . . 0.0 113.09 169.936 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 55.3 m-20 . . . . . 0 CA--C 1.538 0.514 0 CA-C-O 120.176 0.036 . . . . 0.0 110.935 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 28.9 mm-40 -149.69 167.92 25.08 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 124.1 0.96 . . . . 0.0 112.48 -165.359 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 88.1 m-70 -79.16 138.88 38.06 Favored 'General case' 0 CA--C 1.542 0.646 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 155.092 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 43.1 mt -151.17 136.17 17.42 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 124.78 1.232 . . . . 0.0 108.61 -175.617 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 2.3 t -155.41 153.97 31.21 Favored 'General case' 0 CA--C 1.534 0.328 0 O-C-N 121.549 -0.719 . . . . 0.0 112.343 -176.357 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 54.32 -130.97 45.5 Favored Glycine 0 CA--C 1.532 1.149 0 C-N-CA 125.195 1.379 . . . . 0.0 113.617 175.034 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 25.4 p -57.59 -38.0 74.15 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 124.353 1.061 . . . . 0.0 112.803 178.323 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 73.4 m-70 -71.95 -29.51 64.34 Favored 'General case' 0 CA--C 1.544 0.735 0 O-C-N 121.107 -0.995 . . . . 0.0 112.801 177.533 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 9.7 tt -66.74 -47.19 73.06 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 119.527 1.058 . . . . 0.0 110.877 168.123 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 58.3 t -61.87 -38.78 81.42 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.897 0 C-N-CA 123.239 0.616 . . . . 0.0 111.403 178.971 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -61.73 -51.86 66.62 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 125.709 1.604 . . . . 0.0 111.509 172.425 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.58 -46.16 91.07 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 123.231 0.612 . . . . 0.0 112.01 179.608 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 46.7 tp -58.19 -51.67 68.79 Favored 'General case' 0 CA--C 1.53 0.182 0 C-N-CA 124.807 1.243 . . . . 0.0 111.014 176.699 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 56.8 t80 -54.37 -42.59 70.5 Favored 'General case' 0 CA--C 1.543 0.678 0 N-CA-C 112.868 0.692 . . . . 0.0 112.868 174.262 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 83.0 mt -71.53 -34.68 70.26 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 124.093 0.957 . . . . 0.0 113.163 178.911 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 25.2 t -64.47 -44.42 96.99 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.844 0 C-N-CA 124.534 1.133 . . . . 0.0 110.419 171.277 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 79.4 m -72.61 -34.08 67.13 Favored 'General case' 0 CA--C 1.538 0.513 0 N-CA-C 113.129 0.789 . . . . 0.0 113.129 -178.651 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 69.78 -111.63 3.96 Favored Glycine 0 CA--C 1.529 0.927 0 C-N-CA 124.743 1.163 . . . . 0.0 111.797 173.619 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -70.16 -26.65 64.02 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 124.33 1.052 . . . . 0.0 112.061 174.955 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 83.6 mtm180 -72.44 154.37 40.91 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 124.886 1.274 . . . . 0.0 111.137 176.211 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . -79.86 -167.61 35.47 Favored Glycine 0 N--CA 1.471 0.977 0 C-N-CA 124.255 0.931 . . . . 0.0 111.353 167.817 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 52.9 p90 -159.53 162.85 35.53 Favored 'General case' 0 CA--C 1.538 0.506 0 N-CA-C 113.789 1.033 . . . . 0.0 113.789 179.248 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 83.1 t80 . . . . . 0 CA--C 1.541 0.612 0 C-N-CA 125.733 1.613 . . . . 0.0 110.025 168.908 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 29.5 t . . . . . 0 N--CA 1.48 1.043 0 CA-C-O 119.321 -0.371 . . . . 0.0 110.723 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 46.6 tt0 -62.65 -47.62 82.89 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 118.623 0.647 . . . . 0.0 111.078 174.085 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 63.1 tp60 -63.26 -37.11 85.97 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 123.005 0.522 . . . . 0.0 112.095 -177.426 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 78.2 m -85.64 -29.3 24.15 Favored 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 114.607 1.336 . . . . 0.0 114.607 -179.828 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 41.7 t -98.48 -57.16 2.26 Favored 'General case' 0 N--CA 1.473 0.724 0 N-CA-C 113.272 0.841 . . . . 0.0 113.272 -166.301 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 36.5 p -88.7 -33.02 17.69 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 124.178 0.991 . . . . 0.0 111.914 179.228 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.0 t -94.13 -162.61 0.96 Allowed 'General case' 0 CA--C 1.551 0.982 0 C-N-CA 123.531 0.733 . . . . 0.0 110.935 158.396 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 12.0 tt -118.22 146.55 22.6 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.907 0 C-N-CA 125.926 1.69 . . . . 0.0 111.048 174.95 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 14.9 p -132.45 159.23 39.95 Favored 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 113.122 0.786 . . . . 0.0 113.122 177.675 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 52.6 m -99.72 154.03 18.63 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 125.315 1.446 . . . . 0.0 112.186 -179.612 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 43.9 mt -59.37 -33.13 70.81 Favored 'General case' 0 N--CA 1.472 0.653 0 O-C-N 120.86 -1.15 . . . . 0.0 112.042 173.487 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 83.2 t80 -62.41 -30.69 71.4 Favored 'General case' 0 CA--C 1.546 0.804 0 N-CA-C 113.368 0.877 . . . . 0.0 113.368 171.673 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 94.0 mt-30 -80.15 -33.95 38.08 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 123.83 0.852 . . . . 0.0 111.365 174.895 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 56.3 mt -56.93 -48.49 78.15 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 118.841 0.746 . . . . 0.0 110.397 166.444 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -66.19 -31.7 72.69 Favored 'General case' 0 CA--C 1.544 0.712 0 N-CA-C 112.853 0.686 . . . . 0.0 112.853 179.279 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 32.8 t30 -62.9 -27.25 69.24 Favored 'General case' 0 CA--C 1.55 0.973 0 O-C-N 120.965 -1.084 . . . . 0.0 113.24 176.035 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 10.9 m-85 -80.6 -4.19 53.19 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 124.697 1.199 . . . . 0.0 113.894 172.324 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 72.1 m . . . . . 0 N--CA 1.472 0.627 0 C-N-CA 124.905 1.282 . . . . 0.0 113.738 178.286 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.466 0.351 0 CA-C-O 120.977 0.418 . . . . 0.0 111.201 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 47.9 mm-40 -149.11 155.07 40.15 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 124.293 1.037 . . . . 0.0 110.694 -161.685 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 97.7 m-70 -87.69 122.95 32.0 Favored 'General case' 0 CA--C 1.539 0.552 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 164.545 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 77.5 mt -140.71 130.83 24.81 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 125.869 1.668 . . . . 0.0 109.139 -172.086 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 64.8 m -134.17 143.16 47.74 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 125.024 1.33 . . . . 0.0 111.091 -175.374 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 55.61 -125.66 37.31 Favored Glycine 0 N--CA 1.472 1.099 0 C-N-CA 124.763 1.173 . . . . 0.0 114.427 166.225 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 24.5 p -62.57 -34.57 77.24 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 124.382 1.073 . . . . 0.0 112.607 179.34 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 24.7 m80 -68.13 -38.7 82.5 Favored 'General case' 0 CA--C 1.541 0.622 0 O-C-N 121.275 -0.89 . . . . 0.0 111.422 176.038 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 50.4 tp -63.8 -49.43 72.91 Favored 'General case' 0 N--CA 1.464 0.272 0 C-N-CA 123.469 0.708 . . . . 0.0 111.172 170.889 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 47.8 t -58.32 -39.94 76.04 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.905 0 C-N-CA 123.093 0.557 . . . . 0.0 111.83 177.938 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -64.68 -49.75 69.71 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 123.786 0.835 . . . . 0.0 111.82 175.384 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.9 -46.89 88.86 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 123.34 0.656 . . . . 0.0 111.932 179.362 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 52.4 tp -56.0 -50.71 70.11 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 126.365 1.866 . . . . 0.0 111.409 175.482 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 91.4 t80 -61.14 -40.09 92.53 Favored 'General case' 0 CA--C 1.54 0.572 0 N-CA-C 112.998 0.74 . . . . 0.0 112.998 175.093 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 79.0 mt -72.7 -36.05 67.76 Favored 'General case' 0 N--CA 1.471 0.621 0 N-CA-C 113.284 0.846 . . . . 0.0 113.284 -179.828 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 25.5 t -63.31 -45.86 97.09 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.081 0 C-N-CA 123.43 0.692 . . . . 0.0 110.45 171.408 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 69.7 m -83.6 -19.18 35.97 Favored 'General case' 0 CA--C 1.54 0.576 0 N-CA-C 114.193 1.183 . . . . 0.0 114.193 -173.685 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 76.44 -126.09 7.98 Favored Glycine 0 CA--C 1.53 1.019 0 C-N-CA 124.724 1.154 . . . . 0.0 111.574 174.146 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -72.5 -13.39 61.41 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 123.78 0.832 . . . . 0.0 113.121 175.677 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 87.7 mtm180 -71.07 159.16 35.22 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 124.645 1.178 . . . . 0.0 112.511 178.504 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . -91.76 157.72 24.64 Favored Glycine 0 CA--C 1.528 0.873 0 C-N-CA 125.631 1.586 . . . . 0.0 112.246 174.981 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 49.1 p90 -127.42 151.8 48.35 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 125.255 1.422 . . . . 0.0 112.757 -178.553 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 30.2 t80 . . . . . 0 CA--C 1.542 0.646 0 C-N-CA 126.38 1.872 . . . . 0.0 110.267 165.413 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 91.3 t . . . . . 0 N--CA 1.477 0.922 0 N-CA-C 110.441 -0.207 . . . . 0.0 110.441 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -62.33 -44.01 97.5 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 124.855 1.262 . . . . 0.0 111.359 176.731 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 17.5 tt0 -61.96 -56.44 19.18 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.074 0.949 . . . . 0.0 110.138 177.763 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 70.3 m -56.1 -33.43 65.08 Favored 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 113.759 1.022 . . . . 0.0 113.759 -179.728 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 12.6 t -91.38 -34.84 14.71 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 124.251 1.02 . . . . 0.0 113.691 -171.77 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 43.2 p -108.43 -26.08 10.65 Favored 'General case' 0 N--CA 1.482 1.134 0 N-CA-C 114.485 1.291 . . . . 0.0 114.485 -176.149 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 95.8 p -115.41 -131.28 0.32 Allowed 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 124.43 1.092 . . . . 0.0 109.129 162.337 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 10.0 tt -135.22 149.54 28.9 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 C-N-CA 125.219 1.408 . . . . 0.0 110.46 -177.95 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 15.6 p -140.26 157.19 45.97 Favored 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 113.427 0.899 . . . . 0.0 113.427 178.062 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 22.8 t -100.16 158.8 15.59 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-O 122.254 1.026 . . . . 0.0 113.151 178.271 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 52.7 mt -63.38 -33.92 76.6 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 123.847 0.859 . . . . 0.0 110.947 170.838 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 77.2 t80 -63.06 -29.58 70.92 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 124.103 0.961 . . . . 0.0 112.962 173.481 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 98.5 mt-30 -81.55 -38.88 25.49 Favored 'General case' 0 N--CA 1.467 0.381 0 C-N-CA 123.769 0.828 . . . . 0.0 110.736 176.101 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 86.8 mt -59.23 -36.06 74.75 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-N 119.135 0.88 . . . . 0.0 111.96 170.128 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -59.57 -26.98 65.86 Favored 'General case' 0 CA--C 1.546 0.799 0 N-CA-C 113.462 0.912 . . . . 0.0 113.462 178.722 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 26.4 t30 -60.86 -24.51 65.97 Favored 'General case' 0 CA--C 1.55 0.978 0 O-C-N 120.903 -1.123 . . . . 0.0 113.119 173.654 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 84.2 m-85 -98.47 5.96 47.59 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 126.429 1.892 . . . . 0.0 113.247 -178.079 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 71.1 m . . . . . 0 CA--C 1.543 0.674 0 C-N-CA 123.881 0.872 . . . . 0.0 112.753 166.12 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.541 0.597 0 N-CA-C 113.417 0.895 . . . . 0.0 113.417 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 38.5 mt-30 -147.4 163.04 37.73 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 124.961 1.305 . . . . 0.0 111.434 -168.427 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 98.2 m-70 -80.11 132.68 35.99 Favored 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 109.02 -0.733 . . . . 0.0 109.02 156.74 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 76.5 mt -148.21 139.13 23.14 Favored 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 125.327 1.451 . . . . 0.0 109.082 -176.464 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 2.8 t -159.14 155.7 27.7 Favored 'General case' 0 N--CA 1.468 0.474 0 O-C-N 121.587 -0.695 . . . . 0.0 111.904 -177.472 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 54.1 -135.17 44.02 Favored Glycine 0 CA--C 1.53 1.004 0 C-N-CA 124.922 1.249 . . . . 0.0 113.593 175.072 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 20.0 m -58.15 -33.02 68.73 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 124.056 0.942 . . . . 0.0 112.552 -179.712 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 76.2 m-70 -75.67 -28.76 58.83 Favored 'General case' 0 CA--C 1.543 0.688 0 O-C-N 121.102 -0.999 . . . . 0.0 112.85 178.565 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 9.3 tt -66.15 -46.52 77.19 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 119.312 0.96 . . . . 0.0 110.757 166.198 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 95.4 t -62.36 -38.93 82.45 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.766 0 C-N-CA 122.906 0.482 . . . . 0.0 111.396 179.364 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -62.13 -51.27 68.55 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 125.751 1.62 . . . . 0.0 111.691 172.234 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.04 -46.09 92.14 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 123.159 0.584 . . . . 0.0 111.913 179.151 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 58.5 tp -57.59 -53.19 60.96 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 124.66 1.184 . . . . 0.0 110.84 175.858 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 38.6 t80 -53.73 -41.42 67.05 Favored 'General case' 0 CA--C 1.543 0.693 0 N-CA-C 112.886 0.699 . . . . 0.0 112.886 175.308 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 83.2 mt -72.93 -33.08 65.72 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 124.203 1.001 . . . . 0.0 113.457 178.813 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 25.6 t -65.83 -43.91 93.07 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.922 0 C-N-CA 124.343 1.057 . . . . 0.0 110.344 170.78 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 69.5 m -73.07 -39.56 65.78 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 122.952 0.501 . . . . 0.0 112.335 -178.206 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 62.83 -104.35 0.78 Allowed Glycine 0 CA--C 1.533 1.176 0 C-N-CA 124.244 0.926 . . . . 0.0 112.059 174.006 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -77.05 -21.42 54.51 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 124.362 1.065 . . . . 0.0 113.854 175.045 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 1.4 mpp_? -73.52 154.01 40.05 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 123.528 0.731 . . . . 0.0 109.985 166.866 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . -77.4 -171.31 35.75 Favored Glycine 0 CA--C 1.534 1.267 0 C-N-CA 124.154 0.883 . . . . 0.0 111.248 166.101 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 43.8 p90 -156.53 162.96 39.9 Favored 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 113.969 1.1 . . . . 0.0 113.969 179.405 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 92.0 t80 . . . . . 0 CA--C 1.537 0.474 0 C-N-CA 125.436 1.494 . . . . 0.0 110.412 169.584 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 61.5 t . . . . . 0 N--CA 1.481 1.075 0 CA-C-O 119.285 -0.388 . . . . 0.0 110.971 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 79.5 mm-40 -72.13 -43.32 64.89 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 118.761 0.71 . . . . 0.0 111.149 171.912 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 66.3 tp60 -63.08 -36.24 82.93 Favored 'General case' 0 CA--C 1.534 0.34 0 O-C-N 121.744 -0.598 . . . . 0.0 112.135 -178.794 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 68.3 m -85.77 -29.8 23.55 Favored 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 114.575 1.324 . . . . 0.0 114.575 179.641 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 17.6 t -107.47 -41.67 5.01 Favored 'General case' 0 N--CA 1.473 0.698 0 N-CA-C 113.59 0.959 . . . . 0.0 113.59 -169.53 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 44.3 m -84.54 -46.34 11.69 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 125.013 1.325 . . . . 0.0 109.596 176.132 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 31.4 m -96.8 -162.74 0.98 Allowed 'General case' 0 CA--C 1.55 0.961 0 C-N-CA 124.643 1.177 . . . . 0.0 111.278 166.63 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 12.1 tt -111.38 148.3 14.74 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.944 0 C-N-CA 125.469 1.508 . . . . 0.0 110.154 170.996 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 14.7 p -135.5 163.12 30.81 Favored 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 113.554 0.946 . . . . 0.0 113.554 179.911 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 36.2 t -103.0 156.45 17.66 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 124.46 1.104 . . . . 0.0 112.6 177.07 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 69.0 mt -60.12 -30.0 69.0 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 123.977 0.911 . . . . 0.0 111.606 169.964 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 77.2 t80 -65.07 -27.39 68.74 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 123.997 0.919 . . . . 0.0 113.287 171.66 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 86.9 mt-30 -85.32 -33.16 22.15 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 124.061 0.944 . . . . 0.0 110.826 175.685 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 9.5 mp -56.18 -47.52 78.16 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 118.555 0.616 . . . . 0.0 110.749 165.274 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -66.35 -31.22 71.87 Favored 'General case' 0 CA--C 1.546 0.79 0 N-CA-C 112.817 0.673 . . . . 0.0 112.817 177.68 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 24.3 t30 -64.36 -26.94 68.69 Favored 'General case' 0 CA--C 1.547 0.856 0 O-C-N 120.953 -1.092 . . . . 0.0 112.902 173.934 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 10.7 m-85 -85.03 8.07 19.16 Favored 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 125.329 1.452 . . . . 0.0 114.02 171.901 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 73.3 m . . . . . 0 N--CA 1.472 0.629 0 C-N-CA 125.153 1.381 . . . . 0.0 113.408 175.556 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 44.4 p-10 . . . . . 0 CA--C 1.542 0.657 0 N-CA-C 113.541 0.941 . . . . 0.0 113.541 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 44.8 mt-30 -150.86 158.9 44.72 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 125.796 1.638 . . . . 0.0 110.953 -172.334 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 96.9 m-70 -87.52 127.78 35.24 Favored 'General case' 0 CA--C 1.54 0.59 0 N-CA-C 108.963 -0.754 . . . . 0.0 108.963 159.989 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 87.4 mt -140.62 131.41 25.84 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 125.876 1.67 . . . . 0.0 108.715 -173.476 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 71.7 m -138.07 146.23 42.7 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 124.483 1.113 . . . . 0.0 111.56 -172.861 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 55.57 -131.67 49.33 Favored Glycine 0 N--CA 1.471 0.978 0 C-N-CA 124.961 1.267 . . . . 0.0 114.208 165.262 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 22.6 m -59.13 -33.17 70.55 Favored 'General case' 0 N--CA 1.468 0.465 0 C-N-CA 124.241 1.016 . . . . 0.0 112.375 -179.543 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 75.2 m-70 -75.88 -27.8 57.89 Favored 'General case' 0 CA--C 1.542 0.639 0 O-C-N 121.065 -1.022 . . . . 0.0 112.813 176.336 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 54.9 tp -70.15 -46.79 63.98 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-N 119.104 0.865 . . . . 0.0 110.604 167.26 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 74.4 t -55.93 -43.0 73.41 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.306 0 CA-C-N 118.744 0.702 . . . . 0.0 111.43 174.675 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -60.45 -48.99 79.37 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 125.442 1.497 . . . . 0.0 111.477 173.039 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.35 -42.87 99.4 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 123.467 0.707 . . . . 0.0 112.673 179.215 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -52.71 -55.16 24.69 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-N 119.432 1.014 . . . . 0.0 110.58 172.576 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 70.6 t80 -60.21 -35.12 74.71 Favored 'General case' 0 CA--C 1.543 0.691 0 N-CA-C 113.471 0.915 . . . . 0.0 113.471 178.753 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 83.9 mt -74.93 -34.07 62.05 Favored 'General case' 0 N--CA 1.472 0.649 0 N-CA-C 113.524 0.935 . . . . 0.0 113.524 177.43 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 49.5 t -71.16 -42.89 75.58 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.918 0 C-N-CA 123.812 0.845 . . . . 0.0 110.765 174.544 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 70.2 m -102.67 -24.63 13.74 Favored 'General case' 0 N--CA 1.468 0.463 0 N-CA-C 114.771 1.397 . . . . 0.0 114.771 -165.76 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 64.59 -140.6 42.93 Favored Glycine 0 CA--C 1.534 1.231 0 C-N-CA 124.094 0.854 . . . . 0.0 112.315 -178.536 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 57.3 mp0 -65.03 -11.87 44.03 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 125.732 1.613 . . . . 0.0 114.19 -178.412 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 82.6 mtm180 -61.95 -28.79 69.79 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 124.195 0.998 . . . . 0.0 113.322 177.662 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 81.04 162.35 28.23 Favored Glycine 0 CA--C 1.532 1.155 0 C-N-CA 124.53 1.062 . . . . 0.0 112.918 -178.195 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 54.7 p90 -143.54 158.75 43.41 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 125.201 1.4 . . . . 0.0 113.48 -169.501 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 78.3 m-85 . . . . . 0 CA--C 1.54 0.587 0 C-N-CA 126.573 1.949 . . . . 0.0 110.648 169.912 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 56.1 t . . . . . 0 N--CA 1.48 1.07 0 N-CA-C 112.08 0.4 . . . . 0.0 112.08 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 14.4 mm-40 -82.84 -56.25 3.93 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 118.286 0.493 . . . . 0.0 110.618 167.333 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 1.2 tm0? -60.86 -46.41 90.71 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 123.035 0.534 . . . . 0.0 112.237 -166.673 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 70.4 m -76.65 -21.41 55.49 Favored 'General case' 0 N--CA 1.467 0.398 0 N-CA-C 114.289 1.218 . . . . 0.0 114.289 -177.339 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 10.6 t -100.69 -32.3 10.8 Favored 'General case' 0 CA--C 1.541 0.598 0 N-CA-C 113.244 0.831 . . . . 0.0 113.244 -173.851 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 44.5 p -95.76 -14.63 23.16 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 125.211 1.404 . . . . 0.0 113.429 176.586 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 84.3 p -144.34 -174.49 4.32 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 125.546 1.538 . . . . 0.0 110.173 174.279 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 16.9 tt -91.38 138.05 20.54 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.817 0 O-C-N 120.614 -1.304 . . . . 0.0 110.388 178.652 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 8.7 p -132.29 159.05 40.25 Favored 'General case' 0 N--CA 1.469 0.51 0 O-C-N 121.207 -0.933 . . . . 0.0 113.014 178.547 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 36.7 m -106.96 162.32 13.94 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 124.787 1.235 . . . . 0.0 111.145 -175.852 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 24.8 mt -59.32 -33.0 70.58 Favored 'General case' 0 CA--C 1.535 0.393 0 O-C-N 121.164 -0.96 . . . . 0.0 110.934 172.108 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 89.3 t80 -60.15 -33.16 71.78 Favored 'General case' 0 CA--C 1.546 0.815 0 N-CA-C 113.821 1.045 . . . . 0.0 113.821 170.68 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 14.0 mm100 -75.18 -33.92 61.5 Favored 'General case' 0 N--CA 1.471 0.589 0 O-C-N 121.537 -0.727 . . . . 0.0 111.217 174.941 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 93.2 mt -65.85 -44.33 85.8 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-N 118.307 0.503 . . . . 0.0 111.165 170.45 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -68.67 -26.83 65.51 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 125.325 1.45 . . . . 0.0 112.94 -177.078 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 18.6 t30 -52.73 -32.65 44.18 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 124.922 1.289 . . . . 0.0 113.771 179.773 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 84.3 m-85 -96.1 0.37 51.32 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 125.112 1.365 . . . . 0.0 114.365 -177.366 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 88.8 m . . . . . 0 CA--C 1.542 0.635 0 N-CA-C 114.333 1.234 . . . . 0.0 114.333 178.941 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 44.2 p-10 . . . . . 0 CA--C 1.543 0.698 0 CA-C-O 121.401 0.619 . . . . 0.0 112.403 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 41.4 mt-30 -148.34 162.55 39.3 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.039 0.936 . . . . 0.0 111.625 -160.535 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 95.7 m-70 -88.26 132.63 34.31 Favored 'General case' 0 CA--C 1.54 0.57 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 157.689 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 91.5 mt -144.43 132.5 21.6 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 125.347 1.459 . . . . 0.0 109.406 -174.668 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 62.6 m -139.52 151.2 45.94 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 125.159 1.384 . . . . 0.0 110.641 -175.909 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 57.78 -133.14 52.79 Favored Glycine 0 N--CA 1.473 1.112 0 C-N-CA 124.499 1.047 . . . . 0.0 114.466 165.558 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 13.5 t -59.1 -39.41 82.14 Favored 'General case' 0 N--CA 1.472 0.645 0 O-C-N 121.928 -0.748 . . . . 0.0 111.776 -179.875 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 22.1 m-70 -67.39 -29.56 69.1 Favored 'General case' 0 CA--C 1.544 0.716 0 O-C-N 120.524 -1.36 . . . . 0.0 112.62 178.285 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 55.9 tp -69.46 -40.32 77.21 Favored 'General case' 0 CA--C 1.54 0.572 0 O-C-N 121.524 -0.735 . . . . 0.0 111.508 169.753 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 85.5 t -60.87 -45.49 98.07 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.269 0 C-N-CA 123.101 0.56 . . . . 0.0 110.794 172.926 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -61.26 -48.1 82.98 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 124.039 0.936 . . . . 0.0 111.138 177.639 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.48 -47.59 84.95 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 118.499 0.59 . . . . 0.0 111.686 -179.612 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 61.6 tp -55.3 -52.67 62.71 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 124.57 1.148 . . . . 0.0 111.571 176.164 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 25.9 t80 -57.55 -42.27 82.64 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 123.733 0.813 . . . . 0.0 112.629 175.863 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 81.8 mt -74.95 -32.25 61.69 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 124.145 0.978 . . . . 0.0 113.195 -177.678 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 26.8 t -66.08 -47.42 85.0 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 C-N-CA 123.882 0.873 . . . . 0.0 110.405 171.563 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 85.7 m -84.1 -27.46 28.19 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 113.059 0.763 . . . . 0.0 113.059 -172.2 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 69.1 -118.33 8.65 Favored Glycine 0 N--CA 1.468 0.786 0 C-N-CA 124.837 1.208 . . . . 0.0 112.221 169.141 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -70.58 -19.53 62.85 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 124.38 1.072 . . . . 0.0 113.702 175.591 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 89.3 mtm180 -72.59 158.77 35.04 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 124.976 1.31 . . . . 0.0 111.524 177.433 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . -78.22 147.62 31.86 Favored Glycine 0 N--CA 1.467 0.745 0 N-CA-C 110.939 -0.864 . . . . 0.0 110.939 175.152 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 52.6 p90 -128.02 160.1 32.96 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 124.141 0.976 . . . . 0.0 113.054 179.572 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 27.6 t80 . . . . . 0 CA--C 1.536 0.404 0 C-N-CA 124.818 1.247 . . . . 0.0 110.67 175.376 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 82.9 t . . . . . 0 N--CA 1.478 0.963 0 CA-C-O 119.195 -0.431 . . . . 0.0 111.422 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -70.63 -42.79 70.42 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-N 119.108 0.867 . . . . 0.0 111.15 176.02 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 71.0 tp60 -58.96 -42.83 90.84 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 123.172 0.589 . . . . 0.0 111.647 -179.62 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 97.9 m -76.1 -31.35 58.66 Favored 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 114.487 1.292 . . . . 0.0 114.487 177.707 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 30.3 t -98.06 -43.5 7.02 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 113.468 0.914 . . . . 0.0 113.468 -167.852 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 64.3 m -88.97 -38.47 14.43 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 125.216 1.406 . . . . 0.0 110.926 179.81 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 9.5 t -107.91 -155.86 0.56 Allowed 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 124.923 1.289 . . . . 0.0 110.758 167.561 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 29.8 pt -107.81 152.39 9.55 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.565 0 C-N-CA 125.715 1.606 . . . . 0.0 111.609 172.912 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 14.0 p -139.57 164.21 30.52 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 123.799 0.84 . . . . 0.0 112.276 171.997 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 32.8 t -107.23 156.65 18.62 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 124.111 0.964 . . . . 0.0 113.068 179.251 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 62.9 mt -60.21 -33.08 71.74 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 124.176 0.991 . . . . 0.0 111.081 170.051 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 79.9 t80 -61.85 -28.6 69.6 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 124.685 1.194 . . . . 0.0 113.287 172.241 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 86.1 mt-30 -82.1 -39.56 23.19 Favored 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 123.642 0.777 . . . . 0.0 110.955 174.033 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 40.5 mt -58.16 -37.52 74.86 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-N 118.905 0.775 . . . . 0.0 112.218 172.662 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -59.01 -30.81 68.27 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 124.271 1.028 . . . . 0.0 113.181 179.216 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 89.0 m-20 -66.46 -18.78 65.55 Favored 'General case' 0 CA--C 1.544 0.725 0 O-C-N 121.127 -0.983 . . . . 0.0 113.511 179.196 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 92.2 m-85 -92.93 -7.41 46.13 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.177 1.391 . . . . 0.0 113.341 177.163 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 13.7 t . . . . . 0 N--CA 1.472 0.639 0 C-N-CA 124.835 1.254 . . . . 0.0 112.162 171.323 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 11.2 p30 . . . . . 0 CA--C 1.54 0.558 0 N-CA-C 112.562 0.578 . . . . 0.0 112.562 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 39.3 mt-30 -151.69 167.81 26.99 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.836 1.654 . . . . 0.0 111.224 -171.857 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 99.5 m-70 -87.02 133.34 33.6 Favored 'General case' 0 CA--C 1.541 0.63 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 153.312 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 85.4 mt -145.55 138.72 26.25 Favored 'General case' 0 N--CA 1.466 0.374 0 C-N-CA 126.039 1.736 . . . . 0.0 108.806 -177.812 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 3.3 t -155.79 153.88 30.51 Favored 'General case' 0 N--CA 1.47 0.53 0 O-C-N 121.373 -0.83 . . . . 0.0 112.357 -175.899 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 50.6 -127.44 26.9 Favored Glycine 0 N--CA 1.472 1.042 0 C-N-CA 125.185 1.374 . . . . 0.0 113.69 175.327 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 16.1 m -58.27 -34.75 70.85 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 124.193 0.997 . . . . 0.0 112.556 178.881 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 80.5 m-70 -76.19 -27.54 56.94 Favored 'General case' 0 CA--C 1.541 0.614 0 O-C-N 121.363 -0.836 . . . . 0.0 113.121 178.477 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 56.3 tp -69.17 -45.41 70.08 Favored 'General case' 0 N--CA 1.469 0.492 0 O-C-N 121.423 -0.798 . . . . 0.0 110.889 168.042 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 77.7 t -62.59 -37.28 78.52 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.08 0 C-N-CA 123.607 0.763 . . . . 0.0 111.467 175.715 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 43.9 tt0 -63.54 -48.55 77.02 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 125.174 1.389 . . . . 0.0 111.462 172.507 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.51 -43.54 98.57 Favored 'General case' 0 CA--C 1.54 0.593 0 O-C-N 121.563 -0.71 . . . . 0.0 112.253 178.243 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 18.4 mt -54.7 -48.69 72.15 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 124.244 1.017 . . . . 0.0 111.008 171.67 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 80.6 t80 -62.85 -37.33 86.41 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 113.201 0.815 . . . . 0.0 113.201 176.193 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 78.5 mt -72.95 -34.65 66.66 Favored 'General case' 0 N--CA 1.47 0.564 0 O-C-N 121.266 -0.896 . . . . 0.0 112.891 178.551 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 44.8 t -73.3 -41.86 57.62 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 C-N-CA 124.236 1.014 . . . . 0.0 111.299 174.935 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 44.5 t -90.05 -30.73 17.53 Favored 'General case' 0 CA--C 1.537 0.479 0 N-CA-C 113.957 1.095 . . . . 0.0 113.957 -171.995 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 71.01 -155.71 52.89 Favored Glycine 0 CA--C 1.532 1.102 0 C-N-CA 124.223 0.916 . . . . 0.0 112.078 -171.093 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -71.34 -3.77 22.44 Favored 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 124.746 1.218 . . . . 0.0 113.98 179.734 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 58.5 mtp180 -57.8 -34.09 69.26 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 124.845 1.258 . . . . 0.0 113.178 175.49 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 88.04 147.0 12.5 Favored Glycine 0 CA--C 1.531 1.061 0 C-N-CA 125.349 1.452 . . . . 0.0 112.83 178.746 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 52.2 p90 -137.87 166.66 23.49 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 125.27 1.428 . . . . 0.0 112.21 -173.234 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 88.7 t80 . . . . . 0 CA--C 1.536 0.429 0 C-N-CA 124.661 1.184 . . . . 0.0 110.279 174.377 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 86.5 t . . . . . 0 N--CA 1.48 1.036 0 CA-C-O 118.846 -0.597 . . . . 0.0 112.334 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -73.8 -36.44 65.01 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 119.344 0.974 . . . . 0.0 111.312 175.595 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 8.0 tt0 -61.42 -36.79 81.32 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 124.317 1.047 . . . . 0.0 111.882 179.699 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 95.6 m -88.65 -27.93 20.96 Favored 'General case' 0 CA--C 1.534 0.353 0 N-CA-C 114.679 1.363 . . . . 0.0 114.679 176.807 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 20.7 t -102.04 -46.05 4.98 Favored 'General case' 0 N--CA 1.475 0.781 0 N-CA-C 113.281 0.845 . . . . 0.0 113.281 -169.456 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 22.8 m -86.24 -44.72 11.93 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 125.39 1.476 . . . . 0.0 109.829 178.636 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 69.0 m -95.26 -169.55 2.0 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 124.567 1.147 . . . . 0.0 110.739 163.251 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 32.4 pt -108.35 144.94 16.03 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.755 0 C-N-CA 124.914 1.286 . . . . 0.0 110.403 169.485 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 19.3 p -126.41 151.82 47.17 Favored 'General case' 0 N--CA 1.47 0.575 0 C-N-CA 123.744 0.818 . . . . 0.0 112.332 176.683 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 90.1 p -91.05 166.93 12.74 Favored 'General case' 0 C--N 1.323 -0.56 0 C-N-CA 124.392 1.077 . . . . 0.0 113.428 174.648 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 46.6 mt -61.65 -34.78 76.3 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 123.339 0.656 . . . . 0.0 111.505 169.74 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 59.5 m-85 -66.4 -33.92 76.8 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.599 1.159 . . . . 0.0 112.698 175.001 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 85.5 mt-30 -75.29 -35.27 61.33 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 124.323 1.049 . . . . 0.0 112.026 173.056 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 93.3 mt -61.52 -42.04 98.21 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-N 119.582 1.083 . . . . 0.0 111.049 168.19 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -60.0 -30.18 68.96 Favored 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 123.936 0.895 . . . . 0.0 112.682 179.463 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 15.9 t-20 -64.54 -22.49 66.98 Favored 'General case' 0 CA--C 1.55 0.962 0 N-CA-C 113.402 0.889 . . . . 0.0 113.402 176.486 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 61.7 m-85 -99.34 2.4 45.32 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.644 1.578 . . . . 0.0 114.126 178.905 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 37.7 m . . . . . 0 N--CA 1.474 0.73 0 O-C-N 121.144 -0.973 . . . . 0.0 111.135 163.124 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 9.3 m120 . . . . . 0 CA--C 1.535 0.402 0 CA-C-O 121.347 0.594 . . . . 0.0 111.557 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 43.5 mt-30 -145.5 159.33 43.27 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 125.212 1.405 . . . . 0.0 110.64 -174.628 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 62.4 m-70 -82.31 127.46 33.24 Favored 'General case' 0 CA--C 1.537 0.456 0 N-CA-C 108.766 -0.827 . . . . 0.0 108.766 156.359 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 93.0 mt -141.87 132.68 25.75 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 126.014 1.726 . . . . 0.0 108.092 -177.726 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 3.0 t -153.84 153.92 32.99 Favored 'General case' 0 N--CA 1.468 0.434 0 O-C-N 121.044 -1.035 . . . . 0.0 112.279 -173.91 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 55.45 -129.54 46.59 Favored Glycine 0 CA--C 1.529 0.96 0 C-N-CA 125.097 1.332 . . . . 0.0 113.331 176.676 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 20.5 p -60.96 -33.99 74.05 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 124.506 1.123 . . . . 0.0 112.734 177.718 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 26.1 m80 -68.7 -36.66 78.76 Favored 'General case' 0 CA--C 1.542 0.652 0 O-C-N 121.229 -0.919 . . . . 0.0 111.708 176.292 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 55.7 tp -67.07 -46.04 75.49 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 123.072 0.549 . . . . 0.0 111.004 171.409 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 55.1 t -58.52 -42.56 84.86 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.992 0 C-N-CA 122.959 0.503 . . . . 0.0 111.126 177.011 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -64.98 -47.81 76.24 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 124.175 0.99 . . . . 0.0 111.415 176.562 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.7 -47.5 83.36 Favored 'General case' 0 CA--C 1.54 0.568 0 O-C-N 121.42 -0.8 . . . . 0.0 111.789 -179.508 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 31.0 tp -60.87 -45.65 93.7 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 124.388 1.075 . . . . 0.0 111.019 177.778 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 83.9 t80 -56.79 -43.66 81.14 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 123.621 0.768 . . . . 0.0 112.926 172.758 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 79.7 mt -72.75 -33.41 66.35 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 123.677 0.791 . . . . 0.0 113.04 -179.619 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 41.2 t -68.14 -43.34 85.13 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.739 0 C-N-CA 123.742 0.817 . . . . 0.0 111.105 172.837 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 83.5 m -82.35 -30.27 30.46 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 113.664 0.987 . . . . 0.0 113.664 -175.407 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 62.77 -131.24 43.36 Favored Glycine 0 CA--C 1.531 1.053 0 C-N-CA 124.487 1.041 . . . . 0.0 112.176 -178.771 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 31.1 mm-40 -64.9 -18.95 65.64 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 124.929 1.292 . . . . 0.0 114.193 -176.246 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -70.52 -43.08 70.34 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 124.128 0.971 . . . . 0.0 112.763 -174.19 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 86.19 -179.44 49.58 Favored Glycine 0 CA--C 1.534 1.28 0 C-N-CA 124.359 0.98 . . . . 0.0 113.017 -168.278 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 43.4 p90 -152.65 166.31 32.5 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 125.35 1.46 . . . . 0.0 113.261 -170.032 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 47.7 t80 . . . . . 0 CA--C 1.54 0.57 0 C-N-CA 124.648 1.179 . . . . 0.0 110.01 169.137 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 45.4 t . . . . . 0 N--CA 1.48 1.032 0 CA-C-O 120.411 0.148 . . . . 0.0 111.144 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 14.2 pm0 -69.55 -30.61 68.46 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 125.398 1.479 . . . . 0.0 112.651 176.828 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 33.5 tt0 -73.5 -45.4 54.15 Favored 'General case' 0 N--CA 1.465 0.315 0 C-N-CA 124.093 0.957 . . . . 0.0 110.422 177.25 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 67.0 m -60.01 -24.07 64.18 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 124.545 1.138 . . . . 0.0 113.326 170.835 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 9.5 t -84.78 -51.36 6.84 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 124.129 0.972 . . . . 0.0 111.095 -179.644 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 47.2 p -79.68 -23.47 42.43 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 125.531 1.532 . . . . 0.0 113.721 -175.913 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.5 t -140.37 -173.7 3.75 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 125.857 1.663 . . . . 0.0 110.818 175.008 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 39.1 pt -81.86 144.37 10.49 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.398 0 O-C-N 120.905 -1.122 . . . . 0.0 111.539 175.634 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 12.6 p -137.29 165.69 25.57 Favored 'General case' 0 N--CA 1.466 0.329 0 C-N-CA 124.677 1.191 . . . . 0.0 110.979 166.958 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 96.0 p -108.54 166.55 10.7 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 124.374 1.07 . . . . 0.0 113.73 -174.92 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 56.1 mt -64.38 -35.26 80.32 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 123.376 0.67 . . . . 0.0 112.092 175.013 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 29.1 p90 -68.95 -32.23 71.67 Favored 'General case' 0 N--CA 1.468 0.452 0 O-C-N 121.103 -0.998 . . . . 0.0 113.19 174.034 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 39.0 mt-30 -70.92 -33.69 70.77 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-O 118.819 -0.61 . . . . 0.0 112.187 171.819 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 76.0 mt -65.29 -40.39 93.79 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-N 119.417 1.008 . . . . 0.0 111.608 167.086 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 23.1 tt0 -62.54 -24.02 67.29 Favored 'General case' 0 CA--C 1.54 0.579 0 N-CA-C 113.213 0.82 . . . . 0.0 113.213 -178.125 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 19.9 t-20 -57.58 -26.39 61.41 Favored 'General case' 0 CA--C 1.552 1.034 0 O-C-N 120.967 -1.083 . . . . 0.0 113.367 171.883 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 2.4 m-30 -89.73 -10.35 46.0 Favored 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 125.008 1.323 . . . . 0.0 113.839 174.705 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 64.0 m . . . . . 0 N--CA 1.479 1.003 0 CA-C-N 120.315 1.416 . . . . 0.0 111.823 171.77 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.54 0.585 0 N-CA-C 113.414 0.894 . . . . 0.0 113.414 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 44.7 mt-30 -149.06 163.93 36.11 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 125.683 1.593 . . . . 0.0 110.904 -170.822 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 36.0 m-70 -81.96 132.49 35.26 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 108.915 -0.772 . . . . 0.0 108.915 156.345 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 86.7 mt -146.11 135.2 22.68 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 126.541 1.936 . . . . 0.0 108.851 -177.06 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 4.4 t -151.91 153.57 34.39 Favored 'General case' 0 N--CA 1.467 0.424 0 O-C-N 121.445 -0.785 . . . . 0.0 112.395 -173.386 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 51.53 -132.05 35.02 Favored Glycine 0 CA--C 1.531 1.075 0 C-N-CA 125.38 1.466 . . . . 0.0 113.831 174.817 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 19.8 m -58.56 -36.7 74.32 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 124.341 1.056 . . . . 0.0 112.108 -179.899 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 19.5 m-70 -71.54 -30.8 66.32 Favored 'General case' 0 CA--C 1.541 0.603 0 O-C-N 121.148 -0.97 . . . . 0.0 112.478 179.007 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 7.8 tt -67.01 -44.54 80.08 Favored 'General case' 0 C--N 1.343 0.288 0 O-C-N 121.37 -0.831 . . . . 0.0 111.227 166.381 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 72.4 t -60.1 -38.3 76.42 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.072 0 CA-C-N 118.907 0.776 . . . . 0.0 111.525 177.467 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -63.74 -50.49 68.9 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.496 1.118 . . . . 0.0 111.669 171.604 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.45 -44.23 97.47 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 118.578 0.626 . . . . 0.0 112.21 179.946 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 48.0 tp -57.99 -53.05 62.66 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 125.738 1.615 . . . . 0.0 110.698 175.375 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 51.9 t80 -54.34 -42.21 69.97 Favored 'General case' 0 CA--C 1.543 0.676 0 N-CA-C 112.952 0.723 . . . . 0.0 112.952 174.053 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 77.3 mt -69.94 -35.44 74.52 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 123.983 0.913 . . . . 0.0 112.857 178.682 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 39.6 t -64.21 -44.39 97.45 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.853 0 C-N-CA 124.483 1.113 . . . . 0.0 111.039 170.603 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 56.5 m -73.17 -29.04 62.56 Favored 'General case' 0 CA--C 1.54 0.591 0 N-CA-C 112.961 0.726 . . . . 0.0 112.961 -179.002 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 70.57 -120.1 8.84 Favored Glycine 0 CA--C 1.529 0.918 0 C-N-CA 125.03 1.3 . . . . 0.0 110.748 177.492 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 37.4 mp0 -67.3 -22.4 65.63 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 124.581 1.152 . . . . 0.0 112.659 173.566 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 56.2 mtm-85 -79.18 153.97 29.63 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 124.479 1.111 . . . . 0.0 111.451 -179.724 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . -86.76 -178.35 49.21 Favored Glycine 0 CA--C 1.529 0.943 0 C-N-CA 125.128 1.347 . . . . 0.0 112.618 172.327 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 42.0 p90 -146.06 151.94 38.53 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 124.659 1.183 . . . . 0.0 114.15 -176.74 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 64.1 t80 . . . . . 0 CA--C 1.541 0.601 0 C-N-CA 126.458 1.903 . . . . 0.0 109.76 161.151 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 78.0 t . . . . . 0 N--CA 1.485 1.321 0 N-CA-C 113.525 0.935 . . . . 0.0 113.525 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 68.5 mm-40 -100.79 -44.12 5.89 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 119.074 0.852 . . . . 0.0 109.923 164.378 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 54.7 tt0 -59.21 -45.26 91.56 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 123.967 0.907 . . . . 0.0 113.159 -172.354 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 2.6 t -84.71 -16.74 40.71 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-N 119.756 1.162 . . . . 0.0 113.381 -177.07 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 79.5 m -76.53 -41.67 45.93 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 123.966 0.906 . . . . 0.0 111.809 170.992 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 72.3 p -93.94 -36.31 12.24 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 125.147 1.379 . . . . 0.0 112.928 -175.001 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.9 t -121.08 -160.2 0.84 Allowed 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 126.268 1.827 . . . . 0.0 110.255 174.342 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 69.5 mt -103.3 144.39 14.0 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.746 0 C-N-CA 125.555 1.542 . . . . 0.0 110.163 -178.129 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 15.1 p -130.92 157.7 42.23 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 123.845 0.858 . . . . 0.0 112.749 164.472 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 59.6 p -95.33 162.91 13.48 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 124.784 1.234 . . . . 0.0 113.234 177.358 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 51.6 mt -61.47 -33.39 73.68 Favored 'General case' 0 N--CA 1.468 0.462 0 O-C-N 121.502 -0.749 . . . . 0.0 111.781 172.027 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 58.2 m-85 -65.15 -33.9 77.12 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 123.853 0.861 . . . . 0.0 112.654 173.824 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 90.0 mt-30 -75.76 -34.41 60.25 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 124.061 0.944 . . . . 0.0 111.567 174.166 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 83.3 mt -62.45 -41.11 98.5 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 119.767 1.167 . . . . 0.0 111.49 167.967 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 31.8 tt0 -62.92 -27.32 69.29 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 123.669 0.788 . . . . 0.0 112.89 -179.482 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 15.5 t-20 -59.79 -21.89 61.44 Favored 'General case' 0 CA--C 1.549 0.919 0 N-CA-C 113.485 0.92 . . . . 0.0 113.485 175.237 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 86.5 m-85 -97.39 -0.58 46.05 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 125.419 1.488 . . . . 0.0 114.266 178.255 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 55.5 m . . . . . 0 CA--C 1.543 0.676 0 O-C-N 121.071 -1.018 . . . . 0.0 111.356 167.424 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 1.5 p-10 . . . . . 0 CA--C 1.541 0.621 0 N-CA-C 112.974 0.731 . . . . 0.0 112.974 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 28.6 mm-40 -152.57 167.94 27.21 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 125.302 1.441 . . . . 0.0 112.041 -169.041 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 98.2 m-70 -83.21 138.23 33.7 Favored 'General case' 0 CA--C 1.543 0.682 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 155.903 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 79.2 mt -151.86 133.95 15.07 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 124.907 1.283 . . . . 0.0 109.08 -175.156 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 2.0 t -151.59 152.05 32.37 Favored 'General case' 0 N--CA 1.465 0.318 0 N-CA-C 112.8 0.667 . . . . 0.0 112.8 -177.815 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 60.99 -130.68 47.95 Favored Glycine 0 CA--C 1.529 0.969 0 C-N-CA 124.886 1.231 . . . . 0.0 113.472 175.543 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 19.8 p -61.3 -33.69 73.99 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 124.016 0.927 . . . . 0.0 112.161 179.481 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 11.6 m80 -64.36 -40.95 96.86 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 124.461 1.104 . . . . 0.0 111.557 176.472 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 60.2 tp -68.33 -43.67 77.02 Favored 'General case' 0 N--CA 1.468 0.433 0 C-N-CA 124.119 0.968 . . . . 0.0 111.461 176.001 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 79.5 t -64.35 -37.77 80.81 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.958 0 C-N-CA 123.422 0.689 . . . . 0.0 111.858 176.172 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -67.19 -45.44 76.88 Favored 'General case' 0 N--CA 1.466 0.375 0 C-N-CA 124.196 0.999 . . . . 0.0 111.581 173.722 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.43 -45.29 91.98 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 123.173 0.589 . . . . 0.0 111.735 176.976 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 27.4 mt -53.63 -54.79 32.67 Favored 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 124.29 1.036 . . . . 0.0 111.526 171.371 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 90.0 t80 -54.86 -42.48 72.06 Favored 'General case' 0 CA--C 1.543 0.688 0 N-CA-C 112.763 0.653 . . . . 0.0 112.763 177.774 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 92.4 mt -74.65 -35.36 62.85 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 124.158 0.983 . . . . 0.0 113.274 -178.893 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 33.9 t -68.07 -43.89 84.98 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 C-N-CA 124.034 0.934 . . . . 0.0 110.664 173.661 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 84.6 m -77.43 -32.11 54.41 Favored 'General case' 0 CA--C 1.54 0.591 0 N-CA-C 112.782 0.66 . . . . 0.0 112.782 -176.409 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 69.14 -119.76 9.85 Favored Glycine 0 N--CA 1.467 0.746 0 C-N-CA 124.354 0.978 . . . . 0.0 111.438 174.927 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -64.25 -24.49 67.68 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 124.839 1.255 . . . . 0.0 112.658 174.203 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 83.9 mtm180 -75.56 146.22 40.62 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 124.625 1.17 . . . . 0.0 110.95 175.896 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . -75.72 178.62 47.98 Favored Glycine 0 N--CA 1.475 1.248 0 C-N-CA 123.4 0.524 . . . . 0.0 111.968 166.514 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 55.0 p90 -148.27 161.23 41.93 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 124.074 0.949 . . . . 0.0 113.231 174.343 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 83.3 t80 . . . . . 0 CA--C 1.536 0.419 0 C-N-CA 124.896 1.278 . . . . 0.0 110.145 171.613 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 60.5 t . . . . . 0 N--CA 1.484 1.273 0 N-CA-C 112.553 0.575 . . . . 0.0 112.553 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -76.44 -44.0 37.68 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 122.858 0.463 . . . . 0.0 110.83 173.602 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -59.22 -49.17 78.87 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 124.827 1.251 . . . . 0.0 111.822 -173.063 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 8.1 t -74.91 -17.99 60.48 Favored 'General case' 0 N--CA 1.472 0.626 0 N-CA-C 113.542 0.941 . . . . 0.0 113.542 -176.696 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 42.3 t -90.06 -41.41 11.7 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 124.977 1.311 . . . . 0.0 112.46 177.286 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 50.1 m -82.35 -44.68 15.87 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 126.718 2.007 . . . . 0.0 110.572 -177.784 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 73.0 m -108.77 -132.4 0.32 Allowed 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 125.948 1.699 . . . . 0.0 108.512 165.851 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 29.8 pt -136.73 161.9 35.64 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.776 0 C-N-CA 125.843 1.657 . . . . 0.0 112.184 -174.363 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 13.8 p -150.81 162.96 39.74 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 123.664 0.786 . . . . 0.0 112.38 167.046 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 10.8 t -106.88 164.11 12.39 Favored 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 125.3 1.44 . . . . 0.0 112.752 -177.919 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 28.5 mt -60.36 -35.62 76.11 Favored 'General case' 0 N--CA 1.468 0.425 0 C-N-CA 124.724 1.209 . . . . 0.0 111.945 -178.526 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 80.3 t80 -62.93 -29.98 71.21 Favored 'General case' 0 CA--C 1.543 0.685 0 N-CA-C 113.665 0.987 . . . . 0.0 113.665 172.349 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 75.8 mt-30 -82.2 -30.95 30.59 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 123.724 0.809 . . . . 0.0 111.376 176.649 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 88.4 mt -60.81 -48.91 79.64 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-N 118.503 0.592 . . . . 0.0 110.667 164.862 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 28.7 tt0 -63.0 -24.48 67.94 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 123.873 0.869 . . . . 0.0 112.938 -176.524 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 26.4 t30 -57.68 -27.26 62.74 Favored 'General case' 0 CA--C 1.549 0.932 0 O-C-N 121.118 -0.989 . . . . 0.0 113.422 174.893 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 64.7 m-85 -89.25 -3.8 58.41 Favored 'General case' 0 CA--C 1.548 0.887 0 C-N-CA 125.215 1.406 . . . . 0.0 113.714 176.965 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 79.8 m . . . . . 0 N--CA 1.47 0.562 0 C-N-CA 124.857 1.263 . . . . 0.0 113.203 176.141 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 11.9 p30 . . . . . 0 CA--C 1.54 0.567 0 N-CA-C 113.209 0.818 . . . . 0.0 113.209 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 39.6 mt-30 -147.36 160.79 42.14 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 125.247 1.419 . . . . 0.0 110.657 -178.162 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 98.1 m-70 -81.36 127.11 32.4 Favored 'General case' 0 CA--C 1.54 0.576 0 N-CA-C 108.432 -0.951 . . . . 0.0 108.432 155.926 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 90.7 mt -143.28 130.0 20.33 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 124.679 1.192 . . . . 0.0 109.907 -177.204 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 83.8 m -128.72 141.23 51.39 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 124.805 1.242 . . . . 0.0 111.787 -174.926 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 49.0 -120.16 6.76 Favored Glycine 0 N--CA 1.473 1.153 0 C-N-CA 125.652 1.596 . . . . 0.0 114.525 164.556 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 25.3 m -58.2 -38.54 76.94 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 123.979 0.912 . . . . 0.0 112.481 -179.623 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 80.2 m-70 -75.37 -28.18 59.43 Favored 'General case' 0 CA--C 1.541 0.628 0 O-C-N 121.203 -0.936 . . . . 0.0 112.804 177.765 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 51.4 tp -67.23 -46.96 72.21 Favored 'General case' 0 N--CA 1.469 0.507 0 O-C-N 121.345 -0.847 . . . . 0.0 110.824 169.952 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 75.6 t -66.87 -33.88 66.3 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.019 0 C-N-CA 123.752 0.821 . . . . 0.0 111.651 176.591 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 43.2 tt0 -63.69 -49.82 71.65 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 124.987 1.315 . . . . 0.0 111.254 171.781 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -58.94 -45.61 90.01 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 123.159 0.584 . . . . 0.0 112.003 176.845 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 59.9 tp -55.37 -51.44 66.81 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 125.522 1.529 . . . . 0.0 111.745 174.633 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 80.9 t80 -58.61 -40.12 82.37 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 123.823 0.849 . . . . 0.0 112.849 175.062 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 85.8 mt -76.83 -34.35 57.89 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 124.075 0.95 . . . . 0.0 113.246 -177.913 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 27.3 t -63.22 -47.05 94.11 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.843 0 C-N-CA 124.267 1.027 . . . . 0.0 110.25 172.297 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 84.5 m -87.78 -23.78 23.98 Favored 'General case' 0 N--CA 1.471 0.579 0 N-CA-C 113.821 1.045 . . . . 0.0 113.821 -172.82 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 66.48 -115.06 7.0 Favored Glycine 0 CA--C 1.529 0.909 0 C-N-CA 124.625 1.107 . . . . 0.0 111.846 172.464 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -72.56 -19.88 61.42 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 123.844 0.858 . . . . 0.0 112.854 175.257 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 71.6 mtp180 -75.8 133.04 40.76 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 123.969 0.908 . . . . 0.0 109.72 172.932 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . -89.67 167.74 33.93 Favored Glycine 0 N--CA 1.469 0.842 0 C-N-CA 125.268 1.413 . . . . 0.0 113.094 -178.668 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 45.4 p90 -135.36 163.83 29.13 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 124.986 1.314 . . . . 0.0 113.595 -179.502 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 85.1 t80 . . . . . 0 CA--C 1.537 0.478 0 C-N-CA 126.161 1.784 . . . . 0.0 108.484 162.478 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 16.6 t . . . . . 0 N--CA 1.485 1.296 0 CA-C-O 121.597 0.713 . . . . 0.0 110.254 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 4.9 pm0 -71.41 -0.09 9.47 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 127.322 2.249 . . . . 0.0 113.905 174.007 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 33.4 tt0 -104.72 -60.06 1.65 Allowed 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 123.861 0.865 . . . . 0.0 109.638 161.982 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 92.7 m -58.16 -30.9 66.75 Favored 'General case' 0 N--CA 1.467 0.411 0 N-CA-C 115.308 1.595 . . . . 0.0 115.308 -171.175 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 16.6 t -84.71 -38.94 19.11 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 123.194 0.598 . . . . 0.0 112.604 -172.553 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 22.0 p -99.97 -31.8 11.29 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 125.609 1.563 . . . . 0.0 113.618 -177.727 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.8 t -117.78 -166.2 1.18 Allowed 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 126.112 1.765 . . . . 0.0 110.206 172.603 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 14.9 tt -96.56 149.84 4.65 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.66 0 C-N-CA 124.631 1.172 . . . . 0.0 110.782 176.654 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 15.6 p -141.93 157.11 45.35 Favored 'General case' 0 N--CA 1.471 0.594 0 O-C-N 121.267 -0.896 . . . . 0.0 113.135 174.266 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 35.6 m -103.12 152.57 21.26 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 124.022 0.929 . . . . 0.0 112.335 -171.805 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 42.6 mt -60.27 -32.7 71.42 Favored 'General case' 0 N--CA 1.473 0.719 0 O-C-N 121.101 -0.999 . . . . 0.0 111.7 176.019 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 56.4 m-85 -61.77 -31.94 72.17 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 124.392 1.077 . . . . 0.0 113.534 172.422 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 97.1 mt-30 -79.96 -35.55 37.44 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 124.705 1.202 . . . . 0.0 110.833 175.415 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 63.1 mt -61.74 -39.01 90.08 Favored 'General case' 0 N--CA 1.473 0.684 0 CA-C-N 118.499 0.59 . . . . 0.0 111.946 168.662 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 28.8 tt0 -63.56 -30.53 71.63 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 123.419 0.688 . . . . 0.0 112.769 179.295 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 45.4 t30 -62.3 -20.77 64.66 Favored 'General case' 0 CA--C 1.55 0.977 0 O-C-N 120.924 -1.11 . . . . 0.0 113.007 173.417 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 1.4 m-85 -97.16 5.13 50.71 Favored 'General case' 0 CA--C 1.549 0.909 0 C-N-CA 125.989 1.715 . . . . 0.0 114.089 175.81 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 79.5 m . . . . . 0 N--CA 1.473 0.692 0 CA-C-N 119.355 0.98 . . . . 0.0 112.682 169.034 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 25.0 p-10 . . . . . 0 CA--C 1.542 0.66 0 N-CA-C 113.125 0.787 . . . . 0.0 113.125 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 45.5 mm-40 -153.4 164.51 38.03 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 125.486 1.514 . . . . 0.0 111.979 -169.516 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 98.4 m-70 -83.74 133.08 34.8 Favored 'General case' 0 CA--C 1.542 0.637 0 O-C-N 121.653 -0.655 . . . . 0.0 109.259 158.359 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 84.0 mt -150.49 135.17 17.4 Favored 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 124.83 1.252 . . . . 0.0 109.97 -170.722 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 3.6 t -154.45 155.54 35.12 Favored 'General case' 0 N--CA 1.468 0.439 0 O-C-N 121.488 -0.757 . . . . 0.0 111.869 -179.925 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 52.84 -129.3 38.37 Favored Glycine 0 N--CA 1.47 0.944 0 C-N-CA 124.923 1.249 . . . . 0.0 113.536 176.393 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 28.3 p -56.78 -36.48 69.9 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 125.028 1.331 . . . . 0.0 113.065 178.662 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 75.3 m-70 -73.76 -29.62 62.32 Favored 'General case' 0 CA--C 1.541 0.631 0 O-C-N 120.883 -1.136 . . . . 0.0 113.07 177.181 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 35.9 tp -71.59 -42.1 68.16 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 119.172 0.896 . . . . 0.0 110.774 170.291 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 49.7 t -59.07 -41.48 83.59 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.074 0 C-N-CA 124.032 0.933 . . . . 0.0 111.526 172.24 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 43.3 tt0 -63.78 -47.29 81.52 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 125.631 1.572 . . . . 0.0 111.779 174.655 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.8 -43.86 97.69 Favored 'General case' 0 CA--C 1.537 0.447 0 O-C-N 121.749 -0.594 . . . . 0.0 111.61 179.168 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 40.1 mt -56.69 -52.45 64.89 Favored 'General case' 0 N--CA 1.465 0.318 0 C-N-CA 123.675 0.79 . . . . 0.0 111.307 172.181 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 77.2 t80 -53.16 -41.39 65.11 Favored 'General case' 0 CA--C 1.542 0.658 0 N-CA-C 112.803 0.668 . . . . 0.0 112.803 176.044 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 88.6 mt -75.24 -36.44 61.29 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 124.401 1.08 . . . . 0.0 113.525 179.962 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 36.9 t -71.25 -41.38 74.8 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.038 0 C-N-CA 124.249 1.02 . . . . 0.0 110.617 176.186 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 86.3 m -81.47 -38.77 25.85 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 123.825 0.85 . . . . 0.0 112.246 -175.175 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 62.26 -100.52 0.31 Allowed Glycine 0 N--CA 1.472 1.048 0 C-N-CA 124.483 1.039 . . . . 0.0 112.813 172.051 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -69.93 -31.29 68.98 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 124.824 1.249 . . . . 0.0 112.458 174.302 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 1.3 mpp_? -75.52 153.88 37.21 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.072 0.949 . . . . 0.0 110.426 170.243 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . -81.44 -164.9 33.74 Favored Glycine 0 CA--C 1.531 1.064 0 C-N-CA 124.027 0.822 . . . . 0.0 111.26 165.12 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 51.3 p90 -154.63 156.92 37.39 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 124.192 0.997 . . . . 0.0 113.503 177.847 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 60.3 t80 . . . . . 0 CA--C 1.541 0.632 0 C-N-CA 125.08 1.352 . . . . 0.0 113.704 -176.103 . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 99.1 t . . . . . 0 N--CA 1.481 1.083 0 CA-C-O 119.401 -0.333 . . . . 0.0 110.809 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 5.5 pm0 -67.5 -32.45 73.27 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 124.388 1.075 . . . . 0.0 111.265 171.904 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 8.5 tt0 -66.41 -38.19 86.92 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 124.24 1.016 . . . . 0.0 111.617 179.726 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 3.3 t -88.79 -16.76 31.3 Favored 'General case' 0 CA--C 1.544 0.719 0 N-CA-C 114.247 1.203 . . . . 0.0 114.247 176.01 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 52.5 t -97.92 -53.53 3.37 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 124.864 1.266 . . . . 0.0 113.633 -175.819 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 38.5 m -77.97 -47.36 18.72 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 125.396 1.478 . . . . 0.0 109.701 -179.245 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 74.7 m -90.47 -152.85 0.28 Allowed 'General case' 0 CA--C 1.551 1.01 0 C-N-CA 123.737 0.815 . . . . 0.0 109.888 158.224 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 28.8 pt -132.13 154.57 40.37 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.99 0 O-C-N 120.485 -1.384 . . . . 0.0 111.902 -176.821 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 1.1 p -149.94 164.89 34.24 Favored 'General case' 0 N--CA 1.468 0.468 0 N-CA-C 112.98 0.733 . . . . 0.0 112.98 168.89 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 2.8 t -111.9 166.41 11.24 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 124.674 1.19 . . . . 0.0 113.521 -177.414 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 71.1 mt -59.15 -34.42 72.05 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 124.359 1.064 . . . . 0.0 111.967 178.107 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 78.1 m-85 -63.97 -28.77 70.04 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 124.276 1.03 . . . . 0.0 113.476 173.671 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 55.8 mt-30 -81.17 -37.76 28.22 Favored 'General case' 0 N--CA 1.467 0.405 0 C-N-CA 123.778 0.831 . . . . 0.0 110.916 173.65 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 45.0 mt -56.02 -44.89 79.16 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 119.132 0.878 . . . . 0.0 111.086 170.524 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -60.84 -30.91 70.4 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 124.117 0.967 . . . . 0.0 112.959 177.448 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 27.2 t30 -80.64 -31.44 36.47 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 124.341 1.056 . . . . 0.0 112.832 174.608 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 19.6 m-30 -68.15 -37.17 80.76 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 123.975 0.91 . . . . 0.0 112.212 173.466 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 72.1 m . . . . . 0 N--CA 1.473 0.717 0 N-CA-C 113.602 0.964 . . . . 0.0 113.602 178.482 . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 11.0 m120 . . . . . 0 CA--C 1.542 0.645 0 CA-C-O 121.652 0.739 . . . . 0.0 112.951 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 27.7 mm-40 -145.15 164.81 30.14 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 125.373 1.469 . . . . 0.0 110.511 178.499 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 90.4 m-70 -83.59 117.21 23.0 Favored 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 107.785 -1.191 . . . . 0.0 107.785 160.832 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 94.3 mt -129.22 131.74 47.12 Favored 'General case' 0 N--CA 1.462 0.164 0 C-N-CA 124.859 1.263 . . . . 0.0 108.532 178.704 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -142.97 153.76 43.34 Favored 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 124.267 1.027 . . . . 0.0 111.517 -173.867 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 48.23 -126.69 15.55 Favored Glycine 0 N--CA 1.471 0.98 0 C-N-CA 125.578 1.561 . . . . 0.0 114.338 170.047 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 16.0 p -59.88 -38.91 83.58 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 124.579 1.152 . . . . 0.0 112.618 179.46 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 26.7 m170 -65.23 -37.87 88.63 Favored 'General case' 0 CA--C 1.544 0.718 0 O-C-N 121.076 -1.015 . . . . 0.0 111.803 177.74 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 56.6 tp -67.9 -44.23 77.44 Favored 'General case' 0 N--CA 1.466 0.37 0 C-N-CA 123.405 0.682 . . . . 0.0 111.117 172.234 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 53.5 t -59.02 -38.8 76.09 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.973 0 CA-C-N 118.836 0.744 . . . . 0.0 111.978 174.92 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -66.3 -45.71 79.44 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 123.87 0.868 . . . . 0.0 111.579 173.815 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.07 -46.37 90.92 Favored 'General case' 0 CA--C 1.543 0.681 0 CA-C-N 119.296 0.953 . . . . 0.0 111.901 176.794 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 32.5 mt -54.76 -50.28 68.82 Favored 'General case' 0 N--CA 1.466 0.333 0 C-N-CA 124.574 1.149 . . . . 0.0 111.436 173.174 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 88.4 t80 -62.36 -36.55 82.59 Favored 'General case' 0 CA--C 1.543 0.706 0 O-C-N 121.2 -0.938 . . . . 0.0 113.331 177.04 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 76.3 mt -73.01 -33.12 65.56 Favored 'General case' 0 N--CA 1.469 0.495 0 O-C-N 121.155 -0.966 . . . . 0.0 113.296 177.677 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 84.5 t -81.21 -37.1 15.49 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.93 0 C-N-CA 123.945 0.898 . . . . 0.0 111.469 176.869 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 44.0 m -124.8 6.03 8.09 Favored 'General case' 0 N--CA 1.473 0.691 0 N-CA-C 115.587 1.699 . . . . 0.0 115.587 -163.05 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . -57.53 -27.16 58.14 Favored Glycine 0 N--CA 1.479 1.533 0 N-CA-C 116.302 1.281 . . . . 0.0 116.302 -166.523 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -81.39 -21.55 38.91 Favored 'General case' 0 CA--C 1.548 0.871 0 N-CA-C 114.13 1.159 . . . . 0.0 114.13 174.709 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 75.9 mtp180 -91.52 -42.36 10.29 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 126.199 1.8 . . . . 0.0 112.23 177.961 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 97.31 136.98 9.35 Favored Glycine 0 CA--C 1.531 1.049 0 C-N-CA 125.651 1.596 . . . . 0.0 110.558 -163.155 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 46.8 p90 -105.1 165.12 11.31 Favored 'General case' 0 CA--C 1.538 0.519 0 N-CA-C 114.198 1.184 . . . . 0.0 114.198 -172.625 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 69.9 t80 . . . . . 0 CA--C 1.536 0.414 0 C-N-CA 126.391 1.876 . . . . 0.0 109.92 175.609 . . . . . . . . 0 0 . 1 . 025 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 45.3 t . . . . . 0 N--CA 1.481 1.084 0 CA-C-O 119.603 -0.237 . . . . 0.0 111.53 . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 24.6 tt0 -78.8 -44.04 24.03 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-O 118.935 -0.555 . . . . 0.0 111.308 174.599 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -58.58 -49.79 76.18 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-N 118.572 0.624 . . . . 0.0 111.455 -177.558 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 16.5 m -60.89 -22.5 64.38 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 124.183 0.993 . . . . 0.0 113.392 176.935 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 49.7 t -96.93 -50.41 4.65 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 124.586 1.155 . . . . 0.0 112.824 -173.677 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 3.1 t -78.39 -35.46 47.16 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.398 1.079 . . . . 0.0 112.054 -179.221 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 30.9 m -107.74 -161.6 0.79 Allowed 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.235 1.414 . . . . 0.0 109.183 165.146 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 26.8 pt -109.49 157.55 9.83 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.734 0 C-N-CA 124.515 1.126 . . . . 0.0 110.878 174.787 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 18.1 p -140.62 160.39 40.13 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-O 121.615 0.721 . . . . 0.0 112.387 171.835 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 4.1 m -96.08 149.36 21.69 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 124.874 1.269 . . . . 0.0 111.896 -169.414 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 55.5 mt -57.27 -33.26 67.44 Favored 'General case' 0 N--CA 1.474 0.73 0 O-C-N 121.09 -1.006 . . . . 0.0 111.833 167.893 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 80.6 t80 -63.71 -30.81 71.86 Favored 'General case' 0 CA--C 1.543 0.682 0 N-CA-C 113.46 0.911 . . . . 0.0 113.46 172.491 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 45.9 mm-40 -80.99 -34.46 32.98 Favored 'General case' 0 CA--C 1.534 0.358 0 O-C-N 121.46 -0.775 . . . . 0.0 111.05 174.099 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 38.4 mt -58.18 -37.2 74.26 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 119.602 1.092 . . . . 0.0 111.296 167.095 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.43 ' HA ' ' SG ' ' A' ' 20' ' ' CYS . 24.7 tt0 -68.97 -35.3 76.58 Favored 'General case' 0 CA--C 1.545 0.768 0 N-CA-C 112.619 0.6 . . . . 0.0 112.619 173.74 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 62.3 t30 -64.74 -22.92 67.09 Favored 'General case' 0 CA--C 1.553 1.072 0 O-C-N 121.009 -1.057 . . . . 0.0 112.257 171.988 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 16.0 m-30 -91.65 -0.16 57.55 Favored 'General case' 0 CA--C 1.551 1.008 0 C-N-CA 125.802 1.641 . . . . 0.0 113.562 177.378 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.43 ' SG ' ' HA ' ' A' ' 17' ' ' GLU . 81.6 m . . . . . 0 N--CA 1.474 0.752 0 O-C-N 121.063 -1.023 . . . . 0.0 113.639 172.572 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 61.6 m-20 . . . . . 0 N--CA 1.47 0.574 0 CA-C-O 120.63 0.252 . . . . 0.0 111.601 . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 38.3 mt-30 -143.26 158.7 43.4 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 124.445 1.098 . . . . 0.0 111.229 -179.257 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 95.8 m-70 -80.28 127.33 32.24 Favored 'General case' 0 CA--C 1.539 0.522 0 N-CA-C 108.639 -0.874 . . . . 0.0 108.639 156.623 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 98.5 mt -140.23 123.0 16.41 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 125.59 1.556 . . . . 0.0 109.242 -175.142 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 57.7 m -130.73 138.81 50.16 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 124.891 1.277 . . . . 0.0 110.727 -174.176 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 54.43 -123.67 28.78 Favored Glycine 0 N--CA 1.473 1.101 0 C-N-CA 124.86 1.219 . . . . 0.0 114.029 166.522 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 17.8 p -59.9 -35.47 74.93 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 124.35 1.06 . . . . 0.0 112.387 179.973 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 24.2 m80 -67.69 -38.27 83.44 Favored 'General case' 0 CA--C 1.541 0.607 0 O-C-N 121.25 -0.906 . . . . 0.0 111.714 177.817 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 60.1 tp -67.5 -44.92 77.32 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 123.639 0.776 . . . . 0.0 111.213 172.206 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 53.1 t -60.45 -38.54 78.25 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.131 0 C-N-CA 123.614 0.766 . . . . 0.0 111.761 177.023 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 33.2 mm-40 -68.62 -43.89 75.41 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 123.855 0.862 . . . . 0.0 111.91 173.258 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.36 -43.62 98.56 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-N 119.278 0.944 . . . . 0.0 112.253 176.746 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 44.5 mt -55.48 -54.57 42.26 Favored 'General case' 0 N--CA 1.467 0.412 0 C-N-CA 124.803 1.241 . . . . 0.0 110.84 171.771 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 81.9 t80 -55.19 -40.75 71.11 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 123.48 0.712 . . . . 0.0 112.884 177.471 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 83.0 mt -75.74 -34.38 60.3 Favored 'General case' 0 CA--C 1.534 0.358 0 N-CA-C 113.645 0.979 . . . . 0.0 113.645 -179.121 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 42.9 t -72.73 -42.35 61.98 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.922 0 CA-C-N 118.666 0.666 . . . . 0.0 110.642 174.29 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 75.5 m -83.43 -35.6 24.88 Favored 'General case' 0 N--CA 1.466 0.37 0 N-CA-C 113.539 0.941 . . . . 0.0 113.539 -173.21 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 62.54 -131.43 44.09 Favored Glycine 0 CA--C 1.532 1.094 0 C-N-CA 123.839 0.733 . . . . 0.0 111.66 -175.973 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -63.28 -18.85 64.02 Favored 'General case' 0 CA--C 1.55 0.96 0 C-N-CA 124.942 1.297 . . . . 0.0 113.512 179.452 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 85.4 mtm180 -66.17 -21.9 66.34 Favored 'General case' 0 N--CA 1.477 0.919 0 N-CA-C 113.924 1.083 . . . . 0.0 113.924 -177.567 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.73 -178.43 39.5 Favored Glycine 0 CA--C 1.534 1.236 0 C-N-CA 124.658 1.123 . . . . 0.0 112.154 -172.934 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 53.4 p90 -159.86 164.57 33.48 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 124.368 1.067 . . . . 0.0 113.421 -177.299 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 93.6 t80 . . . . . 0 CA--C 1.535 0.389 0 C-N-CA 124.776 1.23 . . . . 0.0 110.635 171.744 . . . . . . . . 0 0 . 1 . 026 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 83.5 t . . . . . 0 N--CA 1.481 1.1 0 CA-C-O 119.376 -0.345 . . . . 0.0 111.028 . . . . . . . . . 0 0 . 1 . 026 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 78.5 mm-40 -70.68 -40.8 72.73 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-N 118.465 0.575 . . . . 0.0 111.329 176.597 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 63.9 tp60 -64.77 -38.9 92.56 Favored 'General case' 0 N--CA 1.463 0.222 0 O-C-N 121.83 -0.544 . . . . 0.0 112.052 -179.252 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 88.3 m -83.03 -31.5 27.39 Favored 'General case' 0 CA--C 1.53 0.204 0 N-CA-C 114.268 1.211 . . . . 0.0 114.268 178.607 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 30.5 t -103.46 -48.47 3.97 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 113.153 0.798 . . . . 0.0 113.153 -169.369 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 34.6 m -79.33 -47.12 16.37 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 124.526 1.131 . . . . 0.0 109.536 178.699 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 71.0 m -94.74 -164.32 1.15 Allowed 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 124.625 1.17 . . . . 0.0 111.255 164.112 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 40.4 pt -109.5 149.35 12.66 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 C-N-CA 124.694 1.198 . . . . 0.0 110.885 169.254 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 17.5 p -128.33 158.42 38.27 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 123.567 0.747 . . . . 0.0 112.028 174.149 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 61.5 p -98.67 160.03 14.55 Favored 'General case' 0 N--CA 1.468 0.441 0 N-CA-C 114.003 1.112 . . . . 0.0 114.003 -179.857 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 59.7 mt -60.88 -35.46 76.7 Favored 'General case' 0 CA--C 1.54 0.573 0 O-C-N 121.646 -0.659 . . . . 0.0 111.452 172.107 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 91.6 t80 -62.57 -35.45 79.54 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 124.118 0.967 . . . . 0.0 112.896 172.641 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 84.3 mt-30 -74.16 -35.4 64.03 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 123.866 0.866 . . . . 0.0 111.884 173.349 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 56.8 mt -63.28 -39.02 93.4 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 119.599 1.091 . . . . 0.0 111.923 171.433 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -60.91 -26.73 67.67 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 124.621 1.168 . . . . 0.0 113.319 -178.989 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 26.3 t30 -57.4 -28.69 63.46 Favored 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 124.261 1.024 . . . . 0.0 113.307 175.521 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 98.2 m-85 -95.07 -2.28 50.47 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 125.146 1.378 . . . . 0.0 114.022 -174.174 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 86.3 m . . . . . 0 CA--C 1.541 0.629 0 N-CA-C 113.938 1.088 . . . . 0.0 113.938 178.701 . . . . . . . . 0 0 . 1 . 026 nuclear nobuild core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 51.4 p30 . . . . . 0 CA--C 1.541 0.634 0 N-CA-C 112.864 0.69 . . . . 0.0 112.864 . . . . . . . . . 0 0 . 1 . 026 nuclear nobuild core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 40.9 mt-30 -151.29 162.53 40.74 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 124.922 1.289 . . . . 0.0 111.722 -164.754 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 84.0 m-70 -82.67 130.16 35.08 Favored 'General case' 0 CA--C 1.541 0.633 0 N-CA-C 109.522 -0.548 . . . . 0.0 109.522 154.589 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 78.5 mt -144.07 126.88 16.24 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 126.391 1.876 . . . . 0.0 108.996 -178.5 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 62.3 m -134.74 140.68 46.12 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 124.986 1.315 . . . . 0.0 110.455 -174.754 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 51.7 -118.88 7.6 Favored Glycine 0 N--CA 1.473 1.137 0 C-N-CA 124.88 1.229 . . . . 0.0 114.022 169.147 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 19.3 m -59.48 -33.92 71.92 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 124.475 1.11 . . . . 0.0 112.688 -179.804 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 93.2 m-70 -72.67 -38.83 67.48 Favored 'General case' 0 CA--C 1.539 0.55 0 O-C-N 121.409 -0.807 . . . . 0.0 111.163 178.196 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 55.7 tp -63.81 -45.87 87.7 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 124.053 0.941 . . . . 0.0 111.056 171.827 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 21.8 t -59.59 -43.28 90.67 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.952 0 C-N-CA 124.614 1.166 . . . . 0.0 111.751 176.171 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -65.57 -46.42 79.53 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 123.175 0.59 . . . . 0.0 111.65 175.683 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.07 -44.01 98.02 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 123.533 0.733 . . . . 0.0 112.058 179.961 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 21.4 mt -54.94 -55.51 29.82 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 124.301 1.041 . . . . 0.0 111.132 173.0 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 79.9 t80 -58.15 -34.51 70.36 Favored 'General case' 0 N--CA 1.472 0.666 0 N-CA-C 113.512 0.93 . . . . 0.0 113.512 179.417 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 86.1 mt -74.79 -40.94 60.85 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 124.661 1.184 . . . . 0.0 113.559 175.062 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 38.7 t -64.49 -42.77 96.19 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.021 0 C-N-CA 123.956 0.903 . . . . 0.0 111.052 174.24 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 61.6 m -73.58 -25.7 60.48 Favored 'General case' 0 CA--C 1.538 0.518 0 N-CA-C 112.611 0.597 . . . . 0.0 112.611 179.264 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 83.77 49.29 4.89 Favored Glycine 0 N--CA 1.471 1.008 0 C-N-CA 124.648 1.118 . . . . 0.0 112.184 171.944 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 36.4 mt-10 78.06 -7.93 1.74 Allowed 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 127.997 2.519 . . . . 0.0 113.362 -177.418 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 32.2 mtp180 -66.47 162.48 20.54 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 125.238 1.415 . . . . 0.0 111.927 168.278 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . -63.63 159.42 38.59 Favored Glycine 0 CA--C 1.532 1.145 0 C-N-CA 124.154 0.883 . . . . 0.0 112.939 174.668 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 56.1 p90 -153.8 175.44 13.3 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 125.518 1.527 . . . . 0.0 111.675 -172.288 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 61.0 t80 . . . . . 0 CA--C 1.536 0.429 0 C-N-CA 124.416 1.086 . . . . 0.0 110.884 178.081 . . . . . . . . 0 0 . 1 . 027 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 25.0 t . . . . . 0 N--CA 1.492 1.659 0 N-CA-C 112.135 0.42 . . . . 0.0 112.135 . . . . . . . . . 0 0 . 1 . 027 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -68.74 -16.52 63.83 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.536 1.134 . . . . 0.0 113.391 -179.867 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 36.7 tt0 -91.82 -57.11 2.85 Favored 'General case' 0 C--O 1.225 -0.207 0 C-N-CA 123.633 0.773 . . . . 0.0 109.474 162.73 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 64.0 m -63.28 -29.89 71.13 Favored 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 114.779 1.4 . . . . 0.0 114.779 -165.412 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 26.7 t -96.18 -38.87 9.96 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 123.872 0.869 . . . . 0.0 112.458 -175.513 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 27.3 m -83.08 -39.21 21.45 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 125.536 1.534 . . . . 0.0 111.766 -179.425 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 22.6 t -114.29 -135.7 0.36 Allowed 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 126.953 2.101 . . . . 0.0 108.768 168.291 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 16.0 pt -133.2 151.18 33.45 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.727 0 C-N-CA 125.901 1.681 . . . . 0.0 111.964 -178.507 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 66.9 m -125.41 158.32 34.64 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 125.392 1.477 . . . . 0.0 111.096 170.38 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 10.5 t -109.52 158.36 18.07 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 124.248 1.019 . . . . 0.0 112.49 175.566 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 45.0 mt -58.87 -35.26 72.69 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 125.297 1.439 . . . . 0.0 111.735 178.942 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 76.2 t80 -62.46 -29.9 70.86 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 124.33 1.052 . . . . 0.0 113.188 173.34 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 94.9 mt-30 -81.63 -33.68 31.3 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 124.313 1.045 . . . . 0.0 110.529 176.586 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 44.1 mt -65.56 -37.98 88.24 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 123.546 0.738 . . . . 0.0 112.129 171.76 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 29.1 tt0 -60.04 -24.32 64.43 Favored 'General case' 0 CA--C 1.544 0.73 0 N-CA-C 113.62 0.971 . . . . 0.0 113.62 -178.901 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 17.3 t-20 -58.47 -23.35 57.57 Favored 'General case' 0 CA--C 1.549 0.939 0 N-CA-C 113.637 0.977 . . . . 0.0 113.637 174.774 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 96.5 m-85 -97.92 0.98 47.52 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.479 1.511 . . . . 0.0 114.195 -177.601 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 60.3 m . . . . . 0 N--CA 1.473 0.722 0 N-CA-C 113.226 0.824 . . . . 0.0 113.226 173.29 . . . . . . . . 0 0 . 1 . 027 nuclear nobuild core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 10.6 m120 . . . . . 0 CA--C 1.539 0.541 0 CA-C-O 121.059 0.457 . . . . 0.0 112.063 . . . . . . . . . 0 0 . 1 . 027 nuclear nobuild core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 38.1 mt-30 -144.87 157.34 44.19 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.16 1.384 . . . . 0.0 110.985 -177.985 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 99.2 m-70 -79.57 127.1 31.74 Favored 'General case' 0 CA--C 1.538 0.508 0 N-CA-C 108.61 -0.885 . . . . 0.0 108.61 160.774 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 98.8 mt -143.21 120.76 11.75 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 125.489 1.516 . . . . 0.0 109.914 -173.165 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 58.1 m -127.54 136.94 52.41 Favored 'General case' 0 N--CA 1.467 0.41 0 C-N-CA 125.066 1.346 . . . . 0.0 110.703 -176.878 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 48.43 -116.57 3.21 Favored Glycine 0 CA--C 1.531 1.046 0 C-N-CA 125.208 1.385 . . . . 0.0 114.275 167.556 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 21.1 m -59.31 -34.6 72.52 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 124.39 1.076 . . . . 0.0 112.651 -178.986 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 94.8 m-70 -72.22 -36.74 69.23 Favored 'General case' 0 CA--C 1.542 0.67 0 O-C-N 121.268 -0.895 . . . . 0.0 111.404 177.891 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 58.8 tp -65.77 -45.51 82.24 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 123.69 0.796 . . . . 0.0 110.99 171.963 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 53.6 t -62.65 -37.15 78.25 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.042 0 C-N-CA 124.381 1.073 . . . . 0.0 111.76 176.916 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -66.19 -47.08 75.1 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 123.627 0.771 . . . . 0.0 111.336 172.593 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.57 -43.53 97.18 Favored 'General case' 0 CA--C 1.539 0.539 0 O-C-N 121.521 -0.737 . . . . 0.0 111.996 177.792 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 18.3 mt -53.16 -56.16 18.57 Favored 'General case' 0 N--CA 1.468 0.448 0 C-N-CA 124.673 1.189 . . . . 0.0 111.175 172.037 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 71.5 t80 -55.82 -41.99 75.03 Favored 'General case' 0 CA--C 1.542 0.646 0 N-CA-C 113.151 0.797 . . . . 0.0 113.151 177.41 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 87.6 mt -72.36 -34.72 68.18 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 124.281 1.032 . . . . 0.0 113.134 -179.461 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 28.6 t -66.79 -43.92 89.54 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.909 0 C-N-CA 123.804 0.842 . . . . 0.0 110.624 172.464 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 82.6 m -72.43 -35.98 68.46 Favored 'General case' 0 CA--C 1.539 0.557 0 N-CA-C 112.206 0.447 . . . . 0.0 112.206 -177.85 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 68.51 -109.51 2.94 Favored Glycine 0 CA--C 1.528 0.885 0 C-N-CA 125.136 1.35 . . . . 0.0 112.112 170.512 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -68.85 -27.75 66.1 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 124.362 1.065 . . . . 0.0 112.199 173.575 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 82.6 mtm180 -74.16 154.59 39.03 Favored 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 124.968 1.307 . . . . 0.0 111.019 175.323 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . -80.62 -173.1 46.39 Favored Glycine 0 CA--C 1.527 0.801 0 C-N-CA 123.985 0.802 . . . . 0.0 111.316 168.721 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 15.3 p90 -162.0 165.43 27.39 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 124.7 1.2 . . . . 0.0 112.213 176.161 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 88.2 t80 . . . . . 0 CA--C 1.535 0.378 0 C-N-CA 123.544 0.738 . . . . 0.0 111.696 167.074 . . . . . . . . 0 0 . 1 . 028 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 76.2 t . . . . . 0 N--CA 1.48 1.031 0 N-CA-C 113.406 0.891 . . . . 0.0 113.406 . . . . . . . . . 0 0 . 1 . 028 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 67.3 mm-40 -69.21 -42.58 75.56 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 118.693 0.679 . . . . 0.0 111.389 177.517 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 17.0 tm0? -61.72 -48.45 80.67 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 123.895 0.878 . . . . 0.0 111.346 -174.49 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 5.0 t -75.66 -12.45 60.2 Favored 'General case' 0 N--CA 1.472 0.646 0 N-CA-C 113.642 0.979 . . . . 0.0 113.642 -179.866 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 25.2 t -87.25 -43.47 12.17 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 124.88 1.272 . . . . 0.0 112.519 177.119 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 74.2 p -86.37 -43.26 13.0 Favored 'General case' 0 N--CA 1.478 0.966 0 C-N-CA 124.408 1.083 . . . . 0.0 112.268 177.952 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 17.5 t -104.52 -149.6 0.41 Allowed 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 125.807 1.643 . . . . 0.0 109.75 169.589 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 27.6 pt -125.94 157.03 36.08 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.728 0 C-N-CA 125.577 1.551 . . . . 0.0 112.286 -178.081 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 17.3 p -143.1 159.66 41.86 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 124.307 1.043 . . . . 0.0 112.157 170.779 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 8.5 t -105.76 162.81 13.22 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 124.885 1.274 . . . . 0.0 112.799 -177.646 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 53.0 mt -58.64 -35.59 72.75 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 124.773 1.229 . . . . 0.0 111.882 179.646 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 69.7 t80 -64.17 -28.58 69.85 Favored 'General case' 0 CA--C 1.547 0.829 0 N-CA-C 113.722 1.008 . . . . 0.0 113.722 173.598 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 75.2 mt-30 -83.32 -33.26 25.96 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 124.269 1.028 . . . . 0.0 110.997 175.495 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 83.2 mt -63.32 -38.14 90.01 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-N 118.576 0.626 . . . . 0.0 111.907 168.858 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 28.8 tt0 -62.23 -23.77 66.85 Favored 'General case' 0 CA--C 1.542 0.651 0 N-CA-C 113.566 0.951 . . . . 0.0 113.566 -179.691 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 29.7 t30 -57.25 -25.92 59.92 Favored 'General case' 0 CA--C 1.549 0.918 0 O-C-N 120.969 -1.082 . . . . 0.0 113.309 173.425 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 97.4 m-85 -96.73 0.84 50.18 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 125.411 1.484 . . . . 0.0 113.735 -175.744 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 61.2 m . . . . . 0 N--CA 1.474 0.727 0 CA-C-N 119.252 0.933 . . . . 0.0 113.143 175.69 . . . . . . . . 0 0 . 1 . 028 nuclear nobuild core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 39.4 p30 . . . . . 0 CA--C 1.541 0.612 0 N-CA-C 113.401 0.889 . . . . 0.0 113.401 . . . . . . . . . 0 0 . 1 . 028 nuclear nobuild core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 39.0 mt-30 -147.48 160.35 42.69 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 125.234 1.413 . . . . 0.0 110.947 -170.22 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 99.3 m-70 -82.18 129.11 34.75 Favored 'General case' 0 CA--C 1.539 0.537 0 N-CA-C 108.156 -1.053 . . . . 0.0 108.156 159.51 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 87.0 mt -145.17 134.18 22.59 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 125.025 1.33 . . . . 0.0 109.211 -176.972 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 4.1 t -151.97 153.82 34.83 Favored 'General case' 0 C--O 1.235 0.342 0 C-N-CA 123.02 0.528 . . . . 0.0 111.786 -174.867 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 49.62 -128.66 24.75 Favored Glycine 0 CA--C 1.53 0.97 0 C-N-CA 125.465 1.507 . . . . 0.0 113.799 175.743 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 18.6 m -58.78 -33.45 70.32 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 124.53 1.132 . . . . 0.0 112.824 -179.136 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 80.8 m-70 -76.78 -26.74 54.81 Favored 'General case' 0 CA--C 1.54 0.578 0 O-C-N 121.073 -1.017 . . . . 0.0 112.875 177.857 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 42.6 tp -72.58 -42.26 64.79 Favored 'General case' 0 N--CA 1.468 0.457 0 O-C-N 121.225 -0.922 . . . . 0.0 111.07 168.28 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 55.8 t -59.28 -41.7 84.88 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.003 0 C-N-CA 123.794 0.838 . . . . 0.0 111.378 172.714 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 43.7 tt0 -62.47 -47.35 84.39 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 125.633 1.573 . . . . 0.0 111.823 173.44 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.25 -44.95 95.38 Favored 'General case' 0 CA--C 1.539 0.541 0 O-C-N 121.927 -0.483 . . . . 0.0 112.245 178.276 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 39.6 mt -55.92 -51.48 67.47 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 124.204 1.002 . . . . 0.0 111.092 173.265 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 68.1 t80 -55.32 -43.66 75.1 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 123.619 0.768 . . . . 0.0 113.058 175.262 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 89.8 mt -74.75 -32.86 62.21 Favored 'General case' 0 N--CA 1.471 0.619 0 N-CA-C 113.595 0.961 . . . . 0.0 113.595 -178.478 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 30.4 t -70.91 -43.58 76.67 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 C-N-CA 123.998 0.919 . . . . 0.0 110.466 173.655 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 76.1 m -81.62 -36.55 28.79 Favored 'General case' 0 CA--C 1.533 0.302 0 N-CA-C 113.533 0.938 . . . . 0.0 113.533 -173.855 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . -50.84 131.89 32.04 Favored Glycine 0 CA--C 1.538 1.521 0 C-N-CA 124.324 0.964 . . . . 0.0 113.37 -168.415 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -80.14 -3.59 49.46 Favored 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 128.468 2.707 . . . . 0.0 115.496 10.908 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 75.3 mtm180 -64.2 155.32 32.17 Favored 'General case' 0 N--CA 1.475 0.798 0 CA-C-N 119.567 1.076 . . . . 0.0 110.708 174.628 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . -78.69 -174.08 43.96 Favored Glycine 0 N--CA 1.471 0.972 0 C-N-CA 124.147 0.88 . . . . 0.0 111.519 169.825 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 45.6 p90 -157.02 155.69 31.64 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 123.882 0.873 . . . . 0.0 112.927 -179.075 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 68.3 t80 . . . . . 0 CA--C 1.538 0.491 0 C-N-CA 125.628 1.571 . . . . 0.0 111.205 173.068 . . . . . . . . 0 0 . 1 . 029 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 47.2 t . . . . . 0 N--CA 1.481 1.12 0 N-CA-C 111.343 0.127 . . . . 0.0 111.343 . . . . . . . . . 0 0 . 1 . 029 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -70.75 -54.94 9.82 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 124.114 0.965 . . . . 0.0 110.099 169.956 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 6.7 tt0 -56.91 -49.08 76.68 Favored 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 123.999 0.919 . . . . 0.0 112.117 -174.121 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 63.7 m -62.33 -28.24 69.61 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 114.006 1.113 . . . . 0.0 114.006 -179.094 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 18.6 t -102.1 -36.39 8.57 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 123.806 0.842 . . . . 0.0 112.763 -171.736 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 92.4 m -82.78 -29.51 29.57 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 126.228 1.811 . . . . 0.0 111.713 175.524 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 9.9 t -135.98 -156.26 0.7 Allowed 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 125.616 1.566 . . . . 0.0 110.697 177.124 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 28.1 mm -93.5 147.35 5.55 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.74 0 C-N-CA 125.408 1.483 . . . . 0.0 109.814 172.047 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 19.1 p -132.73 159.01 40.92 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 123.514 0.726 . . . . 0.0 112.486 163.665 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 53.3 p -100.08 162.72 12.8 Favored 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 113.788 1.033 . . . . 0.0 113.788 -175.22 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 78.4 mt -64.22 -33.54 76.03 Favored 'General case' 0 CA--C 1.536 0.421 0 O-C-N 121.344 -0.848 . . . . 0.0 111.5 172.126 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 87.2 t80 -66.78 -34.01 76.89 Favored 'General case' 0 CA--C 1.544 0.713 0 O-C-N 121.459 -0.776 . . . . 0.0 112.845 173.058 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 78.3 mt-30 -71.38 -37.04 71.61 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 123.556 0.742 . . . . 0.0 111.312 173.36 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 95.6 mt -60.98 -42.68 98.82 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-N 119.144 0.884 . . . . 0.0 111.245 167.346 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 56.6 tt0 -64.75 -31.13 72.22 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 123.353 0.661 . . . . 0.0 112.722 178.495 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 18.6 t-20 -64.2 -22.49 66.96 Favored 'General case' 0 CA--C 1.551 0.987 0 O-C-N 121.044 -1.035 . . . . 0.0 112.846 173.129 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 23.5 m-85 -95.73 0.47 52.52 Favored 'General case' 0 CA--C 1.55 0.958 0 C-N-CA 125.686 1.595 . . . . 0.0 113.338 171.661 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 76.4 m . . . . . 0 CA--C 1.542 0.639 0 O-C-N 120.649 -1.282 . . . . 0.0 112.133 165.772 . . . . . . . . 0 0 . 1 . 029 nuclear nobuild core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . 0.316 6.2 p30 . . . . . 0 CA--C 1.543 0.696 0 N-CA-C 114.162 1.171 . . . . 0.0 114.162 . . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 78.1 mt-30 -156.09 168.42 27.33 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 123.734 0.814 . . . . 0.0 113.149 -162.939 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 93.5 m-70 -84.52 134.21 34.43 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 123.628 0.771 . . . . 0.0 109.53 158.173 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 75.4 mt -148.34 131.91 16.78 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 126.277 1.831 . . . . 0.0 109.895 -176.861 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 85.5 m -135.97 144.52 45.44 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 124.992 1.317 . . . . 0.0 110.911 -177.596 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 52.46 -125.21 28.35 Favored Glycine 0 N--CA 1.474 1.199 0 C-N-CA 125.464 1.507 . . . . 0.0 114.248 165.414 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 27.5 m -58.21 -38.46 76.82 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 123.671 0.788 . . . . 0.0 112.296 -179.196 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 17.5 m-70 -72.33 -32.17 66.29 Favored 'General case' 0 CA--C 1.54 0.565 0 O-C-N 121.142 -0.974 . . . . 0.0 112.237 179.253 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 59.2 tp -65.43 -43.6 89.96 Favored 'General case' 0 CA--C 1.534 0.346 0 O-C-N 121.629 -0.669 . . . . 0.0 111.112 168.708 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 55.4 t -62.3 -40.49 88.03 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.942 0 C-N-CA 123.696 0.798 . . . . 0.0 111.661 175.684 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -62.93 -48.14 80.2 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 124.218 1.007 . . . . 0.0 111.613 173.368 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.63 -44.72 96.02 Favored 'General case' 0 CA--C 1.538 0.497 0 O-C-N 121.759 -0.588 . . . . 0.0 112.224 178.709 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 60.7 tp -57.07 -53.37 58.89 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 123.995 0.918 . . . . 0.0 110.571 174.494 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 9.9 m-30 -55.72 -38.62 69.98 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 123.328 0.651 . . . . 0.0 112.514 178.038 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 76.5 mt -71.65 -35.44 70.36 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 124.42 1.088 . . . . 0.0 113.137 177.758 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 55.3 t -70.44 -40.58 77.71 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.055 0 C-N-CA 123.754 0.822 . . . . 0.0 110.972 173.324 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 57.7 m -75.64 -35.52 60.42 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 113.075 0.769 . . . . 0.0 113.075 -178.747 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 59.02 -129.63 49.89 Favored Glycine 0 CA--C 1.532 1.107 0 N-CA-C 111.544 -0.622 . . . . 0.0 111.544 -174.942 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -75.66 -9.92 59.0 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 124.528 1.131 . . . . 0.0 114.035 179.566 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 60.1 mtp180 -65.95 -35.51 80.79 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 123.957 0.903 . . . . 0.0 113.251 -176.009 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 95.46 158.79 32.72 Favored Glycine 0 CA--C 1.532 1.152 0 C-N-CA 125.366 1.46 . . . . 0.0 113.069 -169.714 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 33.0 p90 -122.77 168.12 12.63 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 125.848 1.659 . . . . 0.0 113.117 -173.192 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 80.9 t80 . . . . . 0 CA--C 1.54 0.59 0 C-N-CA 125.823 1.649 . . . . 0.0 109.239 161.057 . . . . . . . . 0 0 . 1 . 030 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 11.0 t . . . . . 0 N--CA 1.479 0.996 0 CA-C-O 120.301 0.096 . . . . 0.0 111.08 . . . . . . . . . 0 0 . 1 . 030 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 29.7 mm-40 -79.15 8.88 5.11 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.963 1.305 . . . . 0.0 112.535 178.402 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -115.71 -53.63 2.57 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 124.729 1.212 . . . . 0.0 109.993 162.314 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 11.7 m -65.85 -28.48 69.0 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 115.392 1.627 . . . . 0.0 115.392 -173.954 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 42.6 t -92.86 -45.41 8.0 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-N 118.667 0.667 . . . . 0.0 111.927 -178.12 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 23.1 p -68.76 -35.98 77.75 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 126.806 2.042 . . . . 0.0 112.601 -179.308 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 65.0 m -132.76 -171.43 2.66 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 126.42 1.888 . . . . 0.0 110.775 179.064 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 30.3 mm -75.88 142.27 14.68 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.793 0 O-C-N 120.565 -1.335 . . . . 0.0 110.767 172.341 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 14.1 p -134.15 160.58 37.39 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 123.547 0.739 . . . . 0.0 112.461 158.758 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 37.4 t -101.99 159.79 15.06 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 124.889 1.276 . . . . 0.0 112.523 -178.225 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 40.2 mt -63.35 -30.41 71.55 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 123.594 0.758 . . . . 0.0 111.518 170.685 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 26.6 m-85 -65.6 -28.74 69.35 Favored 'General case' 0 CA--C 1.544 0.714 0 N-CA-C 113.304 0.853 . . . . 0.0 113.304 171.881 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 79.0 mt-30 -78.78 -38.36 38.67 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-O 118.558 -0.734 . . . . 0.0 110.593 172.598 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 42.6 mt -58.01 -37.96 75.27 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 119.099 0.863 . . . . 0.0 111.549 168.708 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 25.4 tt0 -66.37 -31.99 73.1 Favored 'General case' 0 CA--C 1.546 0.818 0 CA-C-N 118.688 0.676 . . . . 0.0 112.65 175.891 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 32.8 t30 -68.2 -23.97 64.89 Favored 'General case' 0 CA--C 1.548 0.892 0 O-C-N 121.043 -1.035 . . . . 0.0 112.685 171.947 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 10.5 m-30 -86.7 -5.7 59.05 Favored 'General case' 0 CA--C 1.549 0.917 0 C-N-CA 125.326 1.45 . . . . 0.0 113.545 177.455 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 58.2 m . . . . . 0 N--CA 1.472 0.643 0 C-N-CA 123.562 0.745 . . . . 0.0 112.342 169.614 . . . . . . . . 0 0 . 1 . 030 nuclear nobuild core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 4.1 p30 . . . . . 0 CA--C 1.534 0.349 0 CA-C-O 120.823 0.344 . . . . 0.0 110.406 . . . . . . . . . 0 0 . 1 . 030 nuclear nobuild core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 36.2 mt-30 -153.37 166.17 33.48 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 123.821 0.849 . . . . 0.0 112.36 -159.264 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 51.3 m-70 -81.8 132.3 35.28 Favored 'General case' 0 CA--C 1.542 0.664 0 N-CA-C 108.519 -0.919 . . . . 0.0 108.519 156.298 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 72.5 mt -140.73 126.83 19.56 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 125.698 1.599 . . . . 0.0 109.062 -178.263 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 68.7 m -131.14 143.95 51.02 Favored 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 125.053 1.341 . . . . 0.0 110.986 -173.77 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 56.47 -128.42 46.32 Favored Glycine 0 CA--C 1.528 0.866 0 C-N-CA 124.807 1.194 . . . . 0.0 113.927 166.433 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 23.5 p -61.5 -31.79 71.8 Favored 'General case' 0 N--CA 1.467 0.401 0 C-N-CA 124.482 1.113 . . . . 0.0 112.864 179.742 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 26.5 m80 -69.27 -39.99 78.05 Favored 'General case' 0 CA--C 1.54 0.565 0 O-C-N 121.042 -1.037 . . . . 0.0 111.395 175.792 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 50.5 tp -65.13 -45.28 85.71 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 123.379 0.671 . . . . 0.0 111.226 171.917 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 65.8 t -59.55 -43.02 89.93 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.008 0 C-N-CA 123.265 0.626 . . . . 0.0 111.656 176.381 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -65.01 -47.78 76.24 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 123.776 0.83 . . . . 0.0 111.529 177.214 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.92 -46.78 89.32 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 123.022 0.529 . . . . 0.0 111.653 178.632 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 43.8 tp -59.39 -49.99 75.67 Favored 'General case' 0 CA--C 1.533 0.327 0 C-N-CA 124.783 1.233 . . . . 0.0 111.229 176.981 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 63.2 t80 -55.43 -42.56 74.35 Favored 'General case' 0 CA--C 1.54 0.569 0 N-CA-C 113.122 0.786 . . . . 0.0 113.122 174.158 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 88.0 mt -73.88 -31.52 63.18 Favored 'General case' 0 N--CA 1.469 0.517 0 N-CA-C 113.104 0.779 . . . . 0.0 113.104 -179.324 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 41.1 t -68.65 -45.8 80.86 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.763 0 C-N-CA 123.538 0.735 . . . . 0.0 110.618 171.126 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 76.0 m -76.83 -35.15 57.75 Favored 'General case' 0 N--CA 1.469 0.498 0 N-CA-C 113.232 0.827 . . . . 0.0 113.232 -175.207 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 62.62 -130.82 43.53 Favored Glycine 0 CA--C 1.53 1.019 0 C-N-CA 124.284 0.945 . . . . 0.0 111.182 -175.762 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -64.38 -19.75 65.69 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 124.913 1.285 . . . . 0.0 113.57 179.182 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 83.7 mtm180 -64.2 -31.77 73.1 Favored 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 113.661 0.986 . . . . 0.0 113.661 -176.073 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 75.19 178.87 42.9 Favored Glycine 0 CA--C 1.535 1.284 0 C-N-CA 124.412 1.006 . . . . 0.0 112.852 -172.06 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 51.4 p90 -154.78 166.51 33.24 Favored 'General case' 0 CA--C 1.539 0.554 0 N-CA-C 114.179 1.177 . . . . 0.0 114.179 -170.626 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 83.3 t80 . . . . . 0 CA--C 1.54 0.563 0 C-N-CA 125.826 1.65 . . . . 0.0 110.149 167.06 . . . . . . . . 0 0 . 1 . 031 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 21.5 t . . . . . 0 N--CA 1.484 1.239 0 N-CA-C 112.94 0.718 . . . . 0.0 112.94 . . . . . . . . . 0 0 . 1 . 031 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -85.65 -48.26 9.04 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 125.157 1.383 . . . . 0.0 111.405 176.529 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 62.9 tt0 -69.7 -43.68 71.95 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 124.582 1.153 . . . . 0.0 112.193 -172.436 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 74.0 m -74.15 -15.68 61.02 Favored 'General case' 0 N--CA 1.464 0.256 0 N-CA-C 113.595 0.961 . . . . 0.0 113.595 -179.763 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 44.6 t -85.22 -52.62 5.79 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 125.519 1.528 . . . . 0.0 111.783 172.283 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 37.4 p -74.14 -44.32 54.12 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 124.693 1.197 . . . . 0.0 112.476 -176.525 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 50.9 m -101.54 -161.25 0.84 Allowed 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 125.415 1.486 . . . . 0.0 109.737 164.596 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 27.3 pt -112.31 151.38 14.3 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.708 0 O-C-N 120.801 -1.187 . . . . 0.0 111.311 175.309 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 69.6 m -131.1 161.25 32.48 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 124.741 1.216 . . . . 0.0 111.83 172.841 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 47.1 p -97.77 165.19 12.07 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 124.548 1.139 . . . . 0.0 113.385 176.555 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 58.0 mt -63.81 -33.13 74.98 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 123.571 0.748 . . . . 0.0 111.988 171.492 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 88.5 t80 -67.35 -33.66 75.69 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 123.663 0.785 . . . . 0.0 112.891 173.644 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 92.2 mt-30 -73.09 -33.81 65.82 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 123.464 0.705 . . . . 0.0 111.751 173.553 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 90.9 mt -64.94 -39.59 93.73 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 118.766 0.712 . . . . 0.0 111.701 166.555 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 29.8 tt0 -64.2 -30.64 71.69 Favored 'General case' 0 CA--C 1.543 0.698 0 N-CA-C 112.822 0.675 . . . . 0.0 112.822 179.748 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 18.4 t-20 -60.35 -21.62 62.3 Favored 'General case' 0 CA--C 1.551 1.014 0 O-C-N 121.177 -0.952 . . . . 0.0 113.362 172.794 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 27.6 m-85 -99.89 4.97 45.37 Favored 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 126.301 1.84 . . . . 0.0 113.89 177.128 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 74.7 m . . . . . 0 N--CA 1.473 0.682 0 O-C-N 120.65 -1.281 . . . . 0.0 111.877 167.303 . . . . . . . . 0 0 . 1 . 031 nuclear nobuild core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 4.6 m-80 . . . . . 0 CA--C 1.541 0.605 0 CA-C-O 120.66 0.267 . . . . 0.0 111.312 . . . . . . . . . 0 0 . 1 . 031 nuclear nobuild core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 41.9 mt-30 -146.42 157.49 43.77 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 124.549 1.14 . . . . 0.0 111.423 -174.74 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 81.8 m-70 -79.3 125.76 29.91 Favored 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 108.173 -1.047 . . . . 0.0 108.173 157.513 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 93.2 mt -137.93 121.51 17.33 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 125.187 1.395 . . . . 0.0 109.612 -176.086 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 59.0 m -128.48 138.58 52.35 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 125.136 1.375 . . . . 0.0 110.633 -174.402 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 52.64 -121.59 15.69 Favored Glycine 0 N--CA 1.473 1.13 0 C-N-CA 124.773 1.178 . . . . 0.0 113.484 167.369 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 31.7 p -61.96 -31.73 72.1 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 124.799 1.24 . . . . 0.0 113.293 -179.789 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 93.0 m-70 -69.75 -37.53 76.46 Favored 'General case' 0 CA--C 1.54 0.591 0 O-C-N 120.896 -1.128 . . . . 0.0 111.436 174.748 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 6.9 tt -68.0 -43.44 78.88 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-O 118.581 -0.724 . . . . 0.0 110.98 172.035 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 53.2 t -55.86 -45.56 79.8 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.004 0 CA-C-N 118.985 0.811 . . . . 0.0 111.253 173.647 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 7.1 tp10 -63.21 -46.96 84.56 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 123.573 0.749 . . . . 0.0 111.281 178.002 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.64 -48.14 80.67 Favored 'General case' 0 CA--C 1.537 0.481 0 O-C-N 121.609 -0.682 . . . . 0.0 111.808 178.881 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 44.1 tp -60.2 -46.62 89.09 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 125.356 1.462 . . . . 0.0 111.124 178.726 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 67.5 t80 -57.69 -42.67 84.14 Favored 'General case' 0 CA--C 1.539 0.522 0 N-CA-C 113.012 0.745 . . . . 0.0 113.012 173.481 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 83.6 mt -74.45 -32.43 62.6 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 123.771 0.828 . . . . 0.0 112.784 -179.741 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 25.8 t -66.29 -46.91 85.96 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.884 0 C-N-CA 124.268 1.027 . . . . 0.0 110.456 171.471 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 75.8 m -80.44 -32.55 37.26 Favored 'General case' 0 N--CA 1.467 0.398 0 N-CA-C 113.628 0.973 . . . . 0.0 113.628 -174.345 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 64.3 -134.13 39.29 Favored Glycine 0 CA--C 1.529 0.914 0 C-N-CA 124.167 0.889 . . . . 0.0 111.454 -176.397 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -68.84 -12.08 61.16 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 124.497 1.119 . . . . 0.0 113.956 179.448 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 86.5 mtm180 -65.25 -32.27 73.86 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 124.162 0.985 . . . . 0.0 113.058 179.802 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 79.26 -179.98 52.51 Favored Glycine 0 CA--C 1.533 1.16 0 C-N-CA 124.517 1.056 . . . . 0.0 112.626 -171.329 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 48.3 p90 -151.73 161.45 42.65 Favored 'General case' 0 N--CA 1.468 0.449 0 N-CA-C 114.057 1.132 . . . . 0.0 114.057 -174.645 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 82.7 t80 . . . . . 0 CA--C 1.536 0.438 0 C-N-CA 125.807 1.643 . . . . 0.0 109.216 167.627 . . . . . . . . 0 0 . 1 . 032 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 37.9 t . . . . . 0 N--CA 1.477 0.898 0 N-CA-C 111.819 0.303 . . . . 0.0 111.819 . . . . . . . . . 0 0 . 1 . 032 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -77.68 -57.82 3.6 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-N 118.722 0.692 . . . . 0.0 110.201 168.318 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 62.5 tp60 -55.72 -49.83 71.98 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 124.786 1.235 . . . . 0.0 112.76 -174.662 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 89.3 m -62.21 -26.01 68.12 Favored 'General case' 0 N--CA 1.466 0.348 0 C-N-CA 124.644 1.178 . . . . 0.0 113.711 179.295 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 14.0 t -98.4 -39.73 8.64 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 124.278 1.031 . . . . 0.0 112.257 -171.902 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 1.7 t -83.36 -27.61 29.57 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 125.052 1.341 . . . . 0.0 112.828 178.315 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 21.1 t -140.82 -153.23 0.45 Allowed 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 126.277 1.831 . . . . 0.0 108.828 176.583 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 43.6 pt -101.09 156.24 4.4 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.401 0 C-N-CA 123.889 0.876 . . . . 0.0 111.608 175.329 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 18.1 p -140.17 165.95 26.0 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 124.252 1.021 . . . . 0.0 111.898 173.567 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 88.3 p -104.17 155.72 18.48 Favored 'General case' 0 C--O 1.236 0.383 0 C-N-CA 124.291 1.036 . . . . 0.0 112.481 -175.112 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 57.2 mt -59.02 -29.02 66.95 Favored 'General case' 0 CA--C 1.533 0.293 0 O-C-N 121.294 -0.878 . . . . 0.0 112.058 170.557 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 84.4 t80 -67.2 -29.77 69.53 Favored 'General case' 0 CA--C 1.542 0.653 0 N-CA-C 113.648 0.981 . . . . 0.0 113.648 171.648 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 -78.98 -33.0 45.52 Favored 'General case' 0 N--CA 1.468 0.464 0 O-C-N 121.43 -0.794 . . . . 0.0 110.637 174.333 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 10.8 mp -60.89 -44.46 97.08 Favored 'General case' 0 CA--C 1.542 0.658 0 CA-C-N 118.124 0.42 . . . . 0.0 111.076 164.891 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 31.9 tt0 -63.64 -37.17 86.31 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 123.969 0.908 . . . . 0.0 112.492 179.266 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 21.3 t-20 -61.27 -22.85 65.23 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 123.933 0.893 . . . . 0.0 112.955 173.904 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -94.82 -0.94 53.69 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 125.562 1.545 . . . . 0.0 114.01 176.823 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 38.3 m . . . . . 0 N--CA 1.471 0.597 0 O-C-N 120.657 -1.277 . . . . 0.0 110.731 163.447 . . . . . . . . 0 0 . 1 . 032 nuclear nobuild core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 39.9 m-20 . . . . . 0 CA--C 1.543 0.686 0 CA-C-O 120.821 0.343 . . . . 0.0 111.003 . . . . . . . . . 0 0 . 1 . 032 nuclear nobuild core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 45.0 mt-30 -143.89 159.81 41.9 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 123.723 0.809 . . . . 0.0 112.049 -172.254 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 96.4 m-70 -78.3 133.4 37.64 Favored 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 108.936 -0.765 . . . . 0.0 108.936 155.02 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 93.6 mt -150.53 129.91 12.92 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 125.413 1.485 . . . . 0.0 108.259 -174.6 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 4.1 t -156.82 151.82 26.1 Favored 'General case' 0 N--CA 1.469 0.52 0 O-C-N 121.155 -0.966 . . . . 0.0 112.246 -178.677 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 56.94 -132.16 52.3 Favored Glycine 0 CA--C 1.531 1.033 0 C-N-CA 124.708 1.147 . . . . 0.0 112.698 -179.241 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 25.4 m -61.58 -29.32 69.95 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 124.27 1.028 . . . . 0.0 112.146 -177.615 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 14.9 m80 -68.71 -42.4 77.75 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 124.311 1.044 . . . . 0.0 111.008 178.398 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 51.2 tp -68.7 -44.15 74.56 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-O 118.458 -0.782 . . . . 0.0 110.663 172.806 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 53.7 t -58.57 -40.74 79.94 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.895 0 CA-C-N 119.042 0.837 . . . . 0.0 111.72 177.176 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -66.57 -48.58 69.17 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 123.614 0.766 . . . . 0.0 111.459 175.536 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.51 -44.21 97.47 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-O 121.318 0.58 . . . . 0.0 111.809 179.564 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 40.6 tp -60.95 -46.34 91.11 Favored 'General case' 0 C--N 1.333 -0.124 0 C-N-CA 124.905 1.282 . . . . 0.0 111.058 175.9 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 50.7 t80 -64.59 -26.17 68.29 Favored 'General case' 0 CA--C 1.543 0.691 0 N-CA-C 113.69 0.996 . . . . 0.0 113.69 173.814 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 73.7 mt -75.6 -32.44 60.31 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-N 119.71 1.141 . . . . 0.0 113.087 172.341 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 92.6 t -76.85 -38.9 29.91 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.252 0 C-N-CA 124.163 0.985 . . . . 0.0 111.311 173.237 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 63.5 m -105.58 14.68 28.15 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 126.044 1.738 . . . . 0.0 114.158 -172.566 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . -56.98 -36.71 75.0 Favored Glycine 0 N--CA 1.477 1.413 0 CA-C-N 119.275 0.943 . . . . 0.0 114.958 -168.686 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 4.4 mp0 -77.54 -11.75 59.89 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 124.917 1.287 . . . . 0.0 113.494 175.816 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 24.2 mmm180 -111.45 -53.03 2.74 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 126.225 1.81 . . . . 0.0 113.415 -169.467 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 92.18 162.61 37.44 Favored Glycine 0 CA--C 1.536 1.358 0 C-N-CA 124.706 1.146 . . . . 0.0 111.317 -153.641 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 49.5 p90 -142.02 156.58 45.43 Favored 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 114.403 1.26 . . . . 0.0 114.403 -170.94 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 57.3 t80 . . . . . 0 CA--C 1.542 0.636 0 C-N-CA 127.393 2.277 . . . . 0.0 110.008 165.098 . . . . . . . . 0 0 . 1 . 033 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 70.6 t . . . . . 0 N--CA 1.485 1.281 0 N-CA-C 112.166 0.432 . . . . 0.0 112.166 . . . . . . . . . 0 0 . 1 . 033 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 -79.64 -64.52 1.17 Allowed 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 123.594 0.758 . . . . 0.0 109.352 170.347 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 11.1 tt0 -58.69 -47.28 85.06 Favored 'General case' 0 N--CA 1.465 0.29 0 C-N-CA 125.063 1.345 . . . . 0.0 112.442 -168.048 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 87.3 m -64.86 -23.08 67.12 Favored 'General case' 0 C--O 1.234 0.255 0 N-CA-C 113.645 0.98 . . . . 0.0 113.645 -178.526 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 8.4 t -101.98 -31.41 10.68 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 123.49 0.716 . . . . 0.0 112.597 -172.377 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 80.7 p -88.6 -28.16 20.88 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 124.532 1.133 . . . . 0.0 112.9 172.399 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 11.8 t -139.13 -160.05 1.02 Allowed 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 126.492 1.917 . . . . 0.0 109.622 178.495 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 42.6 pt -96.51 156.98 3.3 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.476 0 C-N-CA 124.416 1.086 . . . . 0.0 111.731 176.061 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 18.2 p -147.35 160.55 42.41 Favored 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 124.219 1.008 . . . . 0.0 112.695 175.409 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 50.8 m -109.6 155.41 21.47 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 124.568 1.147 . . . . 0.0 111.774 -174.979 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 33.1 mt -60.41 -31.13 70.09 Favored 'General case' 0 N--CA 1.469 0.48 0 O-C-N 120.949 -1.094 . . . . 0.0 112.078 177.762 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 33.4 m-85 -61.09 -30.16 70.18 Favored 'General case' 0 CA--C 1.542 0.66 0 N-CA-C 113.558 0.947 . . . . 0.0 113.558 171.22 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 96.2 mt-30 -81.78 -34.55 30.28 Favored 'General case' 0 N--CA 1.465 0.294 0 C-N-CA 123.94 0.896 . . . . 0.0 110.298 177.355 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 8.3 mp -62.12 -40.39 95.73 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 118.775 0.716 . . . . 0.0 111.785 166.653 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -59.16 -28.35 66.51 Favored 'General case' 0 CA--C 1.541 0.596 0 C-N-CA 124.587 1.155 . . . . 0.0 113.105 -178.146 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 5.4 m-80 -66.29 -16.33 63.95 Favored 'General case' 0 CA--C 1.546 0.816 0 N-CA-C 113.795 1.035 . . . . 0.0 113.795 175.559 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 72.5 m-85 -102.21 5.2 40.04 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 125.908 1.683 . . . . 0.0 113.458 177.609 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 86.0 m . . . . . 0 N--CA 1.473 0.701 0 O-C-N 121.018 -1.052 . . . . 0.0 112.422 167.735 . . . . . . . . 0 0 . 1 . 033 nuclear nobuild core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 10.4 p30 . . . . . 0 CA--C 1.541 0.629 0 CA-C-O 120.689 0.281 . . . . 0.0 111.569 . . . . . . . . . 0 0 . 1 . 033 nuclear nobuild core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 38.7 mt-30 -150.43 167.42 27.17 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 124.444 1.098 . . . . 0.0 111.479 -166.673 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 92.4 m-70 -86.72 136.74 32.9 Favored 'General case' 0 CA--C 1.542 0.671 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 152.675 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 93.3 mt -148.93 136.03 19.99 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 125.582 1.553 . . . . 0.0 109.412 -176.875 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 73.0 m -140.74 145.29 36.23 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 124.742 1.217 . . . . 0.0 110.526 -179.11 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 52.53 -125.71 29.81 Favored Glycine 0 N--CA 1.473 1.135 0 C-N-CA 124.772 1.177 . . . . 0.0 114.503 165.381 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 23.6 m -60.39 -36.92 79.21 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 124.061 0.944 . . . . 0.0 111.941 -177.656 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 27.5 m170 -68.62 -37.93 80.13 Favored 'General case' 0 CA--C 1.54 0.559 0 O-C-N 121.325 -0.86 . . . . 0.0 111.809 178.25 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 9.6 tt -64.14 -45.94 86.29 Favored 'General case' 0 C--O 1.223 -0.305 0 C-N-CA 123.993 0.917 . . . . 0.0 110.796 170.074 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 41.7 t -61.65 -37.18 77.34 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.963 0 C-N-CA 123.602 0.761 . . . . 0.0 111.836 178.4 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -68.31 -45.43 72.99 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 124.022 0.929 . . . . 0.0 111.804 173.364 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.76 -43.67 97.72 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 119.352 0.978 . . . . 0.0 111.756 175.248 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 51.4 tp -61.15 -48.76 80.12 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 125.222 1.409 . . . . 0.0 111.022 177.109 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 46.9 t80 -54.35 -40.02 67.66 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 123.49 0.716 . . . . 0.0 112.659 172.436 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 82.2 mt -74.9 -33.9 62.1 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 123.961 0.904 . . . . 0.0 113.248 178.703 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 40.0 t -65.85 -44.7 92.7 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.924 0 C-N-CA 124.413 1.085 . . . . 0.0 110.98 172.15 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 58.5 m -83.41 -29.81 27.82 Favored 'General case' 0 N--CA 1.469 0.504 0 N-CA-C 113.676 0.991 . . . . 0.0 113.676 -175.087 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 67.61 -144.89 44.63 Favored Glycine 0 CA--C 1.532 1.129 0 C-N-CA 124.224 0.916 . . . . 0.0 112.012 -174.499 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -68.96 -7.42 35.05 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 124.65 1.18 . . . . 0.0 114.139 -178.953 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 80.0 mtt85 -61.31 -31.88 71.74 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 124.733 1.213 . . . . 0.0 113.389 177.049 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 86.34 179.35 49.55 Favored Glycine 0 CA--C 1.533 1.164 0 C-N-CA 125.112 1.339 . . . . 0.0 112.441 -170.654 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 52.6 p90 -159.65 167.32 28.69 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 124.729 1.212 . . . . 0.0 112.833 -173.274 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 81.7 t80 . . . . . 0 CA--C 1.537 0.472 0 C-N-CA 125.999 1.72 . . . . 0.0 108.314 172.209 . . . . . . . . 0 0 . 1 . 034 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 74.7 t . . . . . 0 N--CA 1.48 1.041 0 N-CA-C 111.396 0.147 . . . . 0.0 111.396 . . . . . . . . . 0 0 . 1 . 034 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 18.8 tt0 -79.17 0.89 26.49 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 123.642 0.777 . . . . 0.0 113.027 -179.519 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 6.7 tp60 -104.54 -63.05 1.25 Allowed 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 124.458 1.103 . . . . 0.0 109.643 166.032 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 64.5 m -66.19 -26.18 67.28 Favored 'General case' 0 N--CA 1.467 0.424 0 N-CA-C 115.151 1.537 . . . . 0.0 115.151 -170.152 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 12.1 t -87.61 -33.36 18.88 Favored 'General case' 0 N--CA 1.471 0.585 0 O-C-N 121.708 -0.62 . . . . 0.0 112.594 -172.117 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 20.7 p -105.69 -35.29 7.44 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 126.29 1.836 . . . . 0.0 112.826 -175.806 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.1 t -112.18 -171.79 1.92 Allowed 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 125.48 1.512 . . . . 0.0 110.31 169.579 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 11.1 tt -92.83 146.72 6.03 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.686 0 C-N-CA 124.807 1.243 . . . . 0.0 110.329 173.624 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 27.2 p -133.56 158.21 43.73 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-O 121.805 0.812 . . . . 0.0 112.448 175.285 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 83.8 p -104.78 158.29 16.62 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 125.006 1.322 . . . . 0.0 111.939 -179.802 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 55.8 mt -60.16 -30.29 69.22 Favored 'General case' 0 N--CA 1.466 0.34 0 O-C-N 121.083 -1.011 . . . . 0.0 111.927 173.87 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 76.9 t80 -65.7 -31.98 73.29 Favored 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 113.398 0.888 . . . . 0.0 113.398 171.249 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 40.5 mt-30 -73.73 -36.84 65.22 Favored 'General case' 0 N--CA 1.468 0.458 0 O-C-N 121.5 -0.75 . . . . 0.0 110.483 173.144 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 7.0 mp -61.59 -40.12 93.64 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-N 118.608 0.64 . . . . 0.0 111.603 168.992 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 27.5 tt0 -68.51 -32.41 72.35 Favored 'General case' 0 CA--C 1.544 0.737 0 N-CA-C 112.786 0.661 . . . . 0.0 112.786 178.83 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 6.3 m-80 -66.21 -15.11 62.89 Favored 'General case' 0 CA--C 1.549 0.936 0 O-C-N 120.914 -1.116 . . . . 0.0 112.976 171.05 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 14.0 m-85 -97.75 1.33 48.32 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 125.889 1.676 . . . . 0.0 113.639 172.381 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 39.4 m . . . . . 0 CA--C 1.546 0.789 0 CA-C-N 119.93 1.241 . . . . 0.0 110.794 162.144 . . . . . . . . 0 0 . 1 . 034 nuclear nobuild core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 65.4 m-20 . . . . . 0 N--CA 1.472 0.65 0 N-CA-C 110.426 -0.213 . . . . 0.0 110.426 . . . . . . . . . 0 0 . 1 . 034 nuclear nobuild core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 41.9 mt-30 -146.03 159.29 43.47 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 123.575 0.75 . . . . 0.0 112.02 -166.908 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 99.0 m-70 -86.13 133.24 33.88 Favored 'General case' 0 CA--C 1.54 0.576 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 154.772 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 96.3 mt -146.66 135.52 22.33 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 125.375 1.47 . . . . 0.0 108.668 -172.007 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 4.2 t -160.45 154.8 23.46 Favored 'General case' 0 N--CA 1.466 0.348 0 O-C-N 121.538 -0.726 . . . . 0.0 111.99 -175.584 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 62.97 -139.61 44.92 Favored Glycine 0 N--CA 1.47 0.943 0 C-N-CA 123.969 0.795 . . . . 0.0 112.691 -178.845 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 23.9 p -61.83 -29.09 69.94 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 124.675 1.19 . . . . 0.0 112.411 179.64 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 15.7 m80 -62.6 -42.09 99.36 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 124.311 1.044 . . . . 0.0 111.939 176.668 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 40.4 tp -71.72 -40.0 69.75 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 123.628 0.771 . . . . 0.0 111.432 175.299 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 88.1 t -58.5 -43.19 86.37 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.202 0 C-N-CA 123.094 0.558 . . . . 0.0 111.406 173.31 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -67.31 -43.41 81.75 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 124.291 1.037 . . . . 0.0 111.752 176.443 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.36 -44.49 97.08 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 122.942 0.497 . . . . 0.0 111.671 177.14 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 34.9 mt -60.43 -46.59 89.48 Favored 'General case' 0 N--CA 1.467 0.407 0 C-N-CA 124.046 0.938 . . . . 0.0 111.084 174.408 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 84.2 t80 -56.56 -39.57 73.68 Favored 'General case' 0 CA--C 1.543 0.705 0 CA-C-N 118.725 0.693 . . . . 0.0 112.75 174.263 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 89.8 mt -77.62 -36.01 52.12 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 124.074 0.949 . . . . 0.0 113.47 179.805 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 41.1 t -69.14 -44.46 80.86 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.921 0 C-N-CA 124.036 0.934 . . . . 0.0 110.741 174.571 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 75.0 m -85.72 -30.75 22.88 Favored 'General case' 0 N--CA 1.47 0.531 0 N-CA-C 113.374 0.879 . . . . 0.0 113.374 -173.205 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 63.49 -132.08 41.42 Favored Glycine 0 CA--C 1.531 1.046 0 C-N-CA 123.975 0.797 . . . . 0.0 111.377 -177.508 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -69.74 -11.72 61.07 Favored 'General case' 0 CA--C 1.547 0.849 0 N-CA-C 113.8 1.037 . . . . 0.0 113.8 179.797 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 83.8 mtm180 -64.73 -37.45 87.65 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-N 119.13 0.877 . . . . 0.0 112.898 -179.459 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 83.07 169.68 45.02 Favored Glycine 0 CA--C 1.534 1.269 0 C-N-CA 124.513 1.054 . . . . 0.0 112.822 -170.356 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 53.5 p90 -153.34 160.61 42.72 Favored 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 114.198 1.184 . . . . 0.0 114.198 -170.398 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 46.0 t80 . . . . . 0 CA--C 1.54 0.581 0 C-N-CA 126.317 1.847 . . . . 0.0 110.219 164.59 . . . . . . . . 0 0 . 1 . 035 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 54.7 t . . . . . 0 N--CA 1.484 1.27 0 N-CA-C 112.553 0.575 . . . . 0.0 112.553 . . . . . . . . . 0 0 . 1 . 035 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -71.42 -33.68 69.63 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 118.187 0.449 . . . . 0.0 111.354 -178.873 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 18.1 tt0 -59.66 -56.89 16.26 Favored 'General case' 0 N--CA 1.466 0.334 0 C-N-CA 123.411 0.684 . . . . 0.0 110.987 177.948 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 2.1 t -73.45 -15.9 61.32 Favored 'General case' 0 N--CA 1.469 0.515 0 N-CA-C 113.547 0.943 . . . . 0.0 113.547 -174.276 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 26.2 t -90.29 -35.41 15.29 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 123.853 0.861 . . . . 0.0 112.999 178.634 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 76.8 p -95.58 -37.03 11.03 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 124.417 1.087 . . . . 0.0 113.097 177.833 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 17.7 t -113.46 -147.54 0.42 Allowed 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 126.923 2.089 . . . . 0.0 108.74 168.075 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 44.5 pt -118.01 168.49 9.86 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 C-N-CA 125.113 1.365 . . . . 0.0 112.616 -179.767 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 20.1 p -147.44 159.09 44.11 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 124.501 1.121 . . . . 0.0 111.661 166.663 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 88.6 p -96.17 162.12 13.67 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 125.142 1.377 . . . . 0.0 112.43 174.822 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 57.5 mt -60.42 -34.2 73.61 Favored 'General case' 0 N--CA 1.468 0.464 0 O-C-N 121.391 -0.818 . . . . 0.0 111.535 173.292 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 79.9 m-85 -65.6 -34.04 77.3 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 123.81 0.844 . . . . 0.0 113.014 173.028 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 45.2 mt-30 -72.28 -35.88 68.82 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-O 118.468 -0.777 . . . . 0.0 111.98 171.718 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 68.5 mt -58.57 -46.4 86.99 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 119.143 0.883 . . . . 0.0 110.949 169.276 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 22.5 tt0 -69.53 -27.34 65.08 Favored 'General case' 0 CA--C 1.541 0.597 0 N-CA-C 113.307 0.855 . . . . 0.0 113.307 -178.251 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.7 m-80 -62.65 -22.42 66.43 Favored 'General case' 0 CA--C 1.546 0.791 0 O-C-N 120.954 -1.091 . . . . 0.0 113.504 176.579 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 62.6 m-85 -99.91 0.81 41.99 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 125.169 1.388 . . . . 0.0 113.709 174.231 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 89.7 m . . . . . 0 CA--C 1.54 0.56 0 C-N-CA 124.197 0.999 . . . . 0.0 113.188 171.838 . . . . . . . . 0 0 . 1 . 035 nuclear nobuild core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 8.1 p-10 . . . . . 0 CA--C 1.537 0.461 0 N-CA-C 112.745 0.646 . . . . 0.0 112.745 . . . . . . . . . 0 0 . 1 . 035 nuclear nobuild core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 41.7 mt-30 -152.14 169.16 23.11 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 125.11 1.364 . . . . 0.0 111.885 -169.29 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 98.4 m-70 -88.17 135.35 33.48 Favored 'General case' 0 CA--C 1.542 0.673 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 150.276 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 86.6 mt -145.09 132.28 20.49 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 125.063 1.345 . . . . 0.0 110.53 -179.055 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 63.6 m -131.51 141.87 49.83 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 125.568 1.547 . . . . 0.0 110.295 178.097 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 51.57 -120.26 9.83 Favored Glycine 0 N--CA 1.475 1.28 0 C-N-CA 124.843 1.211 . . . . 0.0 114.372 165.543 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 29.3 m -60.13 -33.8 72.64 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 124.234 1.014 . . . . 0.0 112.627 -177.742 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 97.1 m-70 -72.16 -38.21 69.21 Favored 'General case' 0 CA--C 1.54 0.574 0 O-C-N 121.324 -0.86 . . . . 0.0 111.324 177.554 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 62.6 tp -65.13 -45.34 85.45 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 123.718 0.807 . . . . 0.0 111.126 172.392 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 27.5 t -60.38 -41.69 88.21 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.898 0 C-N-CA 124.246 1.018 . . . . 0.0 111.771 175.61 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -63.77 -47.41 81.07 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 123.631 0.772 . . . . 0.0 111.423 174.498 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.49 -43.87 97.75 Favored 'General case' 0 CA--C 1.541 0.62 0 O-C-N 121.691 -0.631 . . . . 0.0 112.477 179.549 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 25.5 mt -54.27 -50.93 66.1 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 124.45 1.1 . . . . 0.0 110.913 172.354 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 57.7 t80 -63.75 -33.06 74.82 Favored 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 113.463 0.912 . . . . 0.0 113.463 176.9 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 74.5 mt -74.69 -36.28 62.75 Favored 'General case' 0 N--CA 1.472 0.631 0 O-C-N 121.044 -1.035 . . . . 0.0 113.175 177.394 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 53.2 t -71.72 -43.44 70.18 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.875 0 C-N-CA 123.762 0.825 . . . . 0.0 111.066 175.709 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 65.1 m -104.72 -17.77 14.52 Favored 'General case' 0 N--CA 1.475 0.783 0 N-CA-C 114.467 1.284 . . . . 0.0 114.467 -166.593 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 67.72 -155.57 52.87 Favored Glycine 0 CA--C 1.531 1.081 0 C-N-CA 124.927 1.251 . . . . 0.0 113.18 179.642 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -71.83 -1.75 15.28 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 124.526 1.13 . . . . 0.0 113.297 175.606 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 29.1 ttp180 -60.83 -26.21 67.16 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 125.45 1.5 . . . . 0.0 112.886 176.531 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 111.5 139.52 7.9 Favored Glycine 0 CA--C 1.53 1.001 0 C-N-CA 126.392 1.949 . . . . 0.0 112.863 177.093 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 40.9 p90 -144.07 166.92 23.63 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 125.671 1.589 . . . . 0.0 112.167 -176.647 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 44.5 t80 . . . . . 0 CA--C 1.538 0.499 0 CA-C-O 121.74 0.781 . . . . 0.0 112.564 169.588 . . . . . . . . 0 0 . 1 . 036 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 85.2 t . . . . . 0 N--CA 1.484 1.259 0 CA-C-O 119.927 -0.082 . . . . 0.0 110.909 . . . . . . . . . 0 0 . 1 . 036 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -74.04 -47.81 34.29 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 123.097 0.559 . . . . 0.0 110.102 176.379 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 13.3 tm0? -58.74 -47.07 85.9 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 124.499 1.12 . . . . 0.0 111.693 -177.409 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 12.4 m -59.15 -23.89 62.56 Favored 'General case' 0 N--CA 1.47 0.525 0 N-CA-C 113.727 1.01 . . . . 0.0 113.727 174.988 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 49.4 t -98.13 -49.23 4.81 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 124.97 1.308 . . . . 0.0 113.324 -172.191 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 77.0 p -79.04 -36.11 41.57 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 124.641 1.176 . . . . 0.0 112.087 -179.662 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 13.2 t -106.77 -154.68 0.53 Allowed 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 125.554 1.542 . . . . 0.0 109.319 164.438 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 26.7 pt -117.29 155.6 18.88 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.624 0 C-N-CA 125.704 1.602 . . . . 0.0 111.474 178.036 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 16.1 p -145.87 162.32 38.0 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 124.041 0.936 . . . . 0.0 111.935 171.772 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 32.6 t -101.85 156.27 17.62 Favored 'General case' 0 N--CA 1.465 0.318 0 C-N-CA 124.071 0.948 . . . . 0.0 112.74 -173.383 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 55.5 mt -59.56 -31.95 69.9 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 124.178 0.991 . . . . 0.0 111.461 174.192 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 3.5 m-30 -67.62 -25.26 65.66 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 124.307 1.043 . . . . 0.0 112.727 173.703 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 89.2 mt-30 -88.41 -31.04 19.03 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 124.405 1.082 . . . . 0.0 110.527 178.505 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 10.9 mp -57.28 -52.65 64.48 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 122.964 0.506 . . . . 0.0 110.578 161.694 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 5.6 tm-20 -58.95 -29.51 67.19 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 124.956 1.303 . . . . 0.0 113.413 -173.971 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 22.3 t30 -51.76 -30.01 21.04 Favored 'General case' 0 CA--C 1.549 0.918 0 C-N-CA 124.934 1.293 . . . . 0.0 114.29 175.087 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 95.2 m-85 -94.79 0.45 54.93 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 125.347 1.459 . . . . 0.0 113.993 -177.343 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 75.3 m . . . . . 0 CA--C 1.538 0.484 0 C-N-CA 124.303 1.041 . . . . 0.0 113.409 177.77 . . . . . . . . 0 0 . 1 . 036 nuclear nobuild core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 40.3 m-80 . . . . . 0 CA--C 1.54 0.596 0 N-CA-C 113.331 0.863 . . . . 0.0 113.331 . . . . . . . . . 0 0 . 1 . 036 nuclear nobuild core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 36.9 mt-30 -145.57 164.19 32.45 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 125.69 1.596 . . . . 0.0 110.552 177.656 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 98.9 m-70 -81.45 128.98 34.45 Favored 'General case' 0 CA--C 1.538 0.5 0 N-CA-C 108.711 -0.848 . . . . 0.0 108.711 157.889 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 89.9 mt -142.24 124.69 15.7 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 125.498 1.519 . . . . 0.0 109.169 -176.302 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 61.5 m -127.67 137.55 52.54 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 124.256 1.022 . . . . 0.0 111.251 -173.646 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 45.59 -118.85 3.25 Favored Glycine 0 N--CA 1.472 1.075 0 C-N-CA 126.04 1.781 . . . . 0.0 114.708 165.404 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 19.1 m -60.0 -33.11 71.54 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 124.33 1.052 . . . . 0.0 112.693 -178.655 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 83.0 m-70 -78.77 -29.91 45.34 Favored 'General case' 0 CA--C 1.543 0.686 0 O-C-N 121.083 -1.01 . . . . 0.0 112.659 176.885 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 54.4 tp -65.48 -45.44 83.64 Favored 'General case' 0 N--CA 1.47 0.571 0 O-C-N 121.444 -0.785 . . . . 0.0 110.991 167.909 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 77.1 t -65.89 -35.02 74.12 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.022 0 C-N-CA 123.869 0.868 . . . . 0.0 111.934 175.95 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -63.87 -50.4 68.95 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 124.799 1.239 . . . . 0.0 111.569 171.623 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -58.76 -43.55 90.36 Favored 'General case' 0 CA--C 1.54 0.567 0 O-C-N 121.895 -0.503 . . . . 0.0 111.594 176.564 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 52.9 tp -58.8 -47.74 83.71 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 124.818 1.247 . . . . 0.0 111.677 177.23 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 89.7 t80 -59.27 -40.46 86.12 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 123.613 0.765 . . . . 0.0 112.452 173.119 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 90.0 mt -75.61 -35.22 60.58 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 124.113 0.965 . . . . 0.0 113.314 -178.156 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 41.4 t -65.24 -44.22 95.16 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.958 0 C-N-CA 124.378 1.071 . . . . 0.0 110.303 174.406 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 74.4 m -98.77 -17.72 18.35 Favored 'General case' 0 N--CA 1.471 0.611 0 N-CA-C 115.094 1.516 . . . . 0.0 115.094 -169.838 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 65.14 -138.79 39.42 Favored Glycine 0 CA--C 1.53 1.016 0 C-N-CA 124.81 1.195 . . . . 0.0 113.019 176.79 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -63.07 -19.66 64.61 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 125.524 1.53 . . . . 0.0 113.553 -176.392 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 50.8 mtm180 -61.47 -36.69 81.16 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 124.042 0.937 . . . . 0.0 113.151 -178.584 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.57 -176.45 42.24 Favored Glycine 0 CA--C 1.533 1.212 0 C-N-CA 123.992 0.806 . . . . 0.0 113.565 -178.17 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 37.9 p90 -156.89 169.98 23.54 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 125.332 1.453 . . . . 0.0 113.121 -168.362 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 89.1 t80 . . . . . 0 CA--C 1.538 0.498 0 C-N-CA 125.124 1.37 . . . . 0.0 109.051 161.577 . . . . . . . . 0 0 . 1 . 037 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 55.4 t . . . . . 0 N--CA 1.48 1.056 0 CA-C-O 119.176 -0.44 . . . . 0.0 111.917 . . . . . . . . . 0 0 . 1 . 037 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 78.5 mt-10 -86.66 -48.06 8.62 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-N 118.946 0.794 . . . . 0.0 111.047 168.72 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 61.8 tp60 -60.46 -44.32 95.99 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 123.144 0.578 . . . . 0.0 112.176 -175.162 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -79.59 -19.61 48.91 Favored 'General case' 0 CA--C 1.536 0.408 0 N-CA-C 113.641 0.978 . . . . 0.0 113.641 -177.128 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 48.3 t -100.54 -55.46 2.59 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 124.212 1.005 . . . . 0.0 113.002 -174.706 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 50.7 m -76.17 -42.99 44.78 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 125.45 1.5 . . . . 0.0 110.217 -177.244 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 16.4 t -99.98 -150.92 0.39 Allowed 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 123.725 0.81 . . . . 0.0 109.266 158.468 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 34.9 pt -120.99 158.24 23.66 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.675 0 C-N-CA 125.402 1.481 . . . . 0.0 112.078 179.056 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -148.78 165.8 30.35 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-O 121.974 0.892 . . . . 0.0 113.035 166.411 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 16.6 t -109.81 166.97 10.5 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 123.986 0.914 . . . . 0.0 112.182 -175.717 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 49.1 mt -57.26 -31.85 66.0 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 124.575 1.15 . . . . 0.0 111.705 174.817 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 27.7 m-85 -59.66 -33.54 71.68 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.215 1.006 . . . . 0.0 113.576 171.334 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 20.7 mm100 -82.05 -32.64 30.31 Favored 'General case' 0 N--CA 1.468 0.428 0 C-N-CA 124.483 1.113 . . . . 0.0 111.069 177.472 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 73.4 mt -60.66 -43.13 97.98 Favored 'General case' 0 CA--C 1.542 0.636 0 CA-C-N 118.418 0.554 . . . . 0.0 110.603 167.78 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -65.33 -35.93 82.48 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 123.85 0.86 . . . . 0.0 112.309 174.058 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 21.6 t-20 -63.77 -29.34 70.56 Favored 'General case' 0 CA--C 1.548 0.884 0 O-C-N 120.801 -1.187 . . . . 0.0 113.065 176.964 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 4.9 m-85 -83.01 -0.84 50.74 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 125.074 1.35 . . . . 0.0 113.891 172.349 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 8.1 t . . . . . 0 CA--C 1.54 0.589 0 O-C-N 120.873 -1.142 . . . . 0.0 113.479 175.422 . . . . . . . . 0 0 . 1 . 037 nuclear nobuild core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 60.9 t-20 . . . . . 0 N--CA 1.468 0.449 0 N-CA-C 109.653 -0.499 . . . . 0.0 109.653 . . . . . . . . . 0 0 . 1 . 037 nuclear nobuild core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 26.7 mm-40 -150.83 161.37 42.8 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 124.475 1.11 . . . . 0.0 113.207 -160.897 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 85.5 m-70 -80.47 123.79 28.36 Favored 'General case' 0 CA--C 1.542 0.636 0 N-CA-C 108.786 -0.82 . . . . 0.0 108.786 156.944 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 91.1 mt -138.67 127.46 23.6 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 126.133 1.773 . . . . 0.0 108.878 178.368 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 73.5 m -132.41 143.87 50.11 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 124.961 1.304 . . . . 0.0 111.066 -173.566 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 52.78 -123.77 24.85 Favored Glycine 0 N--CA 1.471 0.997 0 C-N-CA 124.907 1.242 . . . . 0.0 113.776 166.302 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 20.3 m -61.25 -33.01 72.81 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 123.958 0.903 . . . . 0.0 112.702 -179.063 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 99.5 m-70 -73.52 -35.46 65.58 Favored 'General case' 0 CA--C 1.54 0.568 0 O-C-N 121.196 -0.94 . . . . 0.0 111.81 176.65 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 56.5 tp -64.5 -46.97 80.7 Favored 'General case' 0 N--CA 1.466 0.326 0 C-N-CA 123.332 0.653 . . . . 0.0 110.706 170.509 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 76.5 t -60.77 -41.15 87.36 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 C-N-CA 123.296 0.638 . . . . 0.0 111.515 176.063 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 42.9 tt0 -63.34 -48.34 78.39 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 123.575 0.75 . . . . 0.0 111.434 177.253 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.12 -45.75 92.1 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 123.069 0.548 . . . . 0.0 111.887 177.923 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 37.2 tp -60.43 -43.68 96.53 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 125.056 1.343 . . . . 0.0 111.436 178.454 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 68.8 t80 -64.76 -34.05 77.42 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 124.079 0.952 . . . . 0.0 113.328 172.381 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 65.8 mt -74.13 -31.93 62.96 Favored 'General case' 0 N--CA 1.472 0.626 0 O-C-N 121.044 -1.035 . . . . 0.0 113.142 176.317 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 79.4 t -72.96 -44.03 58.12 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.039 0 CA-C-N 118.367 0.531 . . . . 0.0 111.135 172.6 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -148.27 11.05 0.9 Allowed 'General case' 0 N--CA 1.473 0.705 0 N-CA-C 117.065 2.246 . . . . 0.0 117.065 -161.744 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . -63.76 -23.83 67.62 Favored Glycine 0 N--CA 1.476 1.317 0 O-C-N 120.803 -1.186 . . . . 0.0 115.46 -171.86 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -73.96 -22.51 59.62 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-N 118.255 1.028 . . . . 0.0 113.755 173.436 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 29.4 mtp180 -94.09 -37.08 11.8 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 125.486 1.514 . . . . 0.0 111.835 172.99 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 94.13 142.15 11.98 Favored Glycine 0 CA--C 1.527 0.844 0 C-N-CA 126.051 1.786 . . . . 0.0 112.851 176.707 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 25.9 p90 -127.13 159.76 33.26 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 125.115 1.366 . . . . 0.0 114.221 -166.909 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 40.3 t80 . . . . . 0 CA--C 1.542 0.646 0 C-N-CA 126.024 1.73 . . . . 0.0 110.555 164.523 . . . . . . . . 0 0 . 1 . 038 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 20.4 t . . . . . 0 N--CA 1.484 1.262 0 N-CA-C 110.746 -0.094 . . . . 0.0 110.746 . . . . . . . . . 0 0 . 1 . 038 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -71.6 -13.96 61.93 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 123.653 0.781 . . . . 0.0 112.796 -178.476 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 53.6 tp60 -85.63 -77.69 0.29 Allowed 'General case' 0 C--O 1.226 -0.176 0 N-CA-C 108.082 -1.081 . . . . 0.0 108.082 156.193 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 64.3 m -55.3 -27.1 44.55 Favored 'General case' 0 N--CA 1.472 0.66 0 N-CA-C 115.794 1.776 . . . . 0.0 115.794 -159.844 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 11.0 t -90.78 -23.34 20.67 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 123.929 0.891 . . . . 0.0 112.565 -176.84 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 32.3 m -107.11 -28.15 10.16 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 126.702 2.001 . . . . 0.0 112.224 -175.029 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 16.1 t -147.89 168.46 22.17 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 126.094 1.758 . . . . 0.0 110.36 172.222 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 34.6 pt -68.65 150.16 10.9 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.708 0 O-C-N 120.379 -1.451 . . . . 0.0 113.569 -170.582 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 14.8 p -147.31 163.06 37.61 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 124.783 1.233 . . . . 0.0 112.334 174.384 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 48.7 m -120.08 155.05 33.76 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 124.082 0.953 . . . . 0.0 113.089 -171.366 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 46.8 mt -60.99 -33.52 73.37 Favored 'General case' 0 N--CA 1.471 0.594 0 O-C-N 121.256 -0.903 . . . . 0.0 112.137 177.361 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 83.7 t80 -62.44 -27.0 68.81 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 124.09 0.956 . . . . 0.0 113.519 172.643 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 91.6 mt-30 -81.12 -40.61 23.78 Favored 'General case' 0 N--CA 1.467 0.396 0 C-N-CA 124.132 0.973 . . . . 0.0 110.395 172.517 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 41.8 mt -57.72 -33.32 68.3 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-N 118.921 0.782 . . . . 0.0 112.499 174.19 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 8.4 tm-20 -56.3 -34.7 66.74 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 125.086 1.354 . . . . 0.0 113.003 176.332 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 25.1 t30 -63.34 -34.27 77.33 Favored 'General case' 0 CA--C 1.543 0.711 0 O-C-N 121.203 -0.936 . . . . 0.0 112.256 175.443 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 74.5 m-85 -88.57 2.13 53.63 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 125.849 1.659 . . . . 0.0 113.762 -178.129 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 82.5 m . . . . . 0 CA--C 1.543 0.686 0 C-N-CA 126.146 1.778 . . . . 0.0 113.051 168.227 . . . . . . . . 0 0 . 1 . 038 nuclear nobuild core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 24.8 t-20 . . . . . 0 CA--C 1.54 0.562 0 CA-C-O 120.38 0.133 . . . . 0.0 110.74 . . . . . . . . . 0 0 . 1 . 038 nuclear nobuild core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 48.5 mm-40 -156.32 167.41 30.53 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 124.771 1.228 . . . . 0.0 112.15 -167.554 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 16.8 m170 -84.78 138.43 32.6 Favored 'General case' 0 CA--C 1.542 0.636 0 N-CA-C 109.329 -0.619 . . . . 0.0 109.329 150.226 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 72.1 mt -146.41 136.44 23.5 Favored 'General case' 0 N--CA 1.465 0.314 0 C-N-CA 125.067 1.347 . . . . 0.0 109.455 -175.476 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 3.0 t -154.64 153.44 31.36 Favored 'General case' 0 N--CA 1.466 0.327 0 C-N-CA 123.502 0.721 . . . . 0.0 111.451 -176.117 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 47.76 -124.79 10.59 Favored Glycine 0 CA--C 1.529 0.928 0 C-N-CA 125.19 1.376 . . . . 0.0 113.772 176.82 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 24.3 p -60.35 -33.93 73.13 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 125.028 1.331 . . . . 0.0 113.197 179.301 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 98.2 m-70 -70.12 -39.27 75.56 Favored 'General case' 0 CA--C 1.542 0.646 0 O-C-N 121.204 -0.935 . . . . 0.0 111.583 177.025 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 63.5 tp -65.96 -45.14 82.83 Favored 'General case' 0 N--CA 1.471 0.604 0 O-C-N 121.616 -0.678 . . . . 0.0 110.869 172.735 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 24.7 t -59.59 -39.68 80.1 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.936 0 C-N-CA 124.187 0.995 . . . . 0.0 111.806 176.238 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -67.84 -46.61 71.31 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 123.879 0.872 . . . . 0.0 111.601 175.074 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.87 -46.2 90.04 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.158 0.583 . . . . 0.0 111.602 178.2 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 30.6 mt -54.74 -59.2 5.04 Favored 'General case' 0 N--CA 1.466 0.357 0 C-N-CA 124.099 0.96 . . . . 0.0 110.255 171.472 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 69.6 t80 -51.85 -38.71 57.01 Favored 'General case' 0 CA--C 1.543 0.707 0 CA-C-N 119.443 1.02 . . . . 0.0 113.234 -179.495 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 86.7 mt -72.71 -32.2 65.57 Favored 'General case' 0 N--CA 1.471 0.593 0 N-CA-C 113.914 1.079 . . . . 0.0 113.914 177.732 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 68.0 t -78.07 -38.06 23.61 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.01 0 C-N-CA 123.922 0.889 . . . . 0.0 111.316 174.384 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 44.1 m -89.48 -33.43 16.79 Favored 'General case' 0 N--CA 1.466 0.348 0 N-CA-C 114.28 1.215 . . . . 0.0 114.28 -170.633 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 60.79 -131.93 49.15 Favored Glycine 0 CA--C 1.533 1.192 0 N-CA-C 111.391 -0.684 . . . . 0.0 111.391 -172.18 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -72.46 -7.75 51.48 Favored 'General case' 0 CA--C 1.546 0.826 0 N-CA-C 114.364 1.246 . . . . 0.0 114.364 -179.311 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 68.8 mtp180 -62.95 -26.85 69.02 Favored 'General case' 0 N--CA 1.476 0.875 0 CA-C-N 119.336 0.971 . . . . 0.0 113.414 177.938 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 75.38 173.62 33.67 Favored Glycine 0 CA--C 1.531 1.075 0 C-N-CA 124.419 1.009 . . . . 0.0 112.192 -168.629 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 35.6 p90 -150.12 157.73 43.42 Favored 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 114.789 1.403 . . . . 0.0 114.789 -171.619 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 89.5 t80 . . . . . 0 CA--C 1.541 0.634 0 C-N-CA 126.321 1.848 . . . . 0.0 109.617 171.306 . . . . . . . . 0 0 . 1 . 039 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 38.2 t . . . . . 0 N--CA 1.481 1.113 0 CA-C-O 119.069 -0.491 . . . . 0.0 111.535 . . . . . . . . . 0 0 . 1 . 039 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -71.45 -47.39 56.05 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-N 119.169 0.895 . . . . 0.0 110.491 173.906 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 65.3 tp60 -56.84 -46.24 81.84 Favored 'General case' 0 N--CA 1.467 0.393 0 C-N-CA 123.698 0.799 . . . . 0.0 111.963 179.347 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -82.85 -17.11 45.05 Favored 'General case' 0 N--CA 1.469 0.487 0 N-CA-C 114.477 1.288 . . . . 0.0 114.477 -175.056 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 29.3 t -102.89 -43.92 5.4 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 123.986 0.915 . . . . 0.0 112.807 -175.983 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 61.7 m -85.63 -37.17 19.79 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 125.476 1.511 . . . . 0.0 111.118 178.89 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 18.1 t -110.69 -149.55 0.45 Allowed 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 124.15 0.98 . . . . 0.0 109.366 160.944 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 11.9 tt -116.86 157.45 17.81 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.932 0 C-N-CA 126.099 1.759 . . . . 0.0 111.258 177.828 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 1.6 p -143.72 -171.75 3.59 Favored 'General case' 0 N--CA 1.476 0.865 0 O-C-N 121.237 -0.914 . . . . 0.0 111.719 167.663 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 59.5 p -131.72 168.93 16.93 Favored 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 124.478 1.111 . . . . 0.0 112.573 177.534 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 32.9 mt -61.41 -31.65 71.58 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 123.374 0.669 . . . . 0.0 112.103 174.164 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 87.0 t80 -65.1 -33.01 75.01 Favored 'General case' 0 CA--C 1.54 0.569 0 N-CA-C 112.946 0.721 . . . . 0.0 112.946 171.827 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 19.7 mm100 -75.83 -28.02 58.1 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-O 118.699 -0.667 . . . . 0.0 112.274 172.571 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 53.3 mt -68.9 -40.26 79.28 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-N 119.412 1.005 . . . . 0.0 111.639 168.579 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -58.49 -24.72 61.16 Favored 'General case' 0 CA--C 1.547 0.84 0 N-CA-C 113.428 0.899 . . . . 0.0 113.428 -177.414 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 25.0 t30 -54.83 -26.0 32.2 Favored 'General case' 0 CA--C 1.551 0.989 0 C-N-CA 124.567 1.147 . . . . 0.0 113.844 171.727 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 98.6 m-85 -101.83 4.31 40.2 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 126.051 1.74 . . . . 0.0 114.021 -175.468 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 61.2 m . . . . . 0 CA--C 1.543 0.674 0 O-C-N 121.352 -0.843 . . . . 0.0 111.59 166.384 . . . . . . . . 0 0 . 1 . 039 nuclear nobuild core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 11.5 m120 . . . . . 0 CA--C 1.533 0.322 0 CA-C-O 120.954 0.407 . . . . 0.0 111.229 . . . . . . . . . 0 0 . 1 . 039 nuclear nobuild core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 38.2 mt-30 -152.43 154.11 34.91 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 124.948 1.299 . . . . 0.0 110.332 -173.066 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 95.1 m-70 -87.89 123.37 32.57 Favored 'General case' 0 CA--C 1.54 0.57 0 N-CA-C 108.372 -0.973 . . . . 0.0 108.372 162.572 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 72.1 mt -140.75 142.57 34.75 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 125.541 1.536 . . . . 0.0 108.397 -171.621 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -149.15 150.91 33.45 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 123.486 0.715 . . . . 0.0 112.25 -173.609 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 43.95 -125.06 5.41 Favored Glycine 0 N--CA 1.473 1.129 0 C-N-CA 125.754 1.645 . . . . 0.0 114.316 172.427 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 20.1 m -62.13 -31.13 71.56 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 124.653 1.181 . . . . 0.0 112.803 -178.06 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 97.7 m-70 -72.38 -37.1 68.83 Favored 'General case' 0 CA--C 1.539 0.546 0 O-C-N 121.037 -1.039 . . . . 0.0 111.463 177.308 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 8.8 tt -66.27 -44.72 82.83 Favored 'General case' 0 C--N 1.344 0.346 0 O-C-N 121.719 -0.613 . . . . 0.0 110.974 169.941 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 53.9 t -61.75 -36.72 75.33 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.986 0 C-N-CA 123.212 0.605 . . . . 0.0 111.782 177.836 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -65.8 -48.47 71.62 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 123.905 0.882 . . . . 0.0 111.739 172.107 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.8 -44.07 94.15 Favored 'General case' 0 CA--C 1.543 0.678 0 O-C-N 121.633 -0.667 . . . . 0.0 111.704 176.77 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 52.3 tp -58.28 -50.94 71.83 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 125.885 1.674 . . . . 0.0 111.005 176.122 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 52.8 t80 -54.76 -42.21 71.4 Favored 'General case' 0 CA--C 1.541 0.634 0 N-CA-C 113.009 0.744 . . . . 0.0 113.009 173.434 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 89.5 mt -74.04 -33.36 63.7 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 123.925 0.89 . . . . 0.0 113.348 179.957 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 24.4 t -65.11 -47.18 88.74 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.819 0 C-N-CA 124.864 1.266 . . . . 0.0 110.361 171.457 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 84.7 m -75.74 -36.27 59.95 Favored 'General case' 0 N--CA 1.469 0.482 0 N-CA-C 112.753 0.649 . . . . 0.0 112.753 -176.436 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 62.81 -134.35 43.92 Favored Glycine 0 CA--C 1.529 0.927 0 C-N-CA 124.384 0.992 . . . . 0.0 111.412 -178.195 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -61.13 -18.4 57.86 Favored 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 114.681 1.363 . . . . 0.0 114.681 178.714 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 86.0 mtm180 -65.2 -30.45 71.35 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 124.117 0.967 . . . . 0.0 113.212 179.815 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 77.73 177.82 47.56 Favored Glycine 0 CA--C 1.533 1.212 0 C-N-CA 124.507 1.051 . . . . 0.0 112.888 -173.221 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 33.3 p90 -158.55 168.26 27.39 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 124.641 1.176 . . . . 0.0 112.64 -172.134 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 92.0 t80 . . . . . 0 CA--C 1.537 0.454 0 C-N-CA 124.389 1.076 . . . . 0.0 111.83 164.085 . . . . . . . . 0 0 . 1 . 040 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 83.7 t . . . . . 0 N--CA 1.483 1.211 0 CA-C-O 119.388 -0.339 . . . . 0.0 110.412 . . . . . . . . . 0 0 . 1 . 040 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 14.9 pt-20 -61.98 -36.29 81.04 Favored 'General case' 0 CA--C 1.543 0.695 0 CA-C-N 118.722 0.692 . . . . 0.0 112.296 172.566 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 28.5 tt0 -74.0 -43.92 56.37 Favored 'General case' 0 C--O 1.225 -0.223 0 C-N-CA 123.534 0.734 . . . . 0.0 110.365 -179.704 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 92.6 m -72.27 -36.3 68.97 Favored 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 113.746 1.017 . . . . 0.0 113.746 179.098 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 15.8 t -93.46 -45.61 7.69 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 123.601 0.76 . . . . 0.0 112.826 -168.447 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 25.1 m -91.47 -38.33 12.62 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 124.747 1.219 . . . . 0.0 111.488 -177.298 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.7 t -105.09 -152.32 0.46 Allowed 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 124.493 1.117 . . . . 0.0 111.393 171.221 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 24.1 mt -109.87 140.38 29.04 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.791 0 C-N-CA 126.002 1.721 . . . . 0.0 110.092 168.817 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 9.7 p -124.39 -172.9 2.65 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.74 1.216 . . . . 0.0 111.129 167.366 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 8.4 t -148.8 166.66 27.8 Favored 'General case' 0 N--CA 1.469 0.503 0 O-C-N 120.655 -1.278 . . . . 0.0 111.898 179.264 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 34.0 mt -59.86 -33.49 71.88 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 124.628 1.171 . . . . 0.0 112.143 -178.234 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 86.6 t80 -61.42 -29.91 70.23 Favored 'General case' 0 CA--C 1.546 0.792 0 N-CA-C 113.565 0.95 . . . . 0.0 113.565 171.908 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 54.0 mm-40 -80.16 -36.47 35.08 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 123.343 0.657 . . . . 0.0 110.522 174.503 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 32.5 mt -62.27 -37.86 87.09 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 118.523 0.601 . . . . 0.0 111.52 172.193 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -61.31 -32.1 71.96 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 124.878 1.271 . . . . 0.0 112.903 179.004 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 24.1 t30 -62.5 -24.24 67.37 Favored 'General case' 0 CA--C 1.548 0.901 0 O-C-N 121.405 -0.809 . . . . 0.0 112.794 176.424 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 38.8 m-85 -95.51 1.59 54.01 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 125.584 1.553 . . . . 0.0 114.475 179.785 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 70.2 m . . . . . 0 CA--C 1.544 0.74 0 O-C-N 121.002 -1.061 . . . . 0.0 113.234 173.294 . . . . . . . . 0 0 . 1 . 040 nuclear nobuild core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 10.0 p30 . . . . . 0 CA--C 1.543 0.681 0 CA-C-O 121.007 0.432 . . . . 0.0 110.498 . . . . . . . . . 0 0 . 1 . 040 nuclear nobuild core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 30.5 mt-30 -148.3 165.82 29.87 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 124.043 0.937 . . . . 0.0 112.374 -158.888 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 93.8 m-70 -82.37 134.36 35.25 Favored 'General case' 0 CA--C 1.545 0.752 0 N-CA-C 108.968 -0.753 . . . . 0.0 108.968 157.592 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 76.4 mt -147.54 133.92 19.63 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 125.735 1.614 . . . . 0.0 108.619 -177.649 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 3.7 t -158.42 153.17 24.84 Favored 'General case' 0 N--CA 1.469 0.492 0 O-C-N 121.428 -0.795 . . . . 0.0 112.225 -177.38 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 61.01 -134.4 49.11 Favored Glycine 0 CA--C 1.53 0.992 0 C-N-CA 124.719 1.152 . . . . 0.0 113.139 179.171 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 20.3 m -60.9 -30.92 70.46 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 124.467 1.107 . . . . 0.0 112.029 -178.43 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 13.5 m80 -66.52 -41.82 88.19 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 124.543 1.137 . . . . 0.0 111.541 178.046 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 48.8 tp -69.46 -42.7 74.54 Favored 'General case' 0 N--CA 1.466 0.336 0 C-N-CA 124.284 1.033 . . . . 0.0 111.359 174.585 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 48.1 t -60.32 -41.07 85.82 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.038 0 C-N-CA 123.635 0.774 . . . . 0.0 111.349 175.458 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -66.61 -45.17 80.01 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 124.065 0.946 . . . . 0.0 111.829 174.399 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.99 -45.68 91.92 Favored 'General case' 0 CA--C 1.54 0.582 0 O-C-N 121.656 -0.652 . . . . 0.0 112.129 178.096 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 17.6 mt -54.74 -54.19 45.22 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 124.493 1.117 . . . . 0.0 110.974 172.795 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 77.8 t80 -55.45 -41.66 73.19 Favored 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 113.196 0.813 . . . . 0.0 113.196 177.177 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 85.4 mt -73.22 -35.76 66.35 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 123.9 0.88 . . . . 0.0 113.127 179.839 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 43.6 t -67.89 -42.47 85.76 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.845 0 C-N-CA 123.525 0.73 . . . . 0.0 110.903 173.842 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 82.7 m -80.75 -27.28 36.85 Favored 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 113.483 0.92 . . . . 0.0 113.483 -175.658 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 65.65 -111.96 4.59 Favored Glycine 0 CA--C 1.53 0.996 0 C-N-CA 124.298 0.951 . . . . 0.0 111.908 173.565 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -75.47 -18.91 59.72 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 124.395 1.078 . . . . 0.0 113.074 176.131 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 95.6 mtt-85 -76.9 158.16 30.9 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 124.059 0.943 . . . . 0.0 111.678 173.16 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . -74.46 179.37 43.43 Favored Glycine 0 CA--C 1.531 1.058 0 C-N-CA 123.839 0.733 . . . . 0.0 111.668 168.768 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 42.1 p90 -153.73 169.54 23.07 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.542 1.137 . . . . 0.0 112.473 -178.247 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 63.6 t80 . . . . . 0 CA--C 1.54 0.595 0 C-N-CA 124.828 1.251 . . . . 0.0 111.983 179.406 . . . . . . . . 0 0 . 1 . 041 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 85.5 t . . . . . 0 N--CA 1.48 1.048 0 CA-C-O 118.922 -0.561 . . . . 0.0 112.048 . . . . . . . . . 0 0 . 1 . 041 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -59.75 -35.45 74.61 Favored 'General case' 0 N--CA 1.474 0.755 0 CA-C-N 118.958 0.799 . . . . 0.0 112.573 -178.546 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 28.7 tp60 -71.44 -32.8 68.76 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-O 118.663 -0.684 . . . . 0.0 112.02 -178.536 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -95.23 -22.0 18.1 Favored 'General case' 0 CA--C 1.539 0.557 0 N-CA-C 114.161 1.171 . . . . 0.0 114.161 177.172 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 51.1 t -100.52 -56.08 2.43 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 124.764 1.226 . . . . 0.0 112.983 -172.976 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 26.8 m -81.06 -47.35 13.68 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 124.635 1.174 . . . . 0.0 109.894 -178.245 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 13.7 t -84.83 -158.35 0.35 Allowed 'General case' 0 CA--C 1.552 1.035 0 C-N-CA 123.045 0.538 . . . . 0.0 110.283 155.791 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 29.8 pt -128.82 150.4 34.44 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.552 0 C-N-CA 125.181 1.392 . . . . 0.0 111.974 178.842 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -145.12 166.56 25.04 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 123.962 0.905 . . . . 0.0 112.099 170.546 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 3.4 t -118.52 167.11 11.92 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 124.064 0.946 . . . . 0.0 112.703 -173.943 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 47.7 mt -58.02 -35.65 71.58 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 124.713 1.205 . . . . 0.0 111.946 179.959 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 75.2 m-85 -62.06 -30.78 71.22 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 124.463 1.105 . . . . 0.0 113.543 173.287 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 17.6 mm100 -82.96 -33.68 26.63 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 124.328 1.051 . . . . 0.0 110.951 174.57 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 48.4 mt -62.51 -36.33 82.22 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 119.238 0.927 . . . . 0.0 111.418 170.988 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 25.5 tt0 -63.17 -27.75 69.58 Favored 'General case' 0 CA--C 1.544 0.726 0 N-CA-C 113.331 0.863 . . . . 0.0 113.331 178.894 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 30.8 t30 -59.59 -25.65 64.78 Favored 'General case' 0 CA--C 1.547 0.856 0 O-C-N 121.264 -0.897 . . . . 0.0 113.181 174.423 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 59.3 m-85 -94.55 -0.31 54.66 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 125.282 1.433 . . . . 0.0 114.117 -178.728 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 81.2 m . . . . . 0 CA--C 1.544 0.747 0 CA-C-N 119.076 0.853 . . . . 0.0 113.183 175.338 . . . . . . . . 0 0 . 1 . 041 nuclear nobuild core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 40.8 m-80 . . . . . 0 CA--C 1.541 0.598 0 N-CA-C 113.638 0.977 . . . . 0.0 113.638 . . . . . . . . . 0 0 . 1 . 041 nuclear nobuild core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 53.8 mm-40 -140.55 166.55 24.43 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 125.804 1.642 . . . . 0.0 110.442 -179.096 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 92.2 m-70 -84.96 116.7 23.52 Favored 'General case' 0 CA--C 1.541 0.628 0 N-CA-C 108.655 -0.869 . . . . 0.0 108.655 164.219 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 91.8 mt -132.35 126.33 33.0 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 125.743 1.617 . . . . 0.0 108.507 179.169 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 77.7 m -132.2 144.21 50.49 Favored 'General case' 0 N--CA 1.465 0.29 0 C-N-CA 124.839 1.255 . . . . 0.0 111.76 -168.01 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 53.04 -124.7 28.71 Favored Glycine 0 CA--C 1.531 1.081 0 C-N-CA 125.307 1.432 . . . . 0.0 114.271 164.647 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 22.2 p -56.85 -41.39 77.84 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 124.726 1.21 . . . . 0.0 112.238 176.968 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 19.3 m-70 -69.57 -29.89 67.54 Favored 'General case' 0 CA--C 1.541 0.628 0 O-C-N 120.613 -1.305 . . . . 0.0 112.712 177.946 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 48.0 tp -69.06 -43.06 75.4 Favored 'General case' 0 N--CA 1.47 0.564 0 O-C-N 121.544 -0.723 . . . . 0.0 111.275 169.559 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 52.1 t -60.57 -41.33 87.5 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.99 0 C-N-CA 123.927 0.891 . . . . 0.0 111.67 173.535 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -63.7 -46.5 85.17 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 124.372 1.069 . . . . 0.0 111.527 173.58 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.12 -45.06 96.22 Favored 'General case' 0 CA--C 1.544 0.734 0 CA-C-N 118.761 0.71 . . . . 0.0 111.923 178.872 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 22.2 mt -55.33 -54.36 44.54 Favored 'General case' 0 N--CA 1.467 0.416 0 C-N-CA 124.186 0.995 . . . . 0.0 111.056 173.018 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 71.1 t80 -55.61 -42.28 74.66 Favored 'General case' 0 N--CA 1.47 0.544 0 N-CA-C 113.007 0.743 . . . . 0.0 113.007 177.48 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 84.9 mt -74.88 -33.38 62.06 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 124.127 0.971 . . . . 0.0 113.341 -178.6 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 37.7 t -69.26 -44.02 80.86 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.849 0 C-N-CA 123.974 0.909 . . . . 0.0 110.684 172.498 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 72.9 m -76.79 -33.51 58.03 Favored 'General case' 0 CA--C 1.538 0.508 0 N-CA-C 113.074 0.768 . . . . 0.0 113.074 -175.936 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 68.89 -111.68 4.1 Favored Glycine 0 CA--C 1.529 0.91 0 C-N-CA 124.662 1.125 . . . . 0.0 112.044 172.166 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -69.12 -27.14 65.3 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 124.171 0.988 . . . . 0.0 112.131 173.975 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 82.8 mtm180 -72.91 153.99 40.76 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 124.803 1.241 . . . . 0.0 110.758 175.988 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . -76.22 -174.83 38.54 Favored Glycine 0 N--CA 1.474 1.175 0 C-N-CA 123.915 0.769 . . . . 0.0 111.581 168.423 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 52.5 p90 -152.46 148.09 27.01 Favored 'General case' 0 CA--C 1.536 0.442 0 N-CA-C 113.287 0.847 . . . . 0.0 113.287 179.234 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 90.7 t80 . . . . . 0 CA--C 1.538 0.493 0 C-N-CA 125.787 1.635 . . . . 0.0 110.671 169.664 . . . . . . . . 0 0 . 1 . 042 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 53.0 t . . . . . 0 N--CA 1.481 1.121 0 N-CA-C 111.6 0.222 . . . . 0.0 111.6 . . . . . . . . . 0 0 . 1 . 042 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 44.2 mm-40 -79.14 -56.73 4.15 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-O 118.969 -0.539 . . . . 0.0 110.518 168.609 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 23.8 tt0 -61.58 -40.91 96.44 Favored 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 113.865 1.061 . . . . 0.0 113.865 -166.692 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 25.7 m -69.49 -21.69 63.67 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 119.204 0.911 . . . . 0.0 112.766 175.948 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 13.2 t -88.12 -41.52 12.98 Favored 'General case' 0 CA--C 1.538 0.513 0 O-C-N 121.393 -0.817 . . . . 0.0 111.617 179.814 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 72.7 p -82.29 -18.17 43.27 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 125.243 1.417 . . . . 0.0 114.034 179.668 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 71.3 p -148.36 172.42 14.44 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 124.919 1.288 . . . . 0.0 111.905 -179.485 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 64.9 mt -73.9 129.03 36.59 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.679 0 O-C-N 121.238 -0.914 . . . . 0.0 109.774 174.549 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 17.3 p -123.49 159.77 28.36 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 124.866 1.267 . . . . 0.0 111.727 169.629 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 18.8 m -108.97 153.52 23.46 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 124.3 1.04 . . . . 0.0 111.276 -171.667 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 36.6 mt -60.69 -31.15 70.41 Favored 'General case' 0 N--CA 1.472 0.629 0 O-C-N 120.907 -1.121 . . . . 0.0 112.357 179.678 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 86.9 m-85 -64.59 -25.89 68.17 Favored 'General case' 0 CA--C 1.543 0.711 0 N-CA-C 114.096 1.147 . . . . 0.0 114.096 171.684 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 57.5 mm-40 -88.41 -25.93 22.42 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 124.752 1.221 . . . . 0.0 111.38 175.136 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 9.2 mp -62.42 -49.27 76.15 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 119.467 1.03 . . . . 0.0 110.588 162.993 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 37.5 tt0 -59.55 -28.45 67.12 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 124.679 1.191 . . . . 0.0 113.411 -179.874 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 26.2 t30 -54.33 -30.99 53.22 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 124.582 1.153 . . . . 0.0 113.889 179.321 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 99.4 m-85 -95.95 0.44 51.85 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 124.989 1.316 . . . . 0.0 113.865 -177.88 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 83.0 m . . . . . 0 CA--C 1.542 0.638 0 C-N-CA 124.594 1.158 . . . . 0.0 113.655 174.959 . . . . . . . . 0 0 . 1 . 042 nuclear nobuild core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 51.7 p-10 . . . . . 0 CA--C 1.543 0.677 0 CA-C-O 120.872 0.368 . . . . 0.0 111.328 . . . . . . . . . 0 0 . 1 . 042 nuclear nobuild core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 42.5 mt-30 -152.3 164.93 36.44 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 124.46 1.104 . . . . 0.0 111.937 -162.946 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 21.9 m-70 -84.79 135.25 34.19 Favored 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 108.758 -0.831 . . . . 0.0 108.758 153.607 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 81.5 mt -145.09 125.16 13.61 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 126.302 1.841 . . . . 0.0 109.465 -177.671 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 58.1 m -124.74 138.1 54.3 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 125.097 1.359 . . . . 0.0 110.489 -178.141 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 51.05 -117.25 5.27 Favored Glycine 0 N--CA 1.474 1.173 0 C-N-CA 125.091 1.329 . . . . 0.0 113.947 167.352 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 19.9 m -59.84 -32.94 71.14 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 124.495 1.118 . . . . 0.0 112.786 -178.066 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 96.2 m-70 -71.25 -38.66 71.9 Favored 'General case' 0 CA--C 1.539 0.535 0 O-C-N 121.253 -0.904 . . . . 0.0 111.42 176.418 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 56.5 tp -66.68 -42.95 85.7 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 123.508 0.723 . . . . 0.0 111.241 172.913 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 42.5 t -60.61 -43.26 94.32 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.916 0 C-N-CA 124.018 0.927 . . . . 0.0 111.699 175.061 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -64.28 -45.39 88.23 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 123.74 0.816 . . . . 0.0 111.425 175.5 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.46 -46.18 91.15 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 123.068 0.547 . . . . 0.0 112.034 177.309 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 28.7 mt -56.66 -48.38 77.7 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 124.091 0.956 . . . . 0.0 111.444 175.559 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 61.9 t80 -56.84 -41.13 77.33 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 123.773 0.829 . . . . 0.0 113.095 174.774 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 90.8 mt -78.02 -35.03 50.32 Favored 'General case' 0 N--CA 1.47 0.554 0 N-CA-C 113.426 0.898 . . . . 0.0 113.426 -179.455 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 40.8 t -67.23 -44.89 87.31 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 C-N-CA 124.645 1.178 . . . . 0.0 110.415 175.94 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 74.3 m -95.34 -25.84 16.14 Favored 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 113.628 0.973 . . . . 0.0 113.628 -170.758 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 63.08 -109.37 2.67 Favored Glycine 0 CA--C 1.531 1.052 0 C-N-CA 124.361 0.982 . . . . 0.0 112.72 168.509 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 39.1 mm-40 -69.8 -24.93 63.56 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 124.418 1.087 . . . . 0.0 112.86 175.818 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 96.0 mtt-85 -77.48 141.31 39.75 Favored 'General case' 0 N--CA 1.467 0.382 0 C-N-CA 124.046 0.938 . . . . 0.0 110.617 172.768 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . -74.0 152.48 45.58 Favored Glycine 0 N--CA 1.469 0.843 0 C-N-CA 124.652 1.12 . . . . 0.0 111.6 175.192 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 45.3 p90 -131.02 166.2 21.53 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 124.867 1.267 . . . . 0.0 112.508 -173.967 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 50.3 t80 . . . . . 0 CA--C 1.535 0.389 0 C-N-CA 124.215 1.006 . . . . 0.0 111.557 170.441 . . . . . . . . 0 0 . 1 . 043 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 93.4 t . . . . . 0 N--CA 1.483 1.217 0 N-CA-C 111.996 0.369 . . . . 0.0 111.996 . . . . . . . . . 0 0 . 1 . 043 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 33.4 mm-40 -89.38 -54.74 3.95 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 123.149 0.579 . . . . 0.0 110.093 169.034 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 64.4 tt0 -62.75 -44.19 96.83 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 124.77 1.228 . . . . 0.0 112.865 -168.511 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 2.7 t -81.16 -12.43 59.21 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-N 118.847 0.749 . . . . 0.0 112.777 -179.658 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 13.6 t -89.12 -40.04 13.2 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 124.227 1.011 . . . . 0.0 111.684 178.034 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 2.4 t -89.98 -36.15 15.13 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 124.813 1.245 . . . . 0.0 112.804 178.001 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 14.3 t -120.56 -149.95 0.44 Allowed 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 126.034 1.733 . . . . 0.0 109.42 172.349 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 47.7 pt -113.09 159.84 12.89 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.704 0 C-N-CA 125.099 1.36 . . . . 0.0 112.338 179.924 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 17.0 p -142.03 163.02 34.02 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 124.758 1.223 . . . . 0.0 112.166 167.194 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 13.8 m -104.93 152.48 22.61 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 125.056 1.342 . . . . 0.0 111.363 -176.052 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 33.9 mt -60.21 -34.4 73.59 Favored 'General case' 0 N--CA 1.47 0.526 0 O-C-N 120.999 -1.063 . . . . 0.0 111.549 176.42 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 85.4 t80 -60.06 -32.55 71.04 Favored 'General case' 0 CA--C 1.547 0.834 0 N-CA-C 113.213 0.82 . . . . 0.0 113.213 172.658 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 84.4 mt-30 -77.17 -36.75 54.85 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 123.773 0.829 . . . . 0.0 110.767 175.762 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 57.3 mt -60.93 -40.74 94.39 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-N 118.538 0.608 . . . . 0.0 111.729 170.416 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -62.31 -39.15 92.07 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 124.534 1.134 . . . . 0.0 112.03 175.076 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 31.3 t30 -63.41 -26.22 68.64 Favored 'General case' 0 CA--C 1.549 0.918 0 N-CA-C 113.363 0.875 . . . . 0.0 113.363 178.091 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 7.7 m-85 -77.5 -12.39 59.96 Favored 'General case' 0 CA--C 1.545 0.775 0 N-CA-C 114.247 1.203 . . . . 0.0 114.247 173.629 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 74.0 m . . . . . 0 CA--C 1.544 0.746 0 N-CA-C 114.181 1.178 . . . . 0.0 114.181 -178.102 . . . . . . . . 0 0 . 1 . 043 nuclear nobuild core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.541 0.618 0 N-CA-C 111.768 0.285 . . . . 0.0 111.768 . . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 42.4 mt-30 -146.9 165.63 29.18 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 124.301 1.04 . . . . 0.0 111.668 -166.89 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 96.6 m-70 -84.2 134.09 34.57 Favored 'General case' 0 CA--C 1.541 0.61 0 N-CA-C 108.948 -0.76 . . . . 0.0 108.948 156.882 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 92.0 mt -150.31 136.69 18.84 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 125.39 1.476 . . . . 0.0 108.995 -175.715 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 3.7 t -155.53 151.86 28.16 Favored 'General case' 0 N--CA 1.467 0.377 0 C-N-CA 123.294 0.638 . . . . 0.0 112.05 -177.241 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 54.62 -127.95 41.33 Favored Glycine 0 CA--C 1.531 1.06 0 C-N-CA 124.868 1.223 . . . . 0.0 113.338 178.851 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 24.8 m -62.58 -29.67 70.76 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 124.434 1.093 . . . . 0.0 111.988 -178.247 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 16.7 m80 -70.53 -39.39 74.08 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 124.065 0.946 . . . . 0.0 111.247 179.485 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 59.6 tp -67.9 -43.47 79.22 Favored 'General case' 0 N--CA 1.467 0.393 0 C-N-CA 123.998 0.919 . . . . 0.0 111.153 172.866 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 44.8 t -62.4 -39.17 83.3 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.941 0 C-N-CA 123.59 0.756 . . . . 0.0 111.812 176.028 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -66.3 -45.99 78.51 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 124.185 0.994 . . . . 0.0 111.541 173.985 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.0 -48.87 80.04 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 122.917 0.487 . . . . 0.0 111.766 177.109 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 23.4 mt -51.39 -53.27 38.21 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 124.882 1.273 . . . . 0.0 111.627 173.058 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 69.6 t80 -58.12 -42.88 86.72 Favored 'General case' 0 CA--C 1.54 0.592 0 N-CA-C 113.359 0.874 . . . . 0.0 113.359 177.846 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 89.5 mt -75.58 -32.07 60.22 Favored 'General case' 0 N--CA 1.47 0.55 0 N-CA-C 113.119 0.785 . . . . 0.0 113.119 -178.276 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 25.3 t -69.25 -44.42 80.6 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.746 0 C-N-CA 124.526 1.13 . . . . 0.0 110.795 174.175 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 80.9 m -94.74 -24.62 17.03 Favored 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 114.333 1.234 . . . . 0.0 114.333 -169.409 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 61.5 -109.11 2.28 Favored Glycine 0 CA--C 1.53 0.995 0 C-N-CA 124.327 0.965 . . . . 0.0 112.433 174.971 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -73.59 -24.19 60.03 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 124.079 0.951 . . . . 0.0 113.099 177.892 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 38.5 mtp85 -73.05 139.33 46.48 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 123.703 0.801 . . . . 0.0 110.496 172.895 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . -84.23 128.53 8.67 Favored Glycine 0 N--CA 1.467 0.743 0 C-N-CA 124.908 1.242 . . . . 0.0 111.269 -174.393 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 53.1 p90 -90.97 166.05 13.23 Favored 'General case' 0 CA--C 1.536 0.416 0 N-CA-C 113.446 0.906 . . . . 0.0 113.446 -177.73 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 70.9 t80 . . . . . 0 CA--C 1.536 0.437 0 C-N-CA 124.987 1.315 . . . . 0.0 110.219 174.59 . . . . . . . . 0 0 . 1 . 044 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 93.1 t . . . . . 0 N--CA 1.476 0.852 0 CA-C-O 119.921 -0.085 . . . . 0.0 110.834 . . . . . . . . . 0 0 . 1 . 044 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -64.36 -43.35 94.82 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-O 119.078 -0.487 . . . . 0.0 111.345 177.902 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 42.9 tt0 -61.35 -52.61 63.92 Favored 'General case' 0 CA--C 1.533 0.302 0 CA-C-N 118.633 0.651 . . . . 0.0 111.076 176.56 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 59.7 m -60.08 -32.76 71.26 Favored 'General case' 0 N--CA 1.467 0.38 0 N-CA-C 112.906 0.706 . . . . 0.0 112.906 -176.383 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 68.8 m -76.42 -57.39 3.89 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 123.78 0.832 . . . . 0.0 111.871 176.517 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 69.7 p -81.62 -20.61 39.36 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 124.641 1.176 . . . . 0.0 113.91 -169.168 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 10.5 t -140.86 -162.58 1.38 Allowed 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 126.73 2.012 . . . . 0.0 109.575 177.891 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 38.6 pt -93.88 147.06 5.82 Favored 'Isoleucine or valine' 0 C--O 1.236 0.362 0 O-C-N 120.932 -1.105 . . . . 0.0 112.034 176.492 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 17.2 p -137.87 165.11 27.3 Favored 'General case' 0 N--CA 1.466 0.355 0 C-N-CA 125.06 1.344 . . . . 0.0 110.231 166.747 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 13.5 t -115.96 161.67 18.5 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-O 121.604 0.716 . . . . 0.0 112.419 -179.076 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 53.0 mt -58.89 -33.39 70.45 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 125.009 1.324 . . . . 0.0 111.558 174.772 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 29.0 m-85 -58.79 -33.79 70.75 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 123.788 0.835 . . . . 0.0 113.223 171.304 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 63.4 mm-40 -83.18 -29.37 28.64 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 124.226 1.01 . . . . 0.0 111.327 177.869 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 41.1 mt -64.65 -39.96 94.6 Favored 'General case' 0 N--CA 1.471 0.608 0 CA-C-N 119.148 0.886 . . . . 0.0 111.046 168.593 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 26.9 tt0 -60.84 -27.16 67.87 Favored 'General case' 0 CA--C 1.545 0.751 0 N-CA-C 113.586 0.958 . . . . 0.0 113.586 -179.561 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 21.8 t30 -58.8 -26.29 63.95 Favored 'General case' 0 CA--C 1.548 0.882 0 O-C-N 121.062 -1.024 . . . . 0.0 113.1 173.656 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 89.7 m-85 -100.8 5.95 43.66 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 125.597 1.559 . . . . 0.0 113.967 -178.046 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 63.8 m . . . . . 0 CA--C 1.542 0.66 0 O-C-N 120.999 -1.063 . . . . 0.0 111.995 166.081 . . . . . . . . 0 0 . 1 . 044 nuclear nobuild core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 8.7 m120 . . . . . 0 CA--C 1.543 0.703 0 N-CA-C 111.696 0.258 . . . . 0.0 111.696 . . . . . . . . . 0 0 . 1 . 044 nuclear nobuild core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 42.7 mt-30 -150.93 161.12 43.32 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 125.45 1.5 . . . . 0.0 111.031 -178.493 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 37.1 m-70 -80.51 136.54 36.31 Favored 'General case' 0 CA--C 1.544 0.74 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 152.122 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 90.1 mt -150.07 127.17 11.24 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 125.86 1.664 . . . . 0.0 107.727 -172.917 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 4.2 t -152.19 156.64 40.17 Favored 'General case' 0 CA--C 1.535 0.404 0 O-C-N 121.44 -0.787 . . . . 0.0 112.586 -172.375 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 61.47 -138.6 47.11 Favored Glycine 0 CA--C 1.528 0.888 0 C-N-CA 125.002 1.287 . . . . 0.0 112.941 177.386 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 23.8 p -57.01 -39.2 74.28 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 123.915 0.886 . . . . 0.0 112.516 174.996 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 17.2 m-70 -65.12 -29.17 70.01 Favored 'General case' 0 CA--C 1.545 0.763 0 O-C-N 121.131 -0.981 . . . . 0.0 113.364 -179.4 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 55.9 tp -69.49 -41.76 75.69 Favored 'General case' 0 N--CA 1.469 0.476 0 O-C-N 121.476 -0.765 . . . . 0.0 111.527 170.115 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 94.6 t -64.25 -38.7 83.19 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.901 0 C-N-CA 123.098 0.559 . . . . 0.0 110.942 175.976 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 49.7 mt-10 -64.02 -48.08 77.72 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 124.485 1.114 . . . . 0.0 111.421 173.02 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.29 -45.51 93.11 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-N 119.158 0.89 . . . . 0.0 111.752 178.233 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 53.2 tp -57.45 -51.87 67.68 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 124.403 1.081 . . . . 0.0 110.933 175.077 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 54.8 t80 -56.67 -40.59 75.81 Favored 'General case' 0 CA--C 1.539 0.548 0 N-CA-C 113.42 0.896 . . . . 0.0 113.42 175.283 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 76.7 mt -73.04 -32.2 64.92 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 124.088 0.955 . . . . 0.0 112.934 179.641 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 37.1 t -68.41 -45.88 81.51 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.752 0 C-N-CA 123.739 0.816 . . . . 0.0 110.739 171.039 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 85.0 m -75.94 -36.07 59.49 Favored 'General case' 0 CA--C 1.535 0.398 0 N-CA-C 113.389 0.885 . . . . 0.0 113.389 -175.575 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 63.64 -134.56 41.39 Favored Glycine 0 CA--C 1.531 1.069 0 C-N-CA 124.433 1.016 . . . . 0.0 111.632 -176.136 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -62.94 -17.59 62.09 Favored 'General case' 0 CA--C 1.543 0.703 0 N-CA-C 114.741 1.385 . . . . 0.0 114.741 179.06 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 84.0 mtm180 -62.96 -32.0 73.23 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 124.418 1.087 . . . . 0.0 113.344 -179.152 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 80.32 -178.9 53.68 Favored Glycine 0 CA--C 1.532 1.148 0 C-N-CA 124.707 1.146 . . . . 0.0 112.431 -171.358 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 51.7 p90 -156.04 164.77 38.02 Favored 'General case' 0 N--CA 1.469 0.493 0 N-CA-C 113.531 0.937 . . . . 0.0 113.531 -172.506 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 40.1 t80 . . . . . 0 CA--C 1.538 0.495 0 C-N-CA 126.139 1.776 . . . . 0.0 109.502 174.5 . . . . . . . . 0 0 . 1 . 045 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 73.0 t . . . . . 0 N--CA 1.482 1.126 0 N-CA-C 112.036 0.384 . . . . 0.0 112.036 . . . . . . . . . 0 0 . 1 . 045 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -84.76 -6.05 59.34 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 125.286 1.434 . . . . 0.0 113.907 179.535 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 64.1 tt0 -106.38 -57.24 2.08 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 124.904 1.282 . . . . 0.0 110.099 -178.891 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 89.7 m -66.22 -28.23 68.59 Favored 'General case' 0 N--CA 1.465 0.322 0 C-N-CA 124.881 1.273 . . . . 0.0 113.931 -178.276 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 8.4 t -80.48 -42.91 21.72 Favored 'General case' 0 CA--C 1.541 0.622 0 O-C-N 121.636 -0.665 . . . . 0.0 110.733 178.526 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 20.1 m -77.02 -33.45 57.46 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 127.386 2.274 . . . . 0.0 112.924 -173.763 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.5 t -146.07 -173.62 4.21 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 124.879 1.272 . . . . 0.0 111.142 -179.305 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 65.0 mt -74.28 134.22 29.98 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.58 0 O-C-N 120.613 -1.304 . . . . 0.0 110.256 175.192 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 8.3 p -128.6 173.1 10.57 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 124.86 1.264 . . . . 0.0 111.142 166.103 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 5.7 m -123.58 149.24 45.54 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 123.728 0.811 . . . . 0.0 110.917 -169.938 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 39.8 mt -59.49 -33.07 70.88 Favored 'General case' 0 N--CA 1.471 0.617 0 O-C-N 120.89 -1.131 . . . . 0.0 111.856 173.345 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 79.9 t80 -60.11 -28.24 67.69 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 124.366 1.066 . . . . 0.0 113.612 171.729 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 58.4 mm-40 -84.32 -36.26 22.7 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 124.131 0.973 . . . . 0.0 110.644 174.402 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 49.7 mt -60.33 -30.93 69.83 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-N 119.723 1.147 . . . . 0.0 112.278 172.13 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -59.26 -27.39 65.76 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 124.376 1.07 . . . . 0.0 113.512 176.18 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 33.3 t30 -65.74 -24.24 66.92 Favored 'General case' 0 CA--C 1.55 0.945 0 O-C-N 121.1 -1.0 . . . . 0.0 113.057 174.129 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 87.6 m-85 -99.7 5.01 45.8 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 126.081 1.752 . . . . 0.0 113.368 -176.154 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 56.5 m . . . . . 0 CA--C 1.544 0.712 0 O-C-N 121.408 -0.807 . . . . 0.0 112.025 163.575 . . . . . . . . 0 0 . 1 . 045 nuclear nobuild core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 30.5 m-20 . . . . . 0 CA--C 1.539 0.547 0 N-CA-C 109.745 -0.465 . . . . 0.0 109.745 . . . . . . . . . 0 0 . 1 . 045 nuclear nobuild core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 44.3 mt-30 -151.51 165.08 35.31 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 124.593 1.157 . . . . 0.0 112.181 -168.564 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 17.5 m-70 -77.07 137.22 38.81 Favored 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 108.631 -0.877 . . . . 0.0 108.631 150.951 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 70.0 mt -146.02 129.26 16.69 Favored 'General case' 0 C--N 1.331 -0.2 0 C-N-CA 125.612 1.565 . . . . 0.0 108.295 -176.565 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 4.2 t -148.67 154.36 39.55 Favored 'General case' 0 N--CA 1.465 0.316 0 C-N-CA 123.238 0.615 . . . . 0.0 111.716 -175.863 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 52.06 -129.46 35.54 Favored Glycine 0 CA--C 1.529 0.923 0 C-N-CA 125.336 1.446 . . . . 0.0 113.056 176.975 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 19.9 m -57.86 -34.62 69.94 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 124.251 1.02 . . . . 0.0 112.737 -179.32 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 75.1 m-70 -75.11 -28.96 60.44 Favored 'General case' 0 CA--C 1.541 0.602 0 O-C-N 121.073 -1.017 . . . . 0.0 113.017 177.797 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 50.1 tp -70.68 -42.63 70.47 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 119.037 0.835 . . . . 0.0 111.058 169.008 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 82.1 t -59.48 -42.45 87.88 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.106 0 CA-C-N 118.477 0.58 . . . . 0.0 111.442 172.548 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -61.83 -48.85 78.72 Favored 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 125.439 1.496 . . . . 0.0 111.843 176.458 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -64.29 -45.26 88.76 Favored 'General case' 0 CA--C 1.54 0.572 0 O-C-N 121.681 -0.637 . . . . 0.0 111.733 179.818 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 45.8 tp -59.76 -46.32 89.52 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 123.868 0.867 . . . . 0.0 110.816 175.994 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 39.1 t80 -58.8 -39.81 82.24 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 123.875 0.87 . . . . 0.0 113.183 172.965 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 68.5 mt -69.59 -31.93 70.37 Favored 'General case' 0 N--CA 1.469 0.516 0 O-C-N 121.482 -0.761 . . . . 0.0 112.952 177.993 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 70.2 t -77.35 -40.04 28.69 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.887 0 C-N-CA 124.238 1.015 . . . . 0.0 111.564 174.693 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 85.4 m -108.34 4.92 25.02 Favored 'General case' 0 N--CA 1.47 0.556 0 N-CA-C 115.246 1.573 . . . . 0.0 115.246 -167.269 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . -60.45 -24.17 61.29 Favored Glycine 0 N--CA 1.478 1.446 0 N-CA-C 116.837 1.495 . . . . 0.0 116.837 -161.469 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -77.06 -27.08 54.22 Favored 'General case' 0 CA--C 1.549 0.94 0 CA-C-N 118.406 1.103 . . . . 0.0 112.834 173.714 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 66.1 mtp180 -100.37 -35.4 9.6 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 126.238 1.815 . . . . 0.0 113.497 -174.695 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 88.88 174.43 46.82 Favored Glycine 0 CA--C 1.533 1.192 0 C-N-CA 124.738 1.161 . . . . 0.0 111.44 -159.953 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 40.4 p90 -151.17 167.76 26.77 Favored 'General case' 0 N--CA 1.475 0.775 0 N-CA-C 114.466 1.284 . . . . 0.0 114.466 -172.37 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 45.1 t80 . . . . . 0 CA--C 1.539 0.547 0 C-N-CA 126.005 1.722 . . . . 0.0 110.401 172.406 . . . . . . . . 0 0 . 1 . 046 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 75.8 t . . . . . 0 N--CA 1.487 1.377 0 N-CA-C 112.981 0.734 . . . . 0.0 112.981 . . . . . . . . . 0 0 . 1 . 046 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 43.3 tt0 -76.98 -50.77 12.42 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-N 118.171 0.441 . . . . 0.0 110.131 169.621 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 61.2 tt0 -61.37 -40.48 94.49 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 113.483 0.92 . . . . 0.0 113.483 -169.587 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 7.5 m -64.99 -23.16 67.14 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 113.634 0.976 . . . . 0.0 113.634 174.388 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 26.6 t -94.03 -39.8 10.43 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 124.12 0.968 . . . . 0.0 112.811 -177.544 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 73.2 p -85.41 -40.7 16.15 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 124.856 1.262 . . . . 0.0 112.57 179.116 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 47.8 m -105.32 -170.23 1.72 Allowed 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 125.597 1.559 . . . . 0.0 110.152 170.515 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 11.7 tt -103.43 146.86 10.52 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.8 0 C-N-CA 124.979 1.312 . . . . 0.0 110.025 175.971 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 14.2 p -142.04 162.04 36.47 Favored 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 113.613 0.968 . . . . 0.0 113.613 -178.304 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 19.4 m -112.96 150.1 32.34 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 124.386 1.075 . . . . 0.0 111.994 -170.234 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 28.2 mt -61.1 -33.37 73.25 Favored 'General case' 0 N--CA 1.473 0.713 0 O-C-N 121.275 -0.891 . . . . 0.0 111.858 177.461 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 57.5 m-85 -62.03 -31.85 72.28 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 124.538 1.135 . . . . 0.0 113.082 173.121 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 22.6 mm100 -81.81 -31.18 31.89 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 124.407 1.083 . . . . 0.0 111.684 174.021 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 53.7 mt -62.07 -38.76 90.03 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-N 119.644 1.111 . . . . 0.0 111.397 168.472 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 28.7 tt0 -61.3 -26.02 67.51 Favored 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 113.45 0.907 . . . . 0.0 113.45 -179.396 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 16.1 t-20 -59.72 -22.96 62.76 Favored 'General case' 0 CA--C 1.551 1.015 0 O-C-N 121.156 -0.965 . . . . 0.0 113.547 173.004 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 96.2 m-85 -97.61 1.22 48.52 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 125.61 1.564 . . . . 0.0 114.033 179.574 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 59.6 m . . . . . 0 CA--C 1.543 0.706 0 O-C-N 121.144 -0.973 . . . . 0.0 111.962 168.402 . . . . . . . . 0 0 . 1 . 046 nuclear nobuild core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 10.1 p30 . . . . . 0 CA--C 1.541 0.6 0 CA-C-O 120.677 0.275 . . . . 0.0 111.712 . . . . . . . . . 0 0 . 1 . 046 nuclear nobuild core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 34.3 mm-40 -150.89 162.12 41.39 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 124.282 1.033 . . . . 0.0 112.32 -162.28 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 98.1 m-70 -85.91 130.07 34.65 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 123.612 0.765 . . . . 0.0 109.046 164.185 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 90.3 mt -142.83 128.51 19.23 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 125.16 1.384 . . . . 0.0 109.445 -172.112 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 62.7 m -131.62 143.2 50.15 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 124.932 1.293 . . . . 0.0 111.046 -176.246 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 54.51 -127.44 39.83 Favored Glycine 0 N--CA 1.475 1.287 0 C-N-CA 124.846 1.212 . . . . 0.0 114.363 165.275 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 20.3 m -61.09 -33.67 73.72 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 124.152 0.981 . . . . 0.0 112.223 -177.749 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 27.2 m170 -70.93 -37.6 72.89 Favored 'General case' 0 CA--C 1.544 0.716 0 O-C-N 121.353 -0.842 . . . . 0.0 111.391 177.83 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 54.7 tp -66.38 -45.78 78.9 Favored 'General case' 0 N--CA 1.466 0.339 0 C-N-CA 123.697 0.799 . . . . 0.0 111.543 171.398 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 62.4 t -63.0 -36.44 75.8 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.785 0 C-N-CA 123.121 0.569 . . . . 0.0 111.465 177.421 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -66.14 -47.34 74.4 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 123.924 0.89 . . . . 0.0 112.046 172.278 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.47 -46.14 89.63 Favored 'General case' 0 CA--C 1.538 0.505 0 O-C-N 121.554 -0.716 . . . . 0.0 111.754 177.007 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 50.8 tp -58.5 -49.93 75.6 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 124.849 1.26 . . . . 0.0 110.997 174.828 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 52.1 t80 -56.17 -41.04 74.85 Favored 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 113.11 0.782 . . . . 0.0 113.11 174.329 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 80.1 mt -72.24 -35.51 68.85 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 123.91 0.884 . . . . 0.0 112.818 179.083 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 37.8 t -64.01 -46.14 94.73 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.912 0 C-N-CA 123.793 0.837 . . . . 0.0 110.827 171.333 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 81.5 m -78.18 -30.96 49.33 Favored 'General case' 0 N--CA 1.469 0.493 0 N-CA-C 113.437 0.902 . . . . 0.0 113.437 -175.743 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 63.92 -137.76 41.53 Favored Glycine 0 CA--C 1.531 1.057 0 C-N-CA 123.843 0.735 . . . . 0.0 111.417 -174.924 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 28.2 tt0 -67.71 -15.22 63.53 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 124.428 1.091 . . . . 0.0 113.907 -178.573 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 81.7 mtm180 -57.69 -41.11 80.96 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 124.126 0.971 . . . . 0.0 112.574 178.441 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 81.71 -178.29 53.75 Favored Glycine 0 CA--C 1.532 1.108 0 C-N-CA 124.133 0.873 . . . . 0.0 112.1 -168.591 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 52.5 p90 -159.71 167.68 27.76 Favored 'General case' 0 CA--C 1.539 0.548 0 N-CA-C 113.76 1.022 . . . . 0.0 113.76 -167.258 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 86.3 t80 . . . . . 0 CA--C 1.541 0.598 0 C-N-CA 126.134 1.773 . . . . 0.0 109.76 166.672 . . . . . . . . 0 0 . 1 . 047 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 44.2 t . . . . . 0 N--CA 1.487 1.385 0 N-CA-C 112.87 0.692 . . . . 0.0 112.87 . . . . . . . . . 0 0 . 1 . 047 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -84.17 -32.04 24.83 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 123.395 0.678 . . . . 0.0 111.465 177.969 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 63.9 tt0 -65.88 -40.21 91.39 Favored 'General case' 0 CA--C 1.537 0.446 0 O-C-N 121.516 -0.74 . . . . 0.0 112.091 179.666 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 13.2 t -77.03 -15.95 59.45 Favored 'General case' 0 CA--C 1.539 0.543 0 N-CA-C 113.405 0.891 . . . . 0.0 113.405 174.872 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 33.8 t -82.14 -40.1 22.33 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 124.715 1.206 . . . . 0.0 112.123 174.128 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 25.8 p -85.84 -49.37 7.95 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 125.991 1.716 . . . . 0.0 112.047 179.817 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 63.3 m -97.73 -139.05 0.29 Allowed 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 125.586 1.555 . . . . 0.0 109.673 166.308 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 32.8 pt -136.06 161.15 38.24 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.783 0 C-N-CA 125.558 1.543 . . . . 0.0 111.643 -177.705 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 14.9 p -154.71 159.18 40.54 Favored 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 124.758 1.223 . . . . 0.0 112.08 170.576 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 2.3 t -106.01 165.58 11.11 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 124.104 0.962 . . . . 0.0 111.938 177.193 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.541 HD22 ' H ' ' A' ' 13' ' ' LEU . 2.0 mm? -59.99 -32.44 70.86 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.958 1.303 . . . . 0.0 111.422 178.161 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 80.3 t80 -63.79 -26.61 68.71 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 124.56 1.144 . . . . 0.0 113.425 172.838 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 72.9 mt-30 -87.82 -31.7 19.43 Favored 'General case' 0 N--CA 1.467 0.386 0 C-N-CA 124.511 1.124 . . . . 0.0 111.17 175.518 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 70.9 mt -59.6 -38.41 81.2 Favored 'General case' 0 N--CA 1.472 0.656 0 CA-C-N 119.322 0.964 . . . . 0.0 111.171 166.018 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 27.2 tt0 -58.1 -25.83 61.83 Favored 'General case' 0 CA--C 1.548 0.885 0 N-CA-C 113.85 1.055 . . . . 0.0 113.85 179.424 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 32.0 t30 -60.78 -26.27 67.13 Favored 'General case' 0 CA--C 1.547 0.86 0 O-C-N 121.024 -1.047 . . . . 0.0 113.205 174.081 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 92.8 m-85 -100.08 5.17 44.97 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 125.75 1.62 . . . . 0.0 114.285 -175.348 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 68.8 m . . . . . 0 N--CA 1.473 0.7 0 N-CA-C 113.583 0.957 . . . . 0.0 113.583 167.818 . . . . . . . . 0 0 . 1 . 047 nuclear nobuild core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . 0.279 0.5 OUTLIER . . . . . 0 N--CA 1.473 0.714 0 N-CA-C 116.259 1.948 . . . . 0.0 116.259 . . . . . . . . . 2 2 . 1 . 047 nuclear nobuild core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 71.3 mm-40 -123.31 168.6 12.28 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 125.242 1.417 . . . . 0.0 111.394 -168.446 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 98.4 m-70 -82.9 125.76 31.73 Favored 'General case' 0 CA--C 1.537 0.462 0 O-C-N 121.296 -0.878 . . . . 0.0 108.667 165.804 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 93.7 mt -142.62 137.08 29.76 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 125.255 1.422 . . . . 0.0 108.118 -179.668 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 4.5 t -143.68 151.83 40.57 Favored 'General case' 0 N--CA 1.466 0.374 0 N-CA-C 112.836 0.68 . . . . 0.0 112.836 -171.797 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 46.14 -128.66 10.13 Favored Glycine 0 CA--C 1.529 0.915 0 C-N-CA 125.985 1.755 . . . . 0.0 114.377 170.378 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 20.0 m -59.48 -33.12 70.93 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 124.777 1.231 . . . . 0.0 112.549 -178.619 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 97.4 m-70 -71.48 -39.81 70.63 Favored 'General case' 0 CA--C 1.541 0.605 0 O-C-N 121.088 -1.008 . . . . 0.0 111.472 178.555 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 8.2 tt -65.57 -44.35 87.0 Favored 'General case' 0 N--CA 1.466 0.329 0 C-N-CA 123.171 0.588 . . . . 0.0 111.003 170.8 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 53.3 t -64.31 -34.34 68.54 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.964 0 CA-C-N 118.406 0.548 . . . . 0.0 111.758 179.012 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -67.53 -48.09 68.02 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 123.95 0.9 . . . . 0.0 111.562 171.864 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -58.99 -44.8 91.65 Favored 'General case' 0 CA--C 1.542 0.668 0 O-C-N 121.736 -0.602 . . . . 0.0 111.775 176.141 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 61.4 tp -56.41 -52.5 64.42 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 125.603 1.561 . . . . 0.0 110.753 173.825 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 48.7 t80 -56.14 -39.78 72.82 Favored 'General case' 0 CA--C 1.543 0.69 0 N-CA-C 113.334 0.864 . . . . 0.0 113.334 174.715 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 82.7 mt -72.75 -32.53 65.72 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 123.87 0.868 . . . . 0.0 113.071 178.613 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 34.2 t -67.76 -44.56 85.64 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.995 0 C-N-CA 124.651 1.18 . . . . 0.0 110.594 171.736 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 62.4 m -83.31 -30.23 27.7 Favored 'General case' 0 N--CA 1.471 0.576 0 N-CA-C 114.375 1.25 . . . . 0.0 114.375 -173.888 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 65.32 -151.29 51.68 Favored Glycine 0 CA--C 1.533 1.203 0 C-N-CA 124.464 1.03 . . . . 0.0 112.355 -173.004 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -61.48 -13.65 22.58 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 125.535 1.534 . . . . 0.0 114.246 -178.286 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 59.1 ttm-85 -63.2 -25.43 68.33 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 125.022 1.329 . . . . 0.0 113.013 175.135 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 78.32 -171.63 55.15 Favored Glycine 0 N--CA 1.471 0.992 0 C-N-CA 124.582 1.087 . . . . 0.0 113.036 -178.785 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 50.3 p90 -162.0 166.67 25.68 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 125.028 1.331 . . . . 0.0 113.143 -170.544 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 83.9 t80 . . . . . 0 CA--C 1.538 0.511 0 C-N-CA 125.63 1.572 . . . . 0.0 109.766 167.81 . . . . . . . . 0 0 . 1 . 048 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 78.1 t . . . . . 0 N--CA 1.485 1.293 0 N-CA-C 111.86 0.319 . . . . 0.0 111.86 . . . . . . . . . 0 0 . 1 . 048 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 -79.09 -56.89 4.04 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 123.267 0.627 . . . . 0.0 109.957 169.632 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 23.0 tt0 -67.28 -40.3 86.12 Favored 'General case' 0 N--CA 1.467 0.409 0 N-CA-C 112.823 0.675 . . . . 0.0 112.823 -164.483 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 64.5 m -66.81 -24.08 66.12 Favored 'General case' 0 CA--C 1.534 0.334 0 N-CA-C 113.666 0.987 . . . . 0.0 113.666 178.635 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 33.3 t -98.66 -37.5 9.48 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 124.015 0.926 . . . . 0.0 112.76 -175.376 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 76.8 p -88.63 -33.51 17.6 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 125.077 1.351 . . . . 0.0 113.108 178.978 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 49.0 m -117.39 -168.45 1.49 Allowed 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 125.883 1.673 . . . . 0.0 109.85 170.446 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 12.0 tt -96.66 148.07 5.73 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.659 0 O-C-N 120.834 -1.166 . . . . 0.0 109.821 171.034 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 11.0 p -138.83 166.79 23.51 Favored 'General case' 0 N--CA 1.475 0.785 0 O-C-N 121.251 -0.906 . . . . 0.0 112.828 177.714 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 22.7 t -108.99 157.89 18.23 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-O 121.786 0.803 . . . . 0.0 112.936 -177.927 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 44.4 mt -60.86 -31.12 70.59 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 123.572 0.749 . . . . 0.0 111.44 169.437 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 85.1 t80 -62.96 -28.99 70.46 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.31 1.044 . . . . 0.0 113.223 172.439 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 64.9 mt-30 -80.28 -38.18 31.31 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 123.494 0.718 . . . . 0.0 110.702 174.164 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 42.1 mt -60.49 -37.24 80.44 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-N 118.639 0.654 . . . . 0.0 112.016 170.75 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -61.31 -30.62 70.61 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 124.329 1.052 . . . . 0.0 112.923 178.881 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 14.5 t-20 -65.14 -20.75 66.61 Favored 'General case' 0 CA--C 1.55 0.963 0 O-C-N 121.461 -0.774 . . . . 0.0 112.931 177.134 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 45.4 m-85 -98.91 0.89 45.03 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 125.699 1.599 . . . . 0.0 113.74 179.964 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 60.3 m . . . . . 0 CA--C 1.544 0.747 0 O-C-N 120.942 -1.099 . . . . 0.0 112.872 172.829 . . . . . . . . 0 0 . 1 . 048 nuclear nobuild core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 8.5 p30 . . . . . 0 CA--C 1.542 0.646 0 N-CA-C 112.516 0.561 . . . . 0.0 112.516 . . . . . . . . . 0 0 . 1 . 048 nuclear nobuild core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 54.0 mm-40 -153.42 161.18 42.55 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 125.412 1.485 . . . . 0.0 111.228 -164.985 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 92.9 m-70 -87.93 129.56 35.2 Favored 'General case' 0 CA--C 1.539 0.55 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 159.871 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 87.3 mt -142.96 123.47 13.98 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 125.304 1.442 . . . . 0.0 109.895 -172.952 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 68.5 m -127.87 142.39 51.29 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 125.449 1.499 . . . . 0.0 110.177 178.164 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 51.78 -117.03 5.46 Favored Glycine 0 N--CA 1.472 1.041 0 C-N-CA 125.221 1.391 . . . . 0.0 113.941 167.031 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 20.2 t -60.05 -37.38 79.66 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 123.769 0.828 . . . . 0.0 112.266 -178.65 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 92.6 m-70 -68.0 -40.37 83.03 Favored 'General case' 0 CA--C 1.541 0.605 0 O-C-N 120.975 -1.078 . . . . 0.0 111.4 177.21 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 52.5 tp -64.4 -46.03 85.03 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 123.763 0.825 . . . . 0.0 110.949 174.09 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 33.1 t -61.05 -38.91 80.6 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.797 0 C-N-CA 124.453 1.101 . . . . 0.0 111.988 176.475 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -64.97 -48.04 75.46 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 123.45 0.7 . . . . 0.0 111.094 174.61 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.17 -43.38 98.96 Favored 'General case' 0 CA--C 1.542 0.646 0 O-C-N 121.638 -0.664 . . . . 0.0 112.116 178.246 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 19.1 mt -56.31 -48.76 76.02 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 124.162 0.985 . . . . 0.0 111.302 172.707 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 64.1 t80 -64.91 -30.71 71.72 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 119.207 0.912 . . . . 0.0 113.095 176.845 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 73.8 mt -72.52 -36.17 68.27 Favored 'General case' 0 N--CA 1.471 0.578 0 O-C-N 121.091 -1.006 . . . . 0.0 112.981 174.799 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 73.3 t -77.14 -39.12 28.52 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.004 0 C-N-CA 123.851 0.86 . . . . 0.0 111.715 176.351 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 66.6 m -111.27 -4.3 15.01 Favored 'General case' 0 N--CA 1.476 0.843 0 N-CA-C 114.993 1.479 . . . . 0.0 114.993 -167.459 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . -74.04 145.67 35.32 Favored Glycine 0 CA--C 1.535 1.325 0 O-C-N 120.776 -1.203 . . . . 0.0 112.258 -177.246 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -86.39 -0.13 55.28 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 128.041 2.537 . . . . 0.0 113.608 0.326 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 35.7 mtp180 -63.32 -34.84 78.56 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 125.044 1.338 . . . . 0.0 113.407 -173.641 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 93.74 -179.48 38.53 Favored Glycine 0 N--CA 1.472 1.094 0 C-N-CA 125.097 1.332 . . . . 0.0 113.437 178.895 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 39.8 p90 -150.97 161.82 42.01 Favored 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 114.012 1.116 . . . . 0.0 114.012 -169.311 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 47.0 m-85 . . . . . 0 CA--C 1.548 0.874 0 C-N-CA 126.684 1.994 . . . . 0.0 113.123 -172.346 . . . . . . . . 0 0 . 1 . 049 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 41.8 t . . . . . 0 N--CA 1.482 1.132 0 N-CA-C 112.443 0.535 . . . . 0.0 112.443 . . . . . . . . . 0 0 . 1 . 049 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -89.71 -49.14 6.82 Favored 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 123.263 0.625 . . . . 0.0 110.376 169.408 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 65.3 tt0 -66.45 -40.49 89.44 Favored 'General case' 0 N--CA 1.464 0.234 0 C-N-CA 124.6 1.16 . . . . 0.0 113.013 -168.013 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 4.3 t -82.08 -15.29 53.99 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 119.096 0.862 . . . . 0.0 112.688 -178.526 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 49.1 t -92.16 -40.71 10.86 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 124.6 1.16 . . . . 0.0 112.363 178.423 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 63.0 p -84.01 -44.67 13.91 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 124.996 1.318 . . . . 0.0 112.007 177.6 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 50.5 m -106.85 -141.73 0.37 Allowed 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 125.473 1.509 . . . . 0.0 109.529 167.028 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 45.0 pt -127.02 165.64 25.24 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.667 0 C-N-CA 125.078 1.351 . . . . 0.0 111.396 179.77 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 16.1 p -147.09 160.61 42.2 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 123.886 0.874 . . . . 0.0 112.543 168.286 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 25.4 t -95.97 160.05 14.66 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 124.826 1.25 . . . . 0.0 112.451 176.802 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 52.7 mt -60.6 -34.57 74.41 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 124.07 0.948 . . . . 0.0 111.101 171.089 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 82.6 t80 -62.63 -26.72 68.77 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 124.596 1.158 . . . . 0.0 113.091 173.197 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 83.0 mt-30 -86.46 -38.01 17.73 Favored 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 123.887 0.875 . . . . 0.0 110.856 175.524 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 79.6 mt -56.64 -36.66 69.76 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-N 119.315 0.961 . . . . 0.0 111.893 170.821 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 30.1 tt0 -57.11 -25.76 59.35 Favored 'General case' 0 CA--C 1.547 0.84 0 N-CA-C 113.618 0.97 . . . . 0.0 113.618 177.908 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 14.5 t-20 -65.65 -24.29 66.99 Favored 'General case' 0 CA--C 1.548 0.895 0 O-C-N 120.947 -1.095 . . . . 0.0 113.319 176.018 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 89.7 m-85 -95.91 -0.32 51.02 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 126.001 1.72 . . . . 0.0 113.369 -177.268 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 60.1 m . . . . . 0 CA--C 1.544 0.723 0 C-N-CA 124.147 0.979 . . . . 0.0 113.127 170.073 . . . . . . . . 0 0 . 1 . 049 nuclear nobuild core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 1.7 p-10 . . . . . 0 CA--C 1.536 0.41 0 CA-C-O 120.649 0.261 . . . . 0.0 111.697 . . . . . . . . . 0 0 . 1 . 049 nuclear nobuild core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 38.6 mt-30 -148.96 163.19 38.22 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 123.858 0.863 . . . . 0.0 111.987 -161.69 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 97.9 m-70 -82.7 131.6 35.2 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 108.914 -0.772 . . . . 0.0 108.914 156.282 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 86.7 mt -145.41 129.02 17.11 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 125.263 1.425 . . . . 0.0 110.042 -178.647 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 68.8 m -130.61 142.3 50.45 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 125.614 1.565 . . . . 0.0 110.099 179.744 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 52.33 -121.05 12.8 Favored Glycine 0 N--CA 1.47 0.929 0 C-N-CA 124.704 1.145 . . . . 0.0 114.087 166.588 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 21.5 m -59.53 -33.49 71.45 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 124.222 1.009 . . . . 0.0 112.558 -178.214 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 94.7 m-70 -71.06 -39.13 72.41 Favored 'General case' 0 CA--C 1.538 0.494 0 O-C-N 121.421 -0.799 . . . . 0.0 111.441 176.768 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 48.1 tp -66.16 -42.53 88.87 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 123.653 0.781 . . . . 0.0 111.235 173.569 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 54.7 t -60.31 -45.0 97.01 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.888 0 C-N-CA 123.784 0.833 . . . . 0.0 111.471 173.714 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -62.67 -46.92 85.95 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 123.869 0.867 . . . . 0.0 111.313 178.074 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.66 -46.66 87.16 Favored 'General case' 0 CA--C 1.54 0.56 0 O-C-N 121.674 -0.641 . . . . 0.0 111.778 178.733 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 49.6 tp -59.6 -49.29 78.33 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 123.94 0.896 . . . . 0.0 111.091 177.526 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 53.9 t80 -52.46 -44.91 65.85 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 123.813 0.845 . . . . 0.0 112.902 173.403 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 82.3 mt -70.57 -32.49 69.91 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 123.813 0.845 . . . . 0.0 113.05 179.896 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 42.2 t -69.51 -43.12 80.87 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.814 0 C-N-CA 124.264 1.026 . . . . 0.0 111.238 172.5 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 64.7 m -83.23 -26.38 30.83 Favored 'General case' 0 N--CA 1.469 0.51 0 N-CA-C 114.392 1.256 . . . . 0.0 114.392 -173.987 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 63.29 -134.73 42.47 Favored Glycine 0 CA--C 1.532 1.108 0 C-N-CA 124.283 0.944 . . . . 0.0 112.252 -177.912 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 32.4 mm-40 -66.92 -15.21 63.52 Favored 'General case' 0 CA--C 1.545 0.762 0 N-CA-C 114.06 1.133 . . . . 0.0 114.06 -176.913 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 86.3 mtt-85 -61.25 -41.73 97.41 Favored 'General case' 0 N--CA 1.473 0.712 0 N-CA-C 113.571 0.952 . . . . 0.0 113.571 -178.768 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 79.0 -175.48 55.09 Favored Glycine 0 CA--C 1.534 1.28 0 C-N-CA 123.248 0.452 . . . . 0.0 111.997 -160.697 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 33.9 p90 -160.46 165.79 30.35 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 124.662 1.185 . . . . 0.0 113.18 -166.452 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 50.2 m-85 . . . . . 0 CA--C 1.542 0.635 0 C-N-CA 125.403 1.481 . . . . 0.0 113.336 -177.108 . . . . . . . . 0 0 . 1 . 050 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 85.3 t . . . . . 0 N--CA 1.479 1.009 0 CA-C-O 119.451 -0.309 . . . . 0.0 111.693 . . . . . . . . . 0 0 . 1 . 050 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 21.0 mm-40 -74.61 -46.24 39.79 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-N 118.315 0.507 . . . . 0.0 111.015 173.117 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild core ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 73.4 tp60 -59.48 -44.8 92.97 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 123.662 0.785 . . . . 0.0 111.653 -178.673 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 62.5 m -70.44 -25.92 63.42 Favored 'General case' 0 N--CA 1.466 0.366 0 N-CA-C 114.758 1.392 . . . . 0.0 114.758 179.715 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 17.3 t -106.74 -36.61 6.65 Favored 'General case' 0 CA--C 1.541 0.611 0 N-CA-C 113.701 1.001 . . . . 0.0 113.701 -168.937 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 46.7 p -85.43 -33.02 22.02 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 124.637 1.175 . . . . 0.0 112.055 175.51 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 65.6 m -121.42 -161.62 0.92 Allowed 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 126.68 1.992 . . . . 0.0 109.63 171.303 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 48.4 pt -97.06 157.9 3.26 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.518 0 O-C-N 121.203 -0.935 . . . . 0.0 111.243 168.038 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 21.4 p -137.55 163.83 30.23 Favored 'General case' 0 N--CA 1.466 0.359 0 C-N-CA 124.235 1.014 . . . . 0.0 111.498 170.431 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 32.2 m -104.86 149.18 25.89 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 123.932 0.893 . . . . 0.0 111.215 -177.353 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 56.3 mt -58.71 -32.12 68.89 Favored 'General case' 0 N--CA 1.471 0.611 0 O-C-N 121.358 -0.839 . . . . 0.0 111.686 174.876 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 72.7 t80 -62.22 -27.98 69.37 Favored 'General case' 0 CA--C 1.542 0.646 0 N-CA-C 113.817 1.043 . . . . 0.0 113.817 171.649 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 20.9 mm100 -83.5 -34.2 25.39 Favored 'General case' 0 N--CA 1.465 0.301 0 C-N-CA 124.124 0.97 . . . . 0.0 111.088 175.911 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 10.9 mp -56.1 -49.14 74.68 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-N 118.692 0.678 . . . . 0.0 110.385 165.961 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 4.0 tm-20 -61.99 -39.65 92.93 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 124.898 1.279 . . . . 0.0 112.39 178.694 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 21.6 t30 -64.93 -35.12 80.15 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 123.989 0.916 . . . . 0.0 113.239 175.605 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -74.37 -20.86 59.92 Favored 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 114.116 1.154 . . . . 0.0 114.116 178.969 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 77.2 m . . . . . 0 CA--C 1.54 0.596 0 N-CA-C 114.407 1.262 . . . . 0.0 114.407 178.13 . . . . . . . . 0 0 . 1 . 050 nuclear nobuild core ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.536 0.432 0 N-CA-C 112.345 0.498 . . . . 0.0 112.345 . . . . . . . . . 1 1 . 1 . 050 nuclear nobuild core ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 27.7 mm-40 -148.88 164.22 35.14 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 124.968 1.307 . . . . 0.0 111.19 -165.438 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild core ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 94.7 m-70 -85.59 132.17 34.22 Favored 'General case' 0 CA--C 1.538 0.516 0 N-CA-C 108.991 -0.744 . . . . 0.0 108.991 155.407 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 97.3 mt -144.55 130.6 19.44 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 125.706 1.603 . . . . 0.0 109.154 -178.216 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild core ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 86.0 m -137.67 147.51 44.94 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 125.06 1.344 . . . . 0.0 110.389 -176.436 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild core ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 55.66 -131.53 49.43 Favored Glycine 0 N--CA 1.472 1.052 0 C-N-CA 124.278 0.942 . . . . 0.0 113.658 166.178 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild core ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 21.1 m -61.28 -31.07 70.89 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 124.603 1.161 . . . . 0.0 112.524 -178.415 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild core ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 94.2 m-70 -70.09 -39.33 75.62 Favored 'General case' 0 CA--C 1.539 0.547 0 O-C-N 121.365 -0.835 . . . . 0.0 111.359 176.854 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 51.4 tp -65.94 -44.4 85.19 Favored 'General case' 0 C--N 1.343 0.317 0 CA-C-O 118.594 -0.717 . . . . 0.0 111.043 170.964 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild core ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 71.3 t -57.96 -44.94 87.8 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.102 0 CA-C-N 118.884 0.766 . . . . 0.0 111.624 176.171 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -63.55 -47.58 80.98 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 123.702 0.801 . . . . 0.0 111.248 177.664 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild core ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.71 -48.44 81.78 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 123.3 0.64 . . . . 0.0 111.409 178.524 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 50.1 tp -58.49 -47.41 84.17 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 125.683 1.593 . . . . 0.0 111.622 179.24 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild core ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 82.0 t80 -59.16 -42.18 90.15 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 123.948 0.899 . . . . 0.0 113.2 174.032 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 89.4 mt -75.89 -33.04 59.93 Favored 'General case' 0 N--CA 1.471 0.614 0 N-CA-C 113.191 0.812 . . . . 0.0 113.191 -179.743 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild core ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 23.7 t -65.38 -45.54 92.86 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.734 0 C-N-CA 124.619 1.168 . . . . 0.0 110.598 173.792 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild core ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 71.5 m -90.72 -27.36 19.01 Favored 'General case' 0 N--CA 1.47 0.542 0 N-CA-C 114.349 1.241 . . . . 0.0 114.349 -172.467 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild core ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . -53.31 133.68 42.14 Favored Glycine 0 CA--C 1.536 1.379 0 C-N-CA 124.193 0.902 . . . . 0.0 112.851 -171.977 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -77.71 -11.48 59.88 Favored 'General case' 0 CA--C 1.551 0.996 0 C-N-CA 128.501 2.72 . . . . 0.0 115.006 10.843 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 55.0 ttp85 -65.67 140.9 58.52 Favored 'General case' 0 N--CA 1.473 0.708 0 O-C-N 120.826 -1.171 . . . . 0.0 111.87 178.669 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild core ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . -80.94 151.01 31.38 Favored Glycine 0 N--CA 1.47 0.931 0 C-N-CA 125.342 1.449 . . . . 0.0 112.648 -173.877 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild core ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 45.3 p90 -105.83 166.92 10.13 Favored 'General case' 0 CA--C 1.536 0.439 0 N-CA-C 114.57 1.322 . . . . 0.0 114.57 -173.393 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild core ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 45.1 t80 . . . . . 0 CA--C 1.537 0.477 0 C-N-CA 126.35 1.86 . . . . 0.0 109.206 171.553 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.563 0 N-CA-C 111.247 -0.741 . . . . 0.0 111.247 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 49.6 pt -68.92 -25.07 29.29 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.989 0 O-C-N 121.052 -1.264 . . . . 0.0 114.195 -170.317 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 44.6 t -61.47 -21.36 25.07 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.119 0 CA-C-N 119.229 0.922 . . . . 0.0 112.315 171.449 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -95.19 -52.95 3.97 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-N 119.478 1.035 . . . . 0.0 111.702 164.399 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 68.9 tp60 -64.18 -33.81 76.65 Favored 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 113.087 0.773 . . . . 0.0 113.087 -169.268 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 98.2 m -85.78 -28.17 24.72 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 119.5 1.045 . . . . 0.0 113.387 176.46 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 45.4 t -97.38 -60.1 1.65 Allowed 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 123.385 0.674 . . . . 0.0 112.65 -171.382 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 35.6 m -73.49 -41.71 62.75 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 125.748 1.619 . . . . 0.0 110.141 -179.157 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.4 t -102.49 -163.39 1.0 Allowed 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 124.045 0.938 . . . . 0.0 111.189 165.328 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 35.0 mt -108.25 145.1 15.73 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.743 0 C-N-CA 125.8 1.64 . . . . 0.0 110.499 175.916 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 10.2 p -133.32 163.83 28.45 Favored 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 112.957 0.725 . . . . 0.0 112.957 169.186 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 65.6 p -101.52 161.97 13.24 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 124.514 1.126 . . . . 0.0 113.703 176.519 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 52.5 mt -62.56 -34.37 76.81 Favored 'General case' 0 CA--C 1.539 0.532 0 O-C-N 121.308 -0.87 . . . . 0.0 111.696 171.0 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 91.2 t80 -63.61 -32.84 74.44 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 124.056 0.942 . . . . 0.0 112.748 173.356 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 91.6 mt-30 -73.62 -39.82 64.25 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-O 118.293 -0.861 . . . . 0.0 111.682 171.673 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 84.7 mt -59.82 -34.08 72.61 Favored 'General case' 0 N--CA 1.476 0.857 0 CA-C-N 119.825 1.193 . . . . 0.0 112.175 173.448 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 26.5 tt0 -60.56 -24.29 65.3 Favored 'General case' 0 CA--C 1.548 0.892 0 N-CA-C 113.326 0.861 . . . . 0.0 113.326 178.854 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 30.7 t30 -65.59 -25.65 67.5 Favored 'General case' 0 CA--C 1.546 0.799 0 O-C-N 121.046 -1.034 . . . . 0.0 113.058 173.837 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 97.0 m-85 -99.11 2.5 46.06 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 125.404 1.482 . . . . 0.0 113.899 -174.515 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 57.6 m -64.8 157.31 28.01 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 123.871 0.868 . . . . 0.0 112.768 165.358 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 25.1 t-20 . . . . . 0 C--O 1.25 1.114 0 C-N-CA 124.723 1.209 . . . . 0.0 113.079 177.765 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 31.1 p90 . . . . . 0 N--CA 1.489 1.477 0 CA-C-O 119.808 -0.139 . . . . 0.0 111.135 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 35.9 m -124.72 169.76 15.69 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.164 0 C-N-CA 125.587 1.555 . . . . 0.0 112.14 178.334 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 2.9 p-10 -142.23 145.11 33.73 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 125.698 1.599 . . . . 0.0 112.548 -179.138 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 30.2 mm-40 -153.79 168.58 25.82 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 125.084 1.354 . . . . 0.0 112.007 -168.147 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 80.0 m-70 -82.61 129.06 34.87 Favored 'General case' 0 CA--C 1.545 0.765 0 N-CA-C 109.241 -0.652 . . . . 0.0 109.241 155.289 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 79.7 mt -142.37 125.19 16.03 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 126.74 2.016 . . . . 0.0 108.977 -177.355 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 79.0 m -132.43 143.98 50.17 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 124.943 1.297 . . . . 0.0 111.392 -174.222 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 55.42 -122.52 26.77 Favored Glycine 0 N--CA 1.474 1.218 0 C-N-CA 124.923 1.249 . . . . 0.0 113.861 168.037 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 22.2 m -61.73 -33.43 74.02 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 123.747 0.819 . . . . 0.0 111.554 -179.644 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 20.9 m80 -72.69 -37.65 67.78 Favored 'General case' 0 CA--C 1.538 0.502 0 O-C-N 121.249 -0.907 . . . . 0.0 111.279 178.826 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 51.9 tp -63.12 -48.37 78.81 Favored 'General case' 0 N--CA 1.467 0.416 0 C-N-CA 124.056 0.943 . . . . 0.0 111.003 170.801 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 55.4 t -63.49 -37.74 80.38 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.87 0 C-N-CA 123.473 0.709 . . . . 0.0 111.946 178.743 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -66.5 -47.77 71.92 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 124.169 0.987 . . . . 0.0 111.839 174.207 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.69 -44.71 96.19 Favored 'General case' 0 CA--C 1.536 0.436 0 O-C-N 121.772 -0.58 . . . . 0.0 111.892 178.077 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 48.6 tp -58.55 -50.88 72.18 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 124.408 1.083 . . . . 0.0 110.858 174.932 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 50.8 t80 -56.92 -39.02 73.69 Favored 'General case' 0 CA--C 1.544 0.725 0 N-CA-C 113.286 0.847 . . . . 0.0 113.286 174.652 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 77.1 mt -71.12 -33.58 70.25 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 123.725 0.81 . . . . 0.0 112.878 177.94 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 42.5 t -68.31 -43.13 84.65 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.967 0 C-N-CA 124.067 0.947 . . . . 0.0 111.093 172.144 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 66.6 m -83.9 -29.31 27.27 Favored 'General case' 0 N--CA 1.471 0.625 0 N-CA-C 114.304 1.224 . . . . 0.0 114.304 -174.063 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 70.47 -159.23 53.63 Favored Glycine 0 CA--C 1.532 1.114 0 C-N-CA 124.653 1.12 . . . . 0.0 112.281 -170.721 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -64.1 -10.63 23.65 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 124.851 1.261 . . . . 0.0 114.185 -179.506 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 23.1 ttp85 -58.26 -31.62 67.6 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 125.287 1.435 . . . . 0.0 112.993 173.105 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 86.29 -176.65 48.59 Favored Glycine 0 CA--C 1.532 1.147 0 C-N-CA 124.412 1.006 . . . . 0.0 114.148 -179.671 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 49.5 p90 -163.91 172.67 13.65 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 124.654 1.181 . . . . 0.0 112.938 -164.091 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 91.5 t80 -150.27 112.98 4.75 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 125.417 1.487 . . . . 0.0 110.048 166.219 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 52.3 p90 -77.54 145.32 37.0 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 123.887 0.875 . . . . 0.0 112.747 176.919 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 24.0 p -93.46 142.11 24.79 Favored Pre-proline 0 C--O 1.24 0.58 0 C-N-CA 124.485 1.114 . . . . 0.0 111.379 173.574 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -74.41 -170.95 0.81 Allowed 'Trans proline' 0 C--N 1.352 0.722 0 C-N-CA 124.795 3.663 . . . . 0.0 111.911 -173.81 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 40.9 ttmt -52.73 -55.29 23.85 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 124.092 0.957 . . . . 0.0 112.141 -176.52 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 29.0 m . . . . . 0 C--O 1.251 1.18 0 C-N-CA 125.668 1.587 . . . . 0.0 110.988 175.896 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.606 0 N-CA-C 112.123 -0.391 . . . . 0.0 112.123 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 49.4 pt -59.83 -31.14 46.71 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.182 0 C-N-CA 124.158 0.983 . . . . 0.0 113.305 -173.368 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . 0.508 HG13 ' H ' ' B' ' 8' ' ' GLY . 78.3 t -59.81 -38.18 74.97 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.907 0 C-N-CA 123.153 0.581 . . . . 0.0 111.454 177.499 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -67.42 -48.57 66.92 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 118.343 0.519 . . . . 0.0 110.222 -178.886 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 22.2 tt0 -61.16 -55.84 27.64 Favored 'General case' 0 N--CA 1.466 0.357 0 C-N-CA 124.775 1.23 . . . . 0.0 111.284 -179.716 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 78.1 m -68.76 -19.76 64.34 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 114.271 1.211 . . . . 0.0 114.271 -175.129 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 17.9 t -90.44 -41.24 11.56 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 124.398 1.079 . . . . 0.0 112.893 176.946 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 1.4 t -79.61 -37.68 35.6 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 123.632 0.773 . . . . 0.0 112.413 179.15 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 10.3 t -107.63 -149.96 0.44 Allowed 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 125.907 1.683 . . . . 0.0 109.637 169.098 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 27.1 pt -123.08 149.35 26.81 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.444 0 C-N-CA 125.61 1.564 . . . . 0.0 111.481 177.092 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 58.2 m -128.18 162.86 25.96 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 125.399 1.48 . . . . 0.0 111.005 172.453 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 99.5 p -114.47 165.29 12.89 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 124.748 1.219 . . . . 0.0 112.698 -178.415 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 61.1 mt -62.0 -33.41 74.27 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 123.245 0.618 . . . . 0.0 111.756 173.522 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 88.7 t80 -67.26 -34.46 77.47 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 123.566 0.746 . . . . 0.0 113.0 172.806 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 38.9 mt-30 -72.19 -38.17 69.14 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-O 118.768 -0.634 . . . . 0.0 111.052 173.321 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 85.9 mt -60.58 -40.82 93.1 Favored 'General case' 0 CA--C 1.538 0.498 0 CA-C-N 119.128 0.877 . . . . 0.0 111.476 169.03 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 25.7 tt0 -65.45 -33.62 76.36 Favored 'General case' 0 CA--C 1.543 0.709 0 CA-C-N 118.517 0.598 . . . . 0.0 112.406 177.844 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 34.3 t30 -65.15 -22.94 66.99 Favored 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 123.755 0.822 . . . . 0.0 113.032 173.228 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 13.9 m-85 -87.41 -6.59 58.38 Favored 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 124.908 1.283 . . . . 0.0 113.636 176.069 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 70.2 m -65.76 159.18 25.74 Favored 'General case' 0 N--CA 1.473 0.71 0 O-C-N 120.914 -1.116 . . . . 0.0 113.518 177.302 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.254 1.304 0 C-N-CA 127.5 2.32 . . . . 0.0 111.808 178.973 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 87.4 m-85 . . . . . 0 N--CA 1.487 1.421 0 CA-C-O 119.735 -0.174 . . . . 0.0 111.027 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 8.2 p -69.67 139.74 19.81 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.918 0 O-C-N 121.742 -0.599 . . . . 0.0 110.785 175.07 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 7.4 m-80 -117.67 146.89 43.39 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 125.602 1.561 . . . . 0.0 111.536 177.909 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 38.3 mt-30 -145.58 158.71 43.81 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 125.565 1.546 . . . . 0.0 110.617 -173.877 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 99.5 m-70 -82.34 130.19 35.04 Favored 'General case' 0 CA--C 1.539 0.535 0 N-CA-C 108.289 -1.004 . . . . 0.0 108.289 158.305 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 85.2 mt -138.02 121.53 17.25 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 124.582 1.153 . . . . 0.0 109.732 -173.8 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 33.5 m -131.22 135.19 47.16 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.741 1.216 . . . . 0.0 110.476 -172.91 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 8' ' ' GLY . . . . . 0.508 ' H ' HG13 ' A' ' 3' ' ' VAL . . . 50.42 -120.7 8.92 Favored Glycine 0 CA--C 1.529 0.914 0 C-N-CA 125.163 1.363 . . . . 0.0 114.526 168.54 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 25.2 p -62.02 -32.52 73.02 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 124.484 1.114 . . . . 0.0 113.063 -179.686 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 94.0 m-70 -68.98 -38.62 79.45 Favored 'General case' 0 CA--C 1.538 0.519 0 O-C-N 121.172 -0.955 . . . . 0.0 111.385 175.269 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 8.7 tt -64.0 -48.98 74.25 Favored 'General case' 0 C--N 1.344 0.355 0 CA-C-O 118.875 -0.583 . . . . 0.0 110.552 171.459 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 53.9 t -59.85 -40.5 82.91 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.994 0 C-N-CA 123.234 0.614 . . . . 0.0 111.841 179.864 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -63.4 -49.9 71.96 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 123.676 0.79 . . . . 0.0 111.807 175.404 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.01 -45.98 91.23 Favored 'General case' 0 CA--C 1.539 0.523 0 O-C-N 121.79 -0.569 . . . . 0.0 111.564 178.957 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 40.4 tp -58.26 -51.53 69.4 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 125.619 1.567 . . . . 0.0 111.395 177.857 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 68.7 t80 -55.44 -42.59 74.41 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 123.762 0.825 . . . . 0.0 112.652 174.454 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 87.7 mt -73.7 -32.19 63.8 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 123.951 0.9 . . . . 0.0 113.179 -179.31 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 34.5 t -69.1 -45.25 80.17 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.885 0 C-N-CA 124.025 0.93 . . . . 0.0 110.341 171.883 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 74.0 m -77.06 -35.39 56.71 Favored 'General case' 0 N--CA 1.468 0.44 0 N-CA-C 113.385 0.883 . . . . 0.0 113.385 -175.181 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 62.58 -129.79 42.61 Favored Glycine 0 CA--C 1.532 1.094 0 C-N-CA 123.982 0.801 . . . . 0.0 111.254 -175.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -66.57 -14.36 62.26 Favored 'General case' 0 CA--C 1.546 0.802 0 N-CA-C 114.073 1.138 . . . . 0.0 114.073 179.344 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 84.5 mtm180 -69.09 -24.64 64.16 Favored 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 113.672 0.989 . . . . 0.0 113.672 -177.457 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 69.09 -175.48 31.86 Favored Glycine 0 N--CA 1.472 1.064 0 C-N-CA 124.027 0.822 . . . . 0.0 112.446 -170.697 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 44.2 p90 -154.11 157.66 39.26 Favored 'General case' 0 CA--C 1.539 0.545 0 N-CA-C 115.187 1.551 . . . . 0.0 115.187 -174.367 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 91.6 t80 -91.98 147.44 22.96 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 126.476 1.911 . . . . 0.0 109.981 161.514 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 26.2 t80 -156.53 141.11 16.85 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 124.523 1.129 . . . . 0.0 112.105 -173.075 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 15.9 p -141.32 122.68 8.97 Favored Pre-proline 0 CA--C 1.54 0.582 0 C-N-CA 125.31 1.444 . . . . 0.0 111.489 178.567 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -83.83 -163.09 0.19 Allowed 'Trans proline' 0 CA--C 1.546 1.087 0 C-N-CA 124.328 3.352 . . . . 0.0 110.455 169.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 24.9 ttmm -66.14 -30.86 71.43 Favored 'General case' 0 CA--C 1.549 0.941 0 O-C-N 121.32 -0.862 . . . . 0.0 113.264 170.365 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 8.7 m . . . . . 0 C--O 1.253 1.279 0 C-N-CA 126.608 1.963 . . . . 0.0 112.937 -176.714 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.617 0 N-CA-C 112.36 -0.296 . . . . 0.0 112.36 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 41.0 pt -64.37 -24.67 36.2 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.127 0 O-C-N 121.103 -1.234 . . . . 0.0 113.45 -177.83 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 70.5 t -58.82 -30.04 41.69 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.016 0 C-N-CA 123.774 0.829 . . . . 0.0 111.781 171.222 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -83.18 -50.23 8.66 Favored 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 123.779 0.832 . . . . 0.0 110.898 171.357 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 31.7 tt0 -64.7 -45.93 84.53 Favored 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 123.6 0.76 . . . . 0.0 112.298 -169.386 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 11.6 m -67.36 -17.89 64.93 Favored 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 113.501 0.926 . . . . 0.0 113.501 175.983 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 28.1 t -95.21 -42.56 8.5 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 124.396 1.078 . . . . 0.0 112.293 -176.506 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 54.3 p -87.2 -33.21 19.42 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 126.002 1.721 . . . . 0.0 112.571 -178.823 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 7.8 t -109.79 -170.25 1.62 Allowed 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 124.805 1.242 . . . . 0.0 110.103 165.797 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 11.8 tt -101.76 147.04 9.01 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.629 0 C-N-CA 125.28 1.432 . . . . 0.0 110.093 173.614 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 16.7 p -140.61 157.91 44.76 Favored 'General case' 0 N--CA 1.474 0.772 0 N-CA-C 112.974 0.731 . . . . 0.0 112.974 176.985 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 83.8 p -104.29 157.57 17.05 Favored 'General case' 0 N--CA 1.469 0.492 0 N-CA-C 114.361 1.245 . . . . 0.0 114.361 -173.916 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 62.5 mt -58.26 -32.53 68.46 Favored 'General case' 0 N--CA 1.47 0.526 0 O-C-N 121.633 -0.667 . . . . 0.0 111.675 173.203 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 84.6 t80 -66.21 -29.68 70.0 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 124.379 1.072 . . . . 0.0 113.685 172.754 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 89.0 mt-30 -81.23 -32.25 33.49 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 124.08 0.952 . . . . 0.0 111.07 174.636 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 8.4 mp -62.88 -42.67 99.85 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 123.437 0.695 . . . . 0.0 111.491 167.75 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 29.4 tt0 -62.64 -25.02 67.91 Favored 'General case' 0 CA--C 1.545 0.766 0 N-CA-C 113.532 0.938 . . . . 0.0 113.532 -177.357 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 24.8 t30 -55.03 -27.51 45.05 Favored 'General case' 0 CA--C 1.547 0.827 0 C-N-CA 124.281 1.032 . . . . 0.0 113.22 173.805 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 97.8 m-85 -97.58 0.87 48.14 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 125.443 1.497 . . . . 0.0 114.487 -176.458 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 65.2 m -66.61 154.69 39.85 Favored 'General case' 0 N--CA 1.474 0.726 0 O-C-N 121.369 -0.832 . . . . 0.0 112.818 174.261 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 20.8 t-20 . . . . . 0 C--O 1.25 1.115 0 C-N-CA 125.747 1.619 . . . . 0.0 112.77 -177.876 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 2.8 p90 . . . . . 0 N--CA 1.485 1.324 0 N-CA-C 111.285 0.106 . . . . 0.0 111.285 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 95.7 t -87.29 145.93 6.94 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.076 0 C-N-CA 125.278 1.431 . . . . 0.0 109.748 176.867 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 52.3 p-10 -131.04 148.68 52.78 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 125.437 1.495 . . . . 0.0 112.975 172.856 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 41.3 mt-30 -151.05 161.34 42.91 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 125.532 1.533 . . . . 0.0 110.845 -167.018 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 98.4 m-70 -89.85 128.72 36.23 Favored 'General case' 0 CA--C 1.54 0.57 0 N-CA-C 109.297 -0.631 . . . . 0.0 109.297 159.691 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 90.8 mt -141.1 126.6 18.82 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 125.246 1.418 . . . . 0.0 109.577 -172.653 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 39.9 m -128.65 135.9 49.93 Favored 'General case' 0 N--CA 1.466 0.334 0 C-N-CA 124.516 1.126 . . . . 0.0 110.967 -175.218 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 49.68 -117.02 4.19 Favored Glycine 0 CA--C 1.529 0.916 0 C-N-CA 125.415 1.484 . . . . 0.0 113.694 168.365 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 22.3 m -59.56 -32.92 70.79 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 124.609 1.164 . . . . 0.0 112.931 -179.389 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 94.0 m-70 -72.26 -37.64 69.04 Favored 'General case' 0 CA--C 1.539 0.547 0 O-C-N 121.23 -0.919 . . . . 0.0 111.423 177.129 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 59.8 tp -67.11 -43.12 83.26 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 123.155 0.582 . . . . 0.0 110.99 171.981 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 40.4 t -60.17 -42.76 91.32 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.907 0 C-N-CA 124.335 1.054 . . . . 0.0 111.915 175.589 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -63.42 -47.31 82.5 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 123.65 0.78 . . . . 0.0 111.337 173.717 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.6 -42.83 99.42 Favored 'General case' 0 CA--C 1.541 0.606 0 O-C-N 121.303 -0.873 . . . . 0.0 112.446 178.439 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 28.7 mt -57.75 -50.56 72.83 Favored 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 124.124 0.969 . . . . 0.0 110.931 174.453 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 80.5 t80 -55.94 -41.16 74.21 Favored 'General case' 0 CA--C 1.541 0.632 0 N-CA-C 112.997 0.74 . . . . 0.0 112.997 175.007 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 88.2 mt -73.8 -35.97 64.97 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 123.834 0.854 . . . . 0.0 113.234 179.73 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 26.1 t -66.96 -44.29 88.67 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.948 0 C-N-CA 124.687 1.195 . . . . 0.0 110.542 173.84 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 71.0 m -77.62 -32.15 53.3 Favored 'General case' 0 CA--C 1.537 0.449 0 N-CA-C 112.803 0.668 . . . . 0.0 112.803 -176.235 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 68.62 -113.88 5.57 Favored Glycine 0 CA--C 1.529 0.926 0 C-N-CA 124.406 1.003 . . . . 0.0 111.814 173.055 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 37.6 mm-40 -71.09 -21.55 62.21 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 123.853 0.861 . . . . 0.0 112.711 174.882 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 83.6 mtm180 -75.18 155.49 36.86 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 124.923 1.289 . . . . 0.0 111.215 174.534 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . -74.89 179.63 44.37 Favored Glycine 0 CA--C 1.53 1.017 0 C-N-CA 124.246 0.927 . . . . 0.0 111.253 168.087 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 32.2 p90 -154.42 171.24 19.65 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 124.416 1.086 . . . . 0.0 112.61 -177.255 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 76.9 t80 -155.63 152.07 28.26 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 125.348 1.459 . . . . 0.0 111.582 178.59 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 36.5 p90 -139.24 140.07 37.61 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 126.243 1.817 . . . . 0.0 111.997 176.926 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 18.3 p -90.73 122.32 67.1 Favored Pre-proline 0 C--O 1.24 0.58 0 C-N-CA 124.234 1.014 . . . . 0.0 109.97 171.002 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_endo -82.34 -174.33 2.06 Favored 'Trans proline' 0 CA--C 1.539 0.74 0 C-N-CA 124.157 3.238 . . . . 0.0 111.386 179.728 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 50.6 tttp -75.44 -21.44 58.15 Favored 'General case' 0 CA--C 1.548 0.885 0 N-CA-C 113.233 0.827 . . . . 0.0 113.233 168.952 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 9.5 m . . . . . 0 C--O 1.254 1.308 0 C-N-CA 126.945 2.098 . . . . 0.0 112.915 -176.971 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.653 0 N-CA-C 111.901 -0.479 . . . . 0.0 111.901 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 2.6 pp -66.3 -28.24 42.96 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.249 0 N-CA-C 113.887 1.069 . . . . 0.0 113.887 -169.45 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 54.8 t -65.48 -45.84 91.64 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.066 0 CA-C-N 118.754 0.707 . . . . 0.0 110.782 171.352 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -62.77 -43.99 97.35 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 118.705 0.684 . . . . 0.0 110.572 178.925 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 16.9 tt0 -56.78 -55.68 31.24 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 123.961 0.904 . . . . 0.0 111.25 175.44 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -80.03 -16.92 54.08 Favored 'General case' 0 CA--C 1.541 0.608 0 N-CA-C 114.558 1.318 . . . . 0.0 114.558 -172.209 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 38.4 t -99.33 -50.47 4.11 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 124.127 0.971 . . . . 0.0 112.513 -176.817 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 29.8 m -78.99 -39.83 33.16 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 124.611 1.164 . . . . 0.0 110.726 -178.059 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 10.5 t -104.24 -154.54 0.51 Allowed 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 124.236 1.014 . . . . 0.0 109.908 159.419 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 29.8 pt -112.4 161.47 11.17 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.651 0 C-N-CA 126.117 1.767 . . . . 0.0 111.595 175.953 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 1.6 p -147.08 169.34 19.46 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 123.457 0.703 . . . . 0.0 112.477 165.015 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 70.5 m -112.32 154.19 26.07 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 124.048 0.939 . . . . 0.0 112.956 -170.104 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 62.2 mt -59.09 -29.95 67.73 Favored 'General case' 0 N--CA 1.468 0.456 0 O-C-N 121.197 -0.94 . . . . 0.0 112.189 176.757 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 79.2 t80 -67.48 -26.37 66.33 Favored 'General case' 0 CA--C 1.545 0.77 0 N-CA-C 113.889 1.07 . . . . 0.0 113.889 171.97 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 59.9 mt-30 -77.85 -40.43 40.23 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 123.517 0.727 . . . . 0.0 109.655 171.719 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 9.2 mp -57.47 -39.93 77.45 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 118.401 0.546 . . . . 0.0 111.459 169.571 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -64.7 -37.35 87.31 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 124.307 1.043 . . . . 0.0 112.34 175.854 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 21.8 t30 -66.76 -27.63 67.75 Favored 'General case' 0 CA--C 1.545 0.762 0 O-C-N 121.213 -0.929 . . . . 0.0 112.732 172.721 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 18.9 m-85 -85.31 -4.02 59.02 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 125.14 1.376 . . . . 0.0 113.638 177.699 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 79.2 m -62.94 147.39 50.57 Favored 'General case' 0 CA--C 1.541 0.619 0 O-C-N 120.8 -1.188 . . . . 0.0 112.718 172.596 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 33.6 t30 . . . . . 0 C--O 1.251 1.145 0 C-N-CA 125.437 1.495 . . . . 0.0 112.329 177.525 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 52.6 m-85 . . . . . 0 N--CA 1.487 1.423 0 CA-C-O 119.528 -0.272 . . . . 0.0 110.98 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 99.0 t -79.91 129.95 36.77 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.941 0 CA-C-N 118.962 0.801 . . . . 0.0 109.239 174.278 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 5.4 p-10 -118.97 145.36 45.87 Favored 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 125.975 1.71 . . . . 0.0 111.618 177.387 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 38.9 mt-30 -149.25 163.63 37.1 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 124.429 1.091 . . . . 0.0 111.045 -171.625 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 96.0 m-70 -88.49 126.38 35.22 Favored 'General case' 0 CA--C 1.542 0.641 0 N-CA-C 107.991 -1.114 . . . . 0.0 107.991 154.411 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 85.1 mt -136.64 129.21 30.38 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 125.383 1.473 . . . . 0.0 109.008 -179.979 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 60.2 m -131.67 137.09 48.17 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 124.434 1.094 . . . . 0.0 110.788 -173.614 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 49.37 -120.23 7.21 Favored Glycine 0 N--CA 1.47 0.935 0 C-N-CA 125.06 1.315 . . . . 0.0 113.897 169.648 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 26.9 m -59.28 -31.3 68.99 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 124.81 1.244 . . . . 0.0 112.668 -178.167 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 96.8 m-70 -73.35 -35.96 66.07 Favored 'General case' 0 CA--C 1.541 0.603 0 O-C-N 121.317 -0.864 . . . . 0.0 111.561 177.697 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 32.9 tp -70.3 -40.8 74.04 Favored 'General case' 0 CA--C 1.536 0.44 0 O-C-N 121.667 -0.646 . . . . 0.0 111.392 171.237 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 56.1 t -58.61 -43.48 87.46 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.159 0 C-N-CA 123.569 0.748 . . . . 0.0 111.546 173.093 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -64.41 -45.92 85.48 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 123.703 0.801 . . . . 0.0 111.572 175.194 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.06 -44.31 96.95 Favored 'General case' 0 CA--C 1.541 0.606 0 O-C-N 121.592 -0.693 . . . . 0.0 112.141 178.438 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 34.5 mt -58.51 -48.13 81.82 Favored 'General case' 0 N--CA 1.464 0.253 0 C-N-CA 124.264 1.025 . . . . 0.0 110.876 174.257 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 90.7 t80 -57.63 -38.9 75.78 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-N 118.821 0.737 . . . . 0.0 112.495 175.465 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 84.6 mt -75.78 -36.75 59.71 Favored 'General case' 0 CA--C 1.538 0.483 0 N-CA-C 113.405 0.891 . . . . 0.0 113.405 179.573 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 55.2 t -70.74 -40.4 76.8 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.007 0 C-N-CA 123.695 0.798 . . . . 0.0 110.954 175.796 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 63.3 m -92.95 -23.81 18.6 Favored 'General case' 0 N--CA 1.471 0.604 0 N-CA-C 114.465 1.283 . . . . 0.0 114.465 -172.911 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 63.15 -142.26 47.25 Favored Glycine 0 CA--C 1.531 1.087 0 C-N-CA 124.118 0.866 . . . . 0.0 112.365 -175.829 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -63.52 -12.9 35.97 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 125.626 1.57 . . . . 0.0 114.46 -177.459 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 75.2 mtp180 -59.57 -38.81 82.13 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 124.28 1.032 . . . . 0.0 113.128 178.752 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 82.1 -179.62 53.19 Favored Glycine 0 CA--C 1.536 1.358 0 C-N-CA 124.484 1.04 . . . . 0.0 112.193 -161.994 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 34.9 p90 -157.74 157.92 34.33 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 124.339 1.056 . . . . 0.0 113.653 -169.945 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 81.5 t80 -79.49 144.61 33.83 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 126.084 1.754 . . . . 0.0 110.84 166.187 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 71.4 t80 -158.07 146.09 18.63 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 125.831 1.653 . . . . 0.0 111.039 -179.726 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 10.0 t -160.95 134.47 4.86 Favored Pre-proline 0 N--CA 1.474 0.746 0 C-N-CA 124.794 1.237 . . . . 0.0 111.584 175.045 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 91.5 Cg_endo -76.78 -26.37 8.24 Favored 'Trans proline' 0 C--N 1.353 0.798 0 C-N-CA 123.576 2.85 . . . . 0.0 113.177 -179.968 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 40.0 tttp -166.35 141.11 4.4 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 124.748 1.219 . . . . 0.0 112.364 -174.539 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 40.2 p . . . . . 0 C--O 1.252 1.222 0 C-N-CA 126.07 1.748 . . . . 0.0 112.802 176.153 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.634 0 N-CA-C 111.639 -0.584 . . . . 0.0 111.639 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 11.2 tp -66.74 -38.34 81.34 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.0 0 CA-C-N 118.758 1.279 . . . . 0.0 112.824 -170.112 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 60.0 t -69.05 -38.5 78.39 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.823 0 CA-C-N 118.561 0.619 . . . . 0.0 111.05 -174.746 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 35.7 mm-40 -71.94 -44.75 63.09 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-O 118.684 -0.674 . . . . 0.0 111.041 173.281 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 5.5 tt0 -59.43 -53.6 56.33 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 119.253 0.933 . . . . 0.0 111.281 -178.914 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 57.2 m -60.17 -27.6 67.24 Favored 'General case' 0 CA--C 1.535 0.395 0 N-CA-C 113.793 1.035 . . . . 0.0 113.793 -177.571 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 24.9 t -102.37 -41.0 6.48 Favored 'General case' 0 CA--C 1.538 0.508 0 N-CA-C 113.622 0.971 . . . . 0.0 113.622 -170.772 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 59.4 p -84.62 -25.55 28.49 Favored 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 124.166 0.986 . . . . 0.0 112.683 176.989 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 79.8 p -126.06 -139.54 0.27 Allowed 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 125.669 1.588 . . . . 0.0 109.194 166.369 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 38.4 pt -123.46 161.4 25.56 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.524 0 C-N-CA 125.017 1.327 . . . . 0.0 110.844 177.184 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 29.0 p -141.54 156.04 45.74 Favored 'General case' 0 C--O 1.237 0.422 0 C-N-CA 123.354 0.662 . . . . 0.0 112.67 172.421 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 58.5 p -96.42 160.55 14.35 Favored 'General case' 0 N--CA 1.467 0.377 0 N-CA-C 113.343 0.868 . . . . 0.0 113.343 -176.314 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 65.7 mt -61.76 -33.38 73.96 Favored 'General case' 0 CA--C 1.539 0.522 0 O-C-N 121.366 -0.834 . . . . 0.0 111.843 173.066 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 89.5 t80 -66.68 -32.12 73.22 Favored 'General case' 0 CA--C 1.543 0.702 0 N-CA-C 113.066 0.765 . . . . 0.0 113.066 172.665 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 80.4 mt-30 -73.12 -37.76 66.55 Favored 'General case' 0 N--CA 1.466 0.352 0 O-C-N 121.442 -0.786 . . . . 0.0 111.186 171.671 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 46.5 mt -60.4 -40.01 89.4 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 119.413 1.006 . . . . 0.0 111.227 169.824 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -63.98 -40.12 95.68 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 124.285 1.034 . . . . 0.0 112.316 176.16 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 18.5 t30 -60.98 -28.57 69.1 Favored 'General case' 0 CA--C 1.548 0.873 0 O-C-N 121.226 -0.921 . . . . 0.0 112.797 174.538 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 22.4 m-85 -92.38 4.15 53.99 Favored 'General case' 0 CA--C 1.547 0.827 0 C-N-CA 125.063 1.345 . . . . 0.0 114.316 177.438 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 83.4 m -68.76 155.28 40.44 Favored 'General case' 0 N--CA 1.471 0.617 0 O-C-N 120.737 -1.227 . . . . 0.0 112.526 166.327 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 95.7 m-20 . . . . . 0 C--O 1.25 1.111 0 C-N-CA 124.133 0.973 . . . . 0.0 112.079 170.503 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 78.1 m-85 . . . . . 0 N--CA 1.487 1.423 0 N-CA-C 111.237 0.088 . . . . 0.0 111.237 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 2.0 t 62.75 27.55 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.535 0 C-N-CA 125.889 1.675 . . . . 0.0 113.018 171.72 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 12.7 m-80 -142.34 149.34 39.32 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 126.9 2.08 . . . . 0.0 111.638 -175.566 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 41.0 mt-30 -147.15 160.35 42.54 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 124.834 1.254 . . . . 0.0 111.283 -178.528 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 92.8 m-70 -79.97 130.1 35.01 Favored 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 108.399 -0.963 . . . . 0.0 108.399 153.139 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 88.4 mt -143.36 126.21 16.17 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 125.213 1.405 . . . . 0.0 109.661 -176.892 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 66.4 m -135.41 144.15 46.36 Favored 'General case' 0 N--CA 1.468 0.428 0 C-N-CA 125.337 1.455 . . . . 0.0 110.35 -178.034 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 55.4 -124.55 33.59 Favored Glycine 0 N--CA 1.473 1.102 0 C-N-CA 124.495 1.045 . . . . 0.0 113.953 165.843 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 22.5 p -59.02 -37.12 76.19 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 124.765 1.226 . . . . 0.0 112.755 179.064 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 26.3 m80 -67.36 -38.77 85.31 Favored 'General case' 0 CA--C 1.54 0.576 0 O-C-N 121.171 -0.956 . . . . 0.0 111.577 177.219 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 51.5 tp -68.92 -43.24 75.54 Favored 'General case' 0 N--CA 1.465 0.325 0 O-C-N 121.667 -0.646 . . . . 0.0 111.388 173.387 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 6.4 t -56.88 -43.74 80.86 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.908 0 C-N-CA 124.463 1.105 . . . . 0.0 111.393 174.369 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 30.2 mm-40 -66.75 -44.56 81.15 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 124.1 0.96 . . . . 0.0 111.979 175.169 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -63.43 -45.1 92.49 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-N 118.969 0.804 . . . . 0.0 112.32 179.652 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 40.8 mt -57.44 -52.33 65.83 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 124.145 0.978 . . . . 0.0 110.408 172.058 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 87.9 t80 -55.8 -38.76 70.38 Favored 'General case' 0 CA--C 1.546 0.813 0 CA-C-N 119.321 0.964 . . . . 0.0 113.268 176.989 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 74.2 mt -72.2 -36.14 69.11 Favored 'General case' 0 N--CA 1.47 0.545 0 N-CA-C 113.224 0.824 . . . . 0.0 113.224 178.085 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 58.3 t -74.01 -38.73 49.93 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.133 0 C-N-CA 123.365 0.666 . . . . 0.0 111.53 175.307 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 60.8 m -90.34 -22.75 21.37 Favored 'General case' 0 N--CA 1.473 0.689 0 N-CA-C 114.666 1.358 . . . . 0.0 114.666 -172.906 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 65.99 -145.2 47.65 Favored Glycine 0 CA--C 1.532 1.129 0 C-N-CA 124.171 0.891 . . . . 0.0 112.202 -173.66 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -67.21 -12.37 59.88 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 124.602 1.161 . . . . 0.0 114.044 -178.642 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 76.2 mtp85 -63.85 -33.87 76.67 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 124.17 0.988 . . . . 0.0 113.235 178.832 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 77.01 -170.42 55.13 Favored Glycine 0 CA--C 1.531 1.033 0 C-N-CA 124.476 1.036 . . . . 0.0 113.096 -170.747 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 45.9 p90 -154.66 170.66 21.02 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 125.079 1.352 . . . . 0.0 112.729 -169.109 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 43.3 p90 -117.93 157.98 25.72 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 125.263 1.425 . . . . 0.0 111.042 169.011 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 49.4 t80 -146.78 63.42 1.19 Allowed 'General case' 0 N--CA 1.475 0.808 0 CA-C-O 121.958 0.885 . . . . 0.0 111.781 -148.478 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 49.1 p -72.35 133.24 83.32 Favored Pre-proline 0 N--CA 1.475 0.82 0 C-N-CA 124.377 1.071 . . . . 0.0 112.356 -172.681 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_endo -79.6 -124.74 0.01 OUTLIER 'Trans proline' 0 C--N 1.355 0.892 0 C-N-CA 125.239 3.96 . . . . 0.0 109.343 176.152 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 19.9 ttpp -71.67 137.87 48.17 Favored 'General case' 0 CA--C 1.545 0.754 0 O-C-N 120.918 -1.114 . . . . 0.0 111.276 173.589 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 26.4 m . . . . . 0 C--O 1.253 1.243 0 C-N-CA 125.203 1.401 . . . . 0.0 111.452 171.494 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.463 0 N-CA-C 112.276 -0.329 . . . . 0.0 112.276 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 46.4 pt -89.11 -31.25 5.38 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.115 0 N-CA-C 113.842 1.053 . . . . 0.0 113.842 -176.594 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 38.3 t -59.04 -38.24 72.73 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.067 0 CA-C-N 119.409 1.004 . . . . 0.0 111.793 -176.401 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -68.72 -8.65 44.71 Favored 'General case' 0 CA--C 1.545 0.764 0 N-CA-C 114.5 1.296 . . . . 0.0 114.5 178.379 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 71.5 tp60 -101.46 -55.74 2.46 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 124.191 0.996 . . . . 0.0 110.101 168.695 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 72.5 m -68.66 -28.69 67.1 Favored 'General case' 0 N--CA 1.468 0.436 0 N-CA-C 115.084 1.513 . . . . 0.0 115.084 -171.483 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 22.1 t -90.34 -45.2 9.18 Favored 'General case' 0 N--CA 1.476 0.839 0 N-CA-C 112.989 0.737 . . . . 0.0 112.989 -167.055 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 18.2 p -89.07 -53.97 4.33 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 126.001 1.721 . . . . 0.0 110.986 -177.785 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.9 t -87.69 -160.6 0.63 Allowed 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 124.65 1.18 . . . . 0.0 110.535 164.523 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 2.1 pp -105.03 167.81 2.79 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.535 0 C-N-CA 124.728 1.211 . . . . 0.0 111.98 175.494 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 20.5 p -147.99 160.09 43.2 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 123.71 0.804 . . . . 0.0 112.198 166.576 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 12.5 m -106.57 154.57 20.7 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 124.419 1.088 . . . . 0.0 111.988 -171.488 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 30.4 mt -61.32 -33.45 73.63 Favored 'General case' 0 N--CA 1.47 0.531 0 O-C-N 121.346 -0.846 . . . . 0.0 112.026 178.896 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 59.3 m-85 -60.73 -32.45 71.72 Favored 'General case' 0 CA--C 1.541 0.609 0 N-CA-C 113.565 0.95 . . . . 0.0 113.565 171.976 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 21.3 mm100 -81.6 -31.79 32.34 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 124.373 1.069 . . . . 0.0 110.992 176.707 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 64.1 mt -64.85 -37.73 88.62 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-N 119.23 0.923 . . . . 0.0 111.692 169.186 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 26.7 tt0 -63.07 -27.05 69.13 Favored 'General case' 0 CA--C 1.546 0.825 0 N-CA-C 113.194 0.813 . . . . 0.0 113.194 179.245 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 25.1 t30 -58.73 -24.88 62.32 Favored 'General case' 0 CA--C 1.547 0.841 0 O-C-N 121.103 -0.998 . . . . 0.0 112.91 172.963 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 85.7 m-85 -102.7 9.36 39.23 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 126.074 1.749 . . . . 0.0 113.464 -178.726 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 69.1 m -65.19 146.92 54.34 Favored 'General case' 0 CA--C 1.539 0.551 0 O-C-N 120.916 -1.115 . . . . 0.0 111.558 164.337 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 6.0 t30 . . . . . 0 C--O 1.25 1.109 0 C-N-CA 125.663 1.585 . . . . 0.0 112.739 175.814 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 32.5 t80 . . . . . 0 N--CA 1.485 1.295 0 CA-C-O 118.73 -0.653 . . . . 0.0 110.396 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 43.9 t 85.2 127.17 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 C-N-CA 129.023 2.929 . . . . 0.0 111.01 174.198 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 7.3 p30 -141.68 139.22 32.91 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 125.417 1.487 . . . . 0.0 110.773 169.612 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 49.4 mm-40 -153.72 163.56 39.81 Favored 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 123.842 0.857 . . . . 0.0 111.882 -162.787 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 99.2 m-70 -78.86 129.28 34.39 Favored 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 109.088 -0.708 . . . . 0.0 109.088 161.823 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 79.6 mt -144.97 132.64 20.99 Favored 'General case' 0 N--CA 1.465 0.294 0 C-N-CA 125.743 1.617 . . . . 0.0 109.079 -174.674 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 2.7 t -153.16 152.96 31.84 Favored 'General case' 0 N--CA 1.467 0.382 0 O-C-N 121.488 -0.757 . . . . 0.0 111.893 -176.898 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 49.69 -126.05 19.89 Favored Glycine 0 N--CA 1.47 0.954 0 C-N-CA 124.794 1.188 . . . . 0.0 113.596 177.751 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 15.1 m -60.28 -31.53 70.32 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 124.765 1.226 . . . . 0.0 112.761 -179.637 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 98.2 m-70 -73.87 -35.53 64.74 Favored 'General case' 0 CA--C 1.539 0.537 0 O-C-N 120.994 -1.066 . . . . 0.0 111.667 178.18 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 33.9 tp -68.81 -43.26 75.96 Favored 'General case' 0 N--CA 1.467 0.405 0 O-C-N 121.485 -0.759 . . . . 0.0 110.753 171.844 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 50.6 t -58.54 -41.38 81.76 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.018 0 C-N-CA 123.81 0.844 . . . . 0.0 111.595 173.249 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -66.26 -44.4 83.73 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 123.885 0.874 . . . . 0.0 112.295 175.336 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.66 -44.72 96.42 Favored 'General case' 0 CA--C 1.54 0.578 0 O-C-N 121.614 -0.679 . . . . 0.0 112.088 177.171 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 30.3 mt -56.16 -50.89 69.88 Favored 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 124.204 1.002 . . . . 0.0 111.169 172.177 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 67.5 t80 -56.24 -40.53 74.28 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 113.081 0.771 . . . . 0.0 113.081 176.017 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 89.7 mt -76.99 -33.5 57.58 Favored 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 113.546 0.943 . . . . 0.0 113.546 -179.408 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 38.7 t -69.95 -44.74 78.34 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.879 0 C-N-CA 124.189 0.995 . . . . 0.0 110.828 173.033 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 76.2 m -85.25 -33.18 22.24 Favored 'General case' 0 N--CA 1.466 0.371 0 N-CA-C 113.4 0.889 . . . . 0.0 113.4 -172.76 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 64.44 -135.25 39.06 Favored Glycine 0 CA--C 1.531 1.071 0 C-N-CA 124.229 0.919 . . . . 0.0 111.659 -177.928 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 30.0 tt0 -64.5 -16.81 63.16 Favored 'General case' 0 CA--C 1.549 0.906 0 C-N-CA 124.9 1.28 . . . . 0.0 113.503 -179.511 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 82.6 mtm180 -61.06 -32.51 72.15 Favored 'General case' 0 N--CA 1.473 0.69 0 N-CA-C 113.642 0.979 . . . . 0.0 113.642 179.965 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 85.39 173.36 49.64 Favored Glycine 0 CA--C 1.533 1.175 0 C-N-CA 124.748 1.166 . . . . 0.0 112.21 -169.388 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 51.1 p90 -159.0 166.81 30.92 Favored 'General case' 0 N--CA 1.47 0.545 0 N-CA-C 113.886 1.069 . . . . 0.0 113.886 -170.432 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 31.3 m-85 -121.93 153.53 38.35 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 127.078 2.151 . . . . 0.0 110.711 178.467 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 41.1 t80 -143.33 138.38 29.45 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.406 1.482 . . . . 0.0 110.906 -177.423 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 21.2 p -141.75 128.71 11.43 Favored Pre-proline 0 N--CA 1.475 0.819 0 C-N-CA 124.85 1.26 . . . . 0.0 112.11 -178.689 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 75.4 Cg_exo -59.27 -163.02 0.02 OUTLIER 'Trans proline' 0 CA--C 1.541 0.845 1 C-N-CA 125.324 4.016 . . . . 0.0 114.458 168.422 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 65.3 pttt -70.4 12.02 0.28 Allowed 'General case' 0 CA--C 1.556 1.191 0 N-CA-C 114.644 1.35 . . . . 0.0 114.644 170.112 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 10.8 p . . . . . 0 C--O 1.25 1.129 0 C-N-CA 127.367 2.267 . . . . 0.0 113.729 -179.708 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.552 0 N-CA-C 111.101 -0.799 . . . . 0.0 111.101 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 13.1 tt -55.07 -22.96 12.12 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.367 0 N-CA-C 115.876 1.806 . . . . 0.0 115.876 -160.594 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 4.5 t -51.1 -36.44 16.22 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.059 0 C-N-CA 124.923 1.289 . . . . 0.0 112.252 172.465 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -74.3 -11.05 60.16 Favored 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 113.856 1.058 . . . . 0.0 113.856 -179.69 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 60.5 tp60 -98.74 -53.61 3.25 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 123.811 0.844 . . . . 0.0 109.8 166.268 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 32.9 m -61.37 -33.54 73.82 Favored 'General case' 0 N--CA 1.466 0.333 0 N-CA-C 114.542 1.312 . . . . 0.0 114.542 -171.242 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 23.6 t -91.98 -41.92 10.29 Favored 'General case' 0 CA--C 1.537 0.448 0 O-C-N 121.955 -0.465 . . . . 0.0 111.681 -176.632 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 21.4 m -69.27 -34.77 75.26 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 126.409 1.884 . . . . 0.0 112.532 179.942 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 11.6 t -145.14 -162.56 1.53 Allowed 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 125.525 1.53 . . . . 0.0 110.593 -178.287 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 82.1 mt -80.76 135.93 24.24 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.614 0 O-C-N 120.691 -1.255 . . . . 0.0 109.958 172.38 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 21.0 p -119.13 157.2 28.37 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-O 121.718 0.77 . . . . 0.0 111.255 161.641 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 62.2 m -102.97 153.9 19.76 Favored 'General case' 0 N--CA 1.466 0.36 0 C-N-CA 123.659 0.784 . . . . 0.0 112.726 -173.86 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 57.1 mt -59.96 -32.73 71.08 Favored 'General case' 0 N--CA 1.467 0.416 0 O-C-N 121.388 -0.82 . . . . 0.0 112.034 178.995 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 84.6 m-85 -67.55 -29.08 68.37 Favored 'General case' 0 CA--C 1.54 0.594 0 N-CA-C 113.909 1.077 . . . . 0.0 113.909 172.962 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 92.6 mt-30 -75.87 -39.87 55.64 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 123.707 0.803 . . . . 0.0 110.292 172.829 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 94.2 mt -58.54 -41.31 85.24 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-N 118.454 0.57 . . . . 0.0 110.964 170.127 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -65.28 -40.48 93.91 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 124.575 1.15 . . . . 0.0 112.174 177.27 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 35.1 t30 -63.72 -23.88 67.55 Favored 'General case' 0 CA--C 1.548 0.903 0 O-C-N 121.246 -0.909 . . . . 0.0 112.69 172.949 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -90.05 3.95 51.74 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 125.587 1.555 . . . . 0.0 114.658 175.976 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 83.1 m -71.53 151.09 44.18 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 123.533 0.733 . . . . 0.0 112.807 169.718 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.249 1.055 0 C-N-CA 127.046 2.138 . . . . 0.0 109.4 169.394 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 60.9 t80 . . . . . 0 N--CA 1.488 1.446 0 CA-C-O 119.877 -0.106 . . . . 0.0 111.054 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 34.0 m -69.76 151.69 9.59 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.064 0 C-N-CA 124.588 1.155 . . . . 0.0 112.637 -177.974 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 15.2 m-20 72.63 123.76 0.04 OUTLIER 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 128.062 2.545 . . . . 0.0 111.983 177.146 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 68.4 mm-40 -152.19 166.87 30.38 Favored 'General case' 0 N--CA 1.471 0.604 0 O-C-N 121.232 -0.918 . . . . 0.0 113.068 -158.462 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 17.5 m-70 -78.6 133.46 37.29 Favored 'General case' 0 CA--C 1.544 0.741 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 154.915 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 77.7 mt -145.83 127.39 15.11 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 126.743 2.017 . . . . 0.0 109.137 -176.009 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 84.2 m -132.74 147.41 52.32 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 124.629 1.172 . . . . 0.0 110.696 -177.683 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 55.39 -128.26 43.93 Favored Glycine 0 N--CA 1.469 0.876 0 C-N-CA 124.832 1.206 . . . . 0.0 113.965 165.474 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 14.3 m -58.42 -34.22 70.54 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 124.395 1.078 . . . . 0.0 112.641 179.916 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 79.2 m-70 -77.44 -27.06 52.04 Favored 'General case' 0 CA--C 1.54 0.562 0 O-C-N 121.292 -0.88 . . . . 0.0 112.918 177.566 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 38.9 tp -71.85 -43.4 65.57 Favored 'General case' 0 N--CA 1.47 0.567 0 O-C-N 121.135 -0.978 . . . . 0.0 111.124 167.386 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 42.1 t -57.8 -41.64 80.19 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.992 0 C-N-CA 123.556 0.743 . . . . 0.0 111.603 172.971 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 44.2 tt0 -62.33 -49.32 76.07 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 125.395 1.478 . . . . 0.0 111.822 173.324 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -63.46 -45.19 91.96 Favored 'General case' 0 CA--C 1.541 0.606 0 O-C-N 121.681 -0.637 . . . . 0.0 112.391 -179.269 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 52.0 mt -54.45 -56.37 19.4 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 124.135 0.974 . . . . 0.0 110.392 171.95 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 74.0 t80 -52.9 -41.38 64.34 Favored 'General case' 0 CA--C 1.542 0.669 0 N-CA-C 113.371 0.878 . . . . 0.0 113.371 177.38 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 86.3 mt -73.46 -34.53 65.43 Favored 'General case' 0 CA--C 1.537 0.479 0 N-CA-C 113.884 1.068 . . . . 0.0 113.884 179.569 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 54.2 t -72.25 -39.97 64.94 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.049 0 CA-C-N 118.7 0.682 . . . . 0.0 110.834 173.417 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 73.4 m -79.85 -28.68 40.03 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 124.38 1.072 . . . . 0.0 113.72 -176.089 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 65.1 -111.43 4.18 Favored Glycine 0 CA--C 1.528 0.899 0 C-N-CA 124.472 1.035 . . . . 0.0 112.082 175.504 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -71.93 -21.0 61.67 Favored 'General case' 0 CA--C 1.544 0.73 0 N-CA-C 113.82 1.045 . . . . 0.0 113.82 175.101 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 84.6 mtp180 -78.63 157.79 28.59 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 124.752 1.221 . . . . 0.0 111.272 175.449 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . -81.83 -167.23 38.85 Favored Glycine 0 CA--C 1.529 0.921 0 C-N-CA 124.092 0.853 . . . . 0.0 111.778 170.676 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 43.7 p90 -156.64 152.17 26.82 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 125.384 1.474 . . . . 0.0 112.162 178.067 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 58.9 m-85 -91.59 -28.24 17.65 Favored 'General case' 0 CA--C 1.543 0.698 0 N-CA-C 114.313 1.227 . . . . 0.0 114.313 -172.414 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 57.8 t80 54.58 -96.47 0.06 Allowed 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 125.601 1.56 . . . . 0.0 113.122 179.215 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 88.3 m 63.88 90.13 0.09 OUTLIER Pre-proline 0 N--CA 1.483 1.191 0 C-N-CA 127.621 2.368 . . . . 0.0 113.072 169.446 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 93.8 Cg_endo -74.28 179.79 5.49 Favored 'Trans proline' 0 CA--C 1.54 0.8 0 C-N-CA 123.454 2.769 . . . . 0.0 110.971 164.909 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 28.9 mtpp -79.0 -5.73 54.6 Favored 'General case' 0 CA--C 1.548 0.901 0 N-CA-C 115.134 1.531 . . . . 0.0 115.134 -174.496 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 32.4 p . . . . . 0 C--O 1.252 1.237 0 C-N-CA 125.406 1.482 . . . . 0.0 113.724 -176.612 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.771 0 N-CA-C 111.419 -0.673 . . . . 0.0 111.419 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 10.1 tp -61.11 -36.76 74.77 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.959 0 N-CA-C 114.096 1.147 . . . . 0.0 114.096 -166.94 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 61.4 t -69.46 -33.93 59.62 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.07 0 CA-C-N 119.472 1.033 . . . . 0.0 111.562 -178.981 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -72.49 -45.49 59.19 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 118.499 0.591 . . . . 0.0 110.311 173.404 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 70.6 tp60 -59.88 -47.76 84.43 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 123.127 0.571 . . . . 0.0 111.745 178.979 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 73.1 m -72.0 -30.86 65.67 Favored 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 114.794 1.405 . . . . 0.0 114.794 -177.778 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 22.3 t -103.46 -41.77 5.89 Favored 'General case' 0 N--CA 1.47 0.574 0 N-CA-C 113.711 1.004 . . . . 0.0 113.711 -169.638 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 33.8 m -81.93 -38.01 25.9 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 124.127 0.971 . . . . 0.0 110.911 177.591 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 11.0 t -111.35 -152.58 0.5 Allowed 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 125.055 1.342 . . . . 0.0 110.422 166.073 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 45.3 pt -108.81 158.43 8.64 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.543 0 C-N-CA 125.474 1.51 . . . . 0.0 111.104 170.388 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 21.1 p -137.86 156.09 48.28 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 123.791 0.836 . . . . 0.0 112.588 171.233 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 59.7 p -93.56 165.41 12.75 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 124.456 1.103 . . . . 0.0 112.979 173.942 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 72.7 mt -63.61 -34.05 76.96 Favored 'General case' 0 CA--C 1.537 0.454 0 O-C-N 121.369 -0.832 . . . . 0.0 111.798 171.976 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 91.4 t80 -64.07 -34.97 79.24 Favored 'General case' 0 CA--C 1.544 0.721 0 O-C-N 121.598 -0.689 . . . . 0.0 112.687 171.893 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 91.4 mt-30 -73.77 -32.91 64.04 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-O 118.537 -0.744 . . . . 0.0 112.218 174.022 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 92.4 mt -57.96 -48.84 78.75 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-N 119.612 1.096 . . . . 0.0 110.283 165.989 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 29.3 tt0 -63.75 -30.83 71.88 Favored 'General case' 0 CA--C 1.544 0.74 0 N-CA-C 113.338 0.866 . . . . 0.0 113.338 179.904 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 18.0 t30 -60.29 -27.76 67.55 Favored 'General case' 0 CA--C 1.544 0.74 0 O-C-N 121.131 -0.981 . . . . 0.0 113.231 178.346 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 40.8 m-85 -93.96 8.04 42.83 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 125.604 1.561 . . . . 0.0 113.223 176.071 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 56.2 m -106.16 175.84 5.37 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 125.51 1.524 . . . . 0.0 112.619 174.713 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.254 1.314 0 C-N-CA 123.8 0.84 . . . . 0.0 111.792 171.93 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 45.1 t80 . . . . . 0 N--CA 1.49 1.533 0 CA-C-O 119.442 -0.313 . . . . 0.0 110.8 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 37.9 t 78.81 127.3 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.481 1.083 0 C-N-CA 128.482 2.713 . . . . 0.0 111.162 178.591 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -147.64 130.18 15.87 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 125.227 1.411 . . . . 0.0 111.394 171.097 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 21.5 mm100 -146.28 163.94 33.92 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 124.542 1.137 . . . . 0.0 111.244 -159.81 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 96.7 m-70 -80.79 131.75 35.44 Favored 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 108.885 -0.783 . . . . 0.0 108.885 157.743 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 77.0 mt -144.37 128.58 17.73 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 125.878 1.671 . . . . 0.0 108.895 -178.937 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 85.4 m -137.08 148.0 46.45 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 125.067 1.347 . . . . 0.0 110.569 -177.614 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 56.03 -128.54 45.78 Favored Glycine 0 CA--C 1.531 1.047 0 C-N-CA 124.762 1.172 . . . . 0.0 114.245 165.095 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 25.5 p -56.54 -42.78 79.08 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 124.524 1.129 . . . . 0.0 112.599 179.935 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 73.4 m-70 -70.57 -29.61 66.1 Favored 'General case' 0 CA--C 1.541 0.616 0 O-C-N 121.142 -0.974 . . . . 0.0 113.304 176.473 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 55.0 tp -67.7 -47.14 70.25 Favored 'General case' 0 N--CA 1.469 0.507 0 O-C-N 121.299 -0.876 . . . . 0.0 111.215 169.265 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 76.4 t -60.25 -39.62 81.26 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.016 0 C-N-CA 123.248 0.619 . . . . 0.0 111.211 175.931 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 44.3 tt0 -62.02 -50.06 73.57 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 125.464 1.506 . . . . 0.0 111.594 174.759 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -63.94 -45.36 89.53 Favored 'General case' 0 N--CA 1.469 0.501 0 O-C-N 121.628 -0.67 . . . . 0.0 112.066 178.985 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 33.5 tp -60.12 -44.56 94.78 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 124.722 1.209 . . . . 0.0 111.234 177.133 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 74.4 t80 -61.65 -37.36 83.72 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 124.126 0.97 . . . . 0.0 113.011 171.359 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 65.5 mt -71.11 -28.38 64.26 Favored 'General case' 0 N--CA 1.471 0.602 0 O-C-N 120.754 -1.216 . . . . 0.0 113.1 177.396 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 96.7 t -80.6 -39.74 18.7 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.152 0 C-N-CA 123.703 0.801 . . . . 0.0 111.478 173.283 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 72.6 m -124.06 -1.02 8.31 Favored 'General case' 0 N--CA 1.479 0.987 0 N-CA-C 116.281 1.956 . . . . 0.0 116.281 -162.216 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . -63.0 -22.15 64.45 Favored Glycine 0 N--CA 1.476 1.308 0 CA-C-N 119.707 1.14 . . . . 0.0 115.837 -165.167 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 35.2 mm-40 -74.47 -23.91 58.96 Favored 'General case' 0 CA--C 1.547 0.837 0 CA-C-N 118.416 1.108 . . . . 0.0 112.897 172.574 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 74.3 mtt180 -102.48 -39.36 7.16 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 125.857 1.663 . . . . 0.0 113.132 -177.503 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 99.97 148.49 22.72 Favored Glycine 0 CA--C 1.534 1.278 0 C-N-CA 125.775 1.655 . . . . 0.0 112.159 -166.694 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 39.8 p90 -133.49 167.88 19.64 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 125.288 1.435 . . . . 0.0 113.238 -175.053 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 98.1 m-85 -124.37 144.81 49.82 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 125.89 1.676 . . . . 0.0 110.713 173.734 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 59.9 t80 -133.7 123.26 24.66 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 125.146 1.379 . . . . 0.0 110.806 -169.018 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 8.8 t -167.64 143.77 3.42 Favored Pre-proline 0 N--CA 1.48 1.047 0 C-N-CA 125.322 1.449 . . . . 0.0 112.099 -175.052 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 87.0 Cg_endo -79.18 -29.37 3.21 Favored 'Trans proline' 0 C--N 1.348 0.53 0 C-N-CA 122.905 2.404 . . . . 0.0 112.21 167.705 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 40.8 pttt 164.21 148.32 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 129.793 3.237 . . . . 0.0 111.191 -172.251 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 17.5 p . . . . . 0 C--O 1.255 1.391 0 C-N-CA 125.874 1.67 . . . . 0.0 113.858 178.845 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 1.321 0 N-CA-C 110.655 -0.978 . . . . 0.0 110.655 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 14.5 tt -104.38 4.52 10.51 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.492 0 C-N-CA 130.119 3.368 . . . . 0.0 113.644 6.834 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 27.2 t -51.49 -44.09 32.45 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.166 0 C-N-CA 125.57 1.548 . . . . 0.0 112.449 -172.552 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 3.5 pm0 -72.15 -5.17 33.65 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 125.37 1.468 . . . . 0.0 113.957 -177.789 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 57.1 tp60 -104.18 -53.93 2.64 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 124.508 1.123 . . . . 0.0 110.076 165.849 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 1.8 t -81.12 -17.73 48.9 Favored 'General case' 0 N--CA 1.469 0.477 0 N-CA-C 114.67 1.359 . . . . 0.0 114.67 -165.457 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 27.4 t -87.93 -37.48 16.39 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 123.231 0.612 . . . . 0.0 112.139 -179.947 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 16.7 p -88.94 -52.65 4.98 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 126.71 2.004 . . . . 0.0 111.363 -178.916 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 14.2 t -102.37 -149.91 0.4 Allowed 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 125.778 1.631 . . . . 0.0 109.889 168.044 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 48.0 pt -113.12 160.89 12.44 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.659 0 C-N-CA 125.165 1.386 . . . . 0.0 111.882 178.995 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 15.5 p -139.48 163.2 33.15 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 123.99 0.916 . . . . 0.0 112.108 164.358 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 6.9 t -108.25 162.02 14.47 Favored 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 124.214 1.006 . . . . 0.0 112.925 179.852 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 6.7 mp -61.69 -32.3 72.49 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 124.412 1.085 . . . . 0.0 110.783 176.542 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 86.1 m-85 -65.3 -25.85 67.81 Favored 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 113.45 0.907 . . . . 0.0 113.45 173.932 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 75.2 mt-30 -82.32 -38.79 23.77 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 124.408 1.083 . . . . 0.0 110.921 172.887 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 85.3 mt -59.75 -38.07 80.72 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 119.257 0.935 . . . . 0.0 111.364 170.349 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 -64.95 -21.47 66.84 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 124.778 1.231 . . . . 0.0 113.022 173.184 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 21.9 t30 -82.91 -28.47 29.93 Favored 'General case' 0 CA--C 1.547 0.843 0 O-C-N 121.06 -1.025 . . . . 0.0 112.995 172.419 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 23.5 m-85 -78.36 -23.31 46.98 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 124.133 0.973 . . . . 0.0 113.198 171.234 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 14.0 t -62.0 145.82 51.94 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 124.537 1.135 . . . . 0.0 111.434 160.529 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.251 1.136 0 N-CA-C 113.019 0.748 . . . . 0.0 113.019 172.103 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 81.0 m-85 . . . . . 0 N--CA 1.489 1.475 0 CA-C-O 119.734 -0.174 . . . . 0.0 111.195 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 25.6 m -144.03 164.46 14.43 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.087 0 C-N-CA 125.448 1.499 . . . . 0.0 111.604 179.552 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -65.48 141.77 58.38 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 124.596 1.159 . . . . 0.0 112.228 169.23 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 39.9 mt-30 -145.42 161.52 39.48 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 123.747 0.819 . . . . 0.0 111.769 -163.43 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 97.8 m-70 -81.29 130.57 35.09 Favored 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 108.45 -0.944 . . . . 0.0 108.45 157.235 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 89.8 mt -147.37 138.42 23.69 Favored 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 125.133 1.373 . . . . 0.0 108.501 -177.604 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 3.6 t -149.64 154.85 39.27 Favored 'General case' 0 C--O 1.236 0.351 0 O-C-N 121.575 -0.703 . . . . 0.0 112.25 -178.462 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 54.11 -129.81 43.23 Favored Glycine 0 CA--C 1.53 0.986 0 C-N-CA 125.711 1.624 . . . . 0.0 113.668 174.334 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 33.4 p -57.75 -40.19 79.13 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 124.41 1.084 . . . . 0.0 112.821 -179.621 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 73.7 m-70 -71.57 -28.99 64.22 Favored 'General case' 0 CA--C 1.54 0.585 0 O-C-N 120.951 -1.093 . . . . 0.0 113.108 178.308 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 45.7 tp -70.22 -44.73 67.98 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 119.037 0.835 . . . . 0.0 111.449 169.9 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 76.3 t -62.55 -37.99 80.29 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.056 0 C-N-CA 122.961 0.504 . . . . 0.0 111.558 174.932 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -62.37 -51.0 69.33 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 125.593 1.557 . . . . 0.0 111.149 173.95 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.88 -45.44 93.76 Favored 'General case' 0 CA--C 1.542 0.635 0 O-C-N 121.809 -0.557 . . . . 0.0 111.74 179.264 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 31.0 tp -59.44 -47.48 85.31 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 124.835 1.254 . . . . 0.0 111.228 176.762 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 56.2 t80 -58.24 -43.04 87.62 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 123.978 0.911 . . . . 0.0 113.109 172.304 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 77.1 mt -70.65 -34.45 72.05 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 113.154 0.798 . . . . 0.0 113.154 -179.502 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 41.2 t -70.27 -43.27 78.69 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.011 0 C-N-CA 123.787 0.835 . . . . 0.0 111.146 172.099 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 44.6 t -81.0 -30.23 35.01 Favored 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 114.394 1.257 . . . . 0.0 114.394 -173.157 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 67.93 -147.1 47.52 Favored Glycine 0 CA--C 1.533 1.173 0 C-N-CA 124.604 1.097 . . . . 0.0 112.348 -172.992 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -69.7 -13.57 62.36 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 124.879 1.271 . . . . 0.0 113.616 -177.744 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 40.6 mtp85 -59.05 -37.24 76.54 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 124.773 1.229 . . . . 0.0 113.948 -173.67 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 90.98 150.4 24.87 Favored Glycine 0 CA--C 1.536 1.365 0 C-N-CA 124.94 1.257 . . . . 0.0 113.515 -176.141 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 35.2 p90 -137.46 159.94 40.53 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 125.086 1.354 . . . . 0.0 112.605 -171.448 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 69.5 t80 -88.66 145.99 25.34 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 124.811 1.245 . . . . 0.0 110.125 165.791 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 70.6 t80 -161.66 127.69 3.71 Favored 'General case' 0 C--O 1.239 0.55 0 C-N-CA 124.806 1.242 . . . . 0.0 111.845 179.775 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 27.9 p -144.35 146.11 31.75 Favored Pre-proline 0 N--CA 1.471 0.613 0 C-N-CA 126.183 1.793 . . . . 0.0 111.533 172.739 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 48.4 Cg_endo -79.02 178.34 7.64 Favored 'Trans proline' 0 CA--C 1.539 0.75 0 C-N-CA 123.925 3.083 . . . . 0.0 111.022 167.908 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 25.7 tptp -61.98 135.92 57.75 Favored 'General case' 0 CA--C 1.547 0.835 0 O-C-N 121.592 -0.693 . . . . 0.0 111.991 171.577 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 14.3 p . . . . . 0 C--O 1.249 1.078 0 C-N-CA 125.972 1.709 . . . . 0.0 114.326 175.981 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.451 0 N-CA-C 112.473 -0.251 . . . . 0.0 112.473 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 9.0 tp -66.5 -37.84 80.44 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 C-N-CA 123.946 0.898 . . . . 0.0 113.018 -171.258 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 98.5 t -70.3 -38.13 73.34 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.905 0 CA-C-N 119.204 0.911 . . . . 0.0 111.425 175.015 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -57.86 -46.54 84.67 Favored 'General case' 0 N--CA 1.472 0.674 0 CA-C-N 119.894 1.225 . . . . 0.0 110.398 174.546 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 8.3 tp-100 -64.2 -56.31 15.6 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 124.051 0.94 . . . . 0.0 111.04 178.96 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 4.2 t -79.62 -15.12 58.19 Favored 'General case' 0 N--CA 1.469 0.518 0 N-CA-C 114.777 1.399 . . . . 0.0 114.777 -169.027 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 14.0 t -92.99 -31.09 15.01 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 123.602 0.761 . . . . 0.0 112.606 178.347 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 56.4 p -94.44 -43.2 8.48 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 124.076 0.95 . . . . 0.0 112.144 175.856 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 60.4 m -108.64 -140.69 0.38 Allowed 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 126.203 1.801 . . . . 0.0 109.162 167.486 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 30.2 pt -127.81 163.04 32.38 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.974 0 C-N-CA 124.945 1.298 . . . . 0.0 112.508 -174.96 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 18.7 p -145.76 165.71 28.02 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 125.399 1.479 . . . . 0.0 110.88 167.297 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 95.3 p -111.56 164.1 13.35 Favored 'General case' 0 N--CA 1.467 0.416 0 C-N-CA 124.474 1.11 . . . . 0.0 112.093 177.461 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 70.7 mt -59.64 -32.49 70.49 Favored 'General case' 0 CA--C 1.537 0.447 0 O-C-N 121.576 -0.703 . . . . 0.0 111.489 170.56 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 62.2 m-85 -69.69 -29.09 66.43 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 125.21 1.404 . . . . 0.0 113.047 175.541 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 16.8 mm100 -75.6 -39.65 57.64 Favored 'General case' 0 N--CA 1.467 0.419 0 O-C-N 121.703 -0.623 . . . . 0.0 111.339 168.873 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 87.5 mt -62.15 -34.63 76.75 Favored 'General case' 0 N--CA 1.473 0.702 0 CA-C-N 119.492 1.042 . . . . 0.0 111.693 172.558 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -61.19 -30.11 70.21 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 124.199 0.999 . . . . 0.0 112.335 174.6 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 13.8 t-20 -72.7 -22.56 60.88 Favored 'General case' 0 CA--C 1.548 0.892 0 O-C-N 121.401 -0.812 . . . . 0.0 112.857 175.394 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 27.8 m-85 -85.25 -9.56 57.58 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 124.833 1.253 . . . . 0.0 113.736 173.188 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 61.3 m -65.82 149.4 50.23 Favored 'General case' 0 CA--C 1.543 0.699 0 CA-C-N 119.543 1.065 . . . . 0.0 112.409 172.186 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.253 1.238 0 C-N-CA 125.62 1.568 . . . . 0.0 112.267 178.311 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 95.9 m-85 . . . . . 0 N--CA 1.488 1.432 0 CA-C-O 119.66 -0.209 . . . . 0.0 111.097 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 12.5 p -160.94 142.18 3.67 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.982 0 C-N-CA 125.198 1.399 . . . . 0.0 110.514 176.443 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 11.4 p30 -135.54 152.22 51.09 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 125.594 1.558 . . . . 0.0 111.709 179.949 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 40.4 mt-30 -150.25 164.58 35.37 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.615 1.166 . . . . 0.0 111.09 -165.712 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 98.7 m-70 -86.78 132.54 33.82 Favored 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 108.462 -0.94 . . . . 0.0 108.462 153.527 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 89.2 mt -145.82 143.16 29.47 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 125.566 1.546 . . . . 0.0 108.767 -179.211 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 2.0 t -148.3 149.51 31.97 Favored 'General case' 0 N--CA 1.466 0.344 0 N-CA-C 112.608 0.595 . . . . 0.0 112.608 -173.185 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 44.2 -125.9 5.99 Favored Glycine 0 N--CA 1.471 1.006 0 C-N-CA 126.271 1.891 . . . . 0.0 114.349 173.641 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 19.8 m -60.13 -30.75 69.49 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 124.549 1.139 . . . . 0.0 113.021 -178.249 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 78.7 m-70 -78.63 -28.11 45.53 Favored 'General case' 0 CA--C 1.538 0.516 0 O-C-N 120.891 -1.131 . . . . 0.0 112.661 176.631 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 6.8 tt -68.21 -45.24 73.88 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 119.445 1.02 . . . . 0.0 110.644 165.884 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 73.3 t -57.56 -41.31 78.76 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.007 0 C-N-CA 123.631 0.772 . . . . 0.0 111.749 174.985 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 45.4 tt0 -61.56 -51.08 70.05 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 125.236 1.414 . . . . 0.0 111.279 174.293 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.43 -46.44 90.08 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 123.275 0.63 . . . . 0.0 111.547 179.09 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 51.5 tp -57.48 -53.52 57.19 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 126.185 1.794 . . . . 0.0 111.118 177.246 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 52.4 t80 -53.91 -43.56 69.81 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 123.656 0.783 . . . . 0.0 112.531 174.166 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 81.7 mt -70.24 -35.03 73.55 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 124.002 0.921 . . . . 0.0 113.065 179.726 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 37.1 t -65.09 -44.64 95.65 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.908 0 C-N-CA 124.369 1.068 . . . . 0.0 110.669 170.987 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 64.3 m -75.52 -28.61 59.18 Favored 'General case' 0 CA--C 1.541 0.607 0 N-CA-C 113.539 0.94 . . . . 0.0 113.539 -177.226 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 68.69 -116.5 7.43 Favored Glycine 0 CA--C 1.528 0.888 0 C-N-CA 124.646 1.117 . . . . 0.0 111.792 175.793 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 1.7 pm0 -73.21 -20.28 60.91 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 124.2 1.0 . . . . 0.0 113.474 174.196 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 76.9 mtp180 -74.32 147.27 42.42 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 124.227 1.011 . . . . 0.0 110.346 173.974 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . -76.78 -173.81 38.46 Favored Glycine 0 CA--C 1.53 1.013 0 C-N-CA 123.496 0.57 . . . . 0.0 111.937 167.607 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 42.8 p90 -149.01 153.74 38.32 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.192 0.997 . . . . 0.0 113.651 178.752 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 61.3 t80 -88.64 156.91 18.76 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 125.394 1.478 . . . . 0.0 109.645 159.699 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 65.9 t80 -157.33 144.95 18.82 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 124.022 0.929 . . . . 0.0 112.841 -171.237 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 2.2 p -137.72 119.75 10.95 Favored Pre-proline 0 N--CA 1.473 0.682 0 C-N-CA 125.699 1.599 . . . . 0.0 110.389 175.91 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 65.8 Cg_endo -79.16 -178.03 4.33 Favored 'Trans proline' 0 C--N 1.353 0.774 0 C-N-CA 124.603 3.535 . . . . 0.0 112.261 -174.742 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 52.0 tttt -69.79 -15.85 63.19 Favored 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 124.163 0.985 . . . . 0.0 113.593 178.259 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 11.5 m . . . . . 0 C--O 1.252 1.185 0 C-N-CA 127.363 2.265 . . . . 0.0 113.2 -174.404 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.192 0 N-CA-C 110.508 -1.037 . . . . 0.0 110.508 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 43.0 pt -107.74 -25.16 3.74 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.045 0 N-CA-C 113.872 1.064 . . . . 0.0 113.872 170.065 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 53.1 t -66.03 -34.48 70.52 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.036 0 C-N-CA 123.936 0.894 . . . . 0.0 112.608 -173.258 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -88.47 -43.45 11.44 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 118.568 0.622 . . . . 0.0 111.3 169.419 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 43.3 tp60 -63.91 -40.72 97.14 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 123.354 0.662 . . . . 0.0 112.725 -171.022 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 11.9 t -77.87 -13.39 59.9 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 118.953 0.797 . . . . 0.0 112.982 175.527 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 17.1 t -84.77 -40.08 17.67 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.05 0.94 . . . . 0.0 112.25 175.059 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 47.1 p -87.25 -48.41 8.04 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 124.937 1.295 . . . . 0.0 111.928 178.194 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 10.3 t -97.92 -146.89 0.31 Allowed 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 125.55 1.54 . . . . 0.0 109.996 166.753 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 31.0 pt -124.31 164.27 22.92 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.865 0 C-N-CA 125.915 1.686 . . . . 0.0 112.488 -177.522 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 19.7 p -149.26 173.33 13.6 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 125.264 1.425 . . . . 0.0 110.993 166.05 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 2.8 m -131.14 164.11 26.2 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 124.225 1.01 . . . . 0.0 111.473 -170.929 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 30.4 mt -62.33 -39.44 93.08 Favored 'General case' 0 N--CA 1.468 0.458 0 O-C-N 121.292 -0.88 . . . . 0.0 111.755 -175.521 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 20.2 p90 -65.68 -31.26 72.17 Favored 'General case' 0 N--CA 1.471 0.581 0 O-C-N 121.277 -0.889 . . . . 0.0 113.27 173.685 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 49.4 mt-30 -76.48 -31.16 57.6 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 123.475 0.71 . . . . 0.0 111.516 176.617 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 80.5 mt -66.52 -43.7 84.52 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 123.996 0.918 . . . . 0.0 111.062 168.459 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 31.8 tt0 -61.3 -23.64 65.84 Favored 'General case' 0 CA--C 1.547 0.83 0 N-CA-C 113.536 0.939 . . . . 0.0 113.536 -178.22 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 22.1 t30 -55.14 -28.43 52.68 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 124.404 1.082 . . . . 0.0 113.539 171.867 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 97.8 m-85 -93.35 5.71 50.63 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.819 1.648 . . . . 0.0 113.646 -178.404 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 68.7 m -105.51 164.35 11.95 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 125.862 1.665 . . . . 0.0 113.886 178.724 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.253 1.244 0 C-N-CA 124.744 1.218 . . . . 0.0 112.513 178.563 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 62.3 m-85 . . . . . 0 N--CA 1.487 1.386 0 CA-C-O 120.207 0.051 . . . . 0.0 110.982 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 14.6 p -150.33 144.39 17.29 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.981 0 C-N-CA 125.548 1.539 . . . . 0.0 110.649 177.914 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 5.9 p-10 -107.05 152.29 24.21 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 125.568 1.547 . . . . 0.0 112.611 177.644 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 43.2 mt-30 -148.2 165.26 31.45 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 125.45 1.5 . . . . 0.0 110.77 -177.578 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 96.1 m-70 -89.02 128.31 35.71 Favored 'General case' 0 CA--C 1.542 0.655 0 N-CA-C 108.178 -1.045 . . . . 0.0 108.178 156.236 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 74.5 mt -140.53 131.49 26.11 Favored 'General case' 0 N--CA 1.466 0.356 0 C-N-CA 124.738 1.215 . . . . 0.0 109.414 -176.884 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 57.0 m -125.94 136.82 53.46 Favored 'General case' 0 N--CA 1.467 0.4 0 C-N-CA 124.72 1.208 . . . . 0.0 110.726 -175.667 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 47.3 -118.02 3.67 Favored Glycine 0 N--CA 1.473 1.145 0 C-N-CA 125.404 1.478 . . . . 0.0 114.564 164.976 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 21.0 p -57.95 -35.9 71.78 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 124.563 1.145 . . . . 0.0 113.254 178.932 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 86.6 m-70 -76.33 -27.93 56.71 Favored 'General case' 0 CA--C 1.542 0.645 0 O-C-N 120.756 -1.215 . . . . 0.0 112.775 176.353 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 8.2 tt -67.03 -46.1 75.47 Favored 'General case' 0 N--CA 1.468 0.434 0 O-C-N 121.24 -0.912 . . . . 0.0 110.78 166.385 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 55.0 t -62.95 -36.39 75.5 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.142 0 C-N-CA 123.622 0.769 . . . . 0.0 111.638 177.543 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 44.2 tt0 -62.48 -51.03 69.07 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 125.503 1.521 . . . . 0.0 111.217 172.548 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.94 -46.42 90.77 Favored 'General case' 0 CA--C 1.539 0.542 0 O-C-N 121.777 -0.577 . . . . 0.0 111.797 177.543 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 53.8 tp -56.29 -49.25 74.78 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 125.688 1.595 . . . . 0.0 111.432 177.069 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 44.6 t80 -58.61 -42.55 88.41 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 123.628 0.771 . . . . 0.0 113.003 173.436 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 83.1 mt -74.6 -31.4 62.02 Favored 'General case' 0 N--CA 1.473 0.682 0 N-CA-C 113.208 0.818 . . . . 0.0 113.208 -177.845 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 41.4 t -67.27 -46.85 83.06 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.877 0 C-N-CA 124.333 1.053 . . . . 0.0 110.474 171.913 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 72.1 m -93.31 -24.96 17.95 Favored 'General case' 0 N--CA 1.469 0.497 0 N-CA-C 114.587 1.329 . . . . 0.0 114.587 -168.147 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 64.65 -136.46 38.87 Favored Glycine 0 CA--C 1.532 1.147 0 C-N-CA 124.478 1.037 . . . . 0.0 112.696 177.444 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -63.3 -17.47 62.56 Favored 'General case' 0 CA--C 1.544 0.728 0 N-CA-C 114.659 1.355 . . . . 0.0 114.659 -177.727 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 83.3 mtm180 -61.71 -31.52 71.68 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 124.506 1.122 . . . . 0.0 113.301 -177.952 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 79.41 166.87 33.01 Favored Glycine 0 CA--C 1.533 1.205 0 C-N-CA 124.403 1.002 . . . . 0.0 113.515 -177.03 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 47.7 p90 -152.7 165.47 35.18 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 124.584 1.154 . . . . 0.0 113.694 -168.15 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 87.4 t80 -152.94 104.82 2.87 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 125.15 1.38 . . . . 0.0 110.287 166.543 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 50.8 p90 -73.98 157.88 35.37 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 125.326 1.451 . . . . 0.0 113.149 177.493 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 34.4 m -93.0 120.33 67.12 Favored Pre-proline 0 N--CA 1.477 0.894 0 CA-C-O 118.173 -0.917 . . . . 0.0 109.382 166.921 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 79.9 Cg_endo -74.57 -170.97 0.82 Allowed 'Trans proline' 0 CA--C 1.538 0.701 0 C-N-CA 124.108 3.205 . . . . 0.0 111.45 -177.775 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 20.1 ptpt -61.73 137.02 58.21 Favored 'General case' 0 CA--C 1.548 0.866 0 O-C-N 121.544 -0.722 . . . . 0.0 112.891 175.433 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 34.8 p . . . . . 0 N--CA 1.485 1.279 0 C-N-CA 124.877 1.271 . . . . 0.0 112.928 -176.823 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.514 0 N-CA-C 111.809 -0.516 . . . . 0.0 111.809 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 43.4 pt -66.4 -24.4 33.25 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.098 0 N-CA-C 114.321 1.23 . . . . 0.0 114.321 -171.6 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 84.5 t -63.11 -32.55 56.67 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.114 0 CA-C-N 118.652 0.66 . . . . 0.0 111.539 174.371 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 44.1 tt0 -83.99 -53.7 5.38 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 118.431 0.559 . . . . 0.0 110.262 168.429 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 31.7 tt0 -64.81 -41.38 95.83 Favored 'General case' 0 CA--C 1.535 0.367 0 N-CA-C 113.275 0.842 . . . . 0.0 113.275 -165.448 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 4.5 t -85.24 -10.37 56.62 Favored 'General case' 0 N--CA 1.476 0.851 0 CA-C-N 119.907 1.231 . . . . 0.0 113.298 179.768 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 21.7 t -89.98 -34.55 15.95 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 124.863 1.265 . . . . 0.0 111.907 176.243 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 46.2 p -95.94 -45.33 6.98 Favored 'General case' 0 N--CA 1.478 0.925 0 C-N-CA 126.106 1.762 . . . . 0.0 112.518 179.151 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.6 t -104.42 -161.11 0.8 Allowed 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 125.177 1.391 . . . . 0.0 110.029 166.394 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 7.8 tt -113.45 154.06 14.9 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.903 0 C-N-CA 125.685 1.594 . . . . 0.0 111.289 -177.63 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 14.8 p -141.6 162.33 35.75 Favored 'General case' 0 N--CA 1.475 0.779 0 O-C-N 121.259 -0.9 . . . . 0.0 113.154 173.436 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 83.3 p -104.87 166.91 10.06 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 125.429 1.492 . . . . 0.0 113.1 -177.846 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 62.2 mt -63.83 -37.99 89.45 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 123.72 0.808 . . . . 0.0 111.87 174.419 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 20.8 p90 -68.4 -32.56 72.71 Favored 'General case' 0 N--CA 1.469 0.499 0 N-CA-C 113.296 0.85 . . . . 0.0 113.296 175.048 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 16.7 mm100 -70.57 -35.06 72.85 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-O 119.069 -0.491 . . . . 0.0 111.885 172.314 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 88.9 mt -66.94 -37.07 83.63 Favored 'General case' 0 N--CA 1.472 0.674 0 CA-C-N 119.15 0.886 . . . . 0.0 112.226 170.926 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -62.69 -25.6 68.24 Favored 'General case' 0 CA--C 1.543 0.694 0 N-CA-C 113.335 0.865 . . . . 0.0 113.335 -178.73 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 25.9 t30 -53.93 -28.5 37.38 Favored 'General case' 0 CA--C 1.548 0.877 0 C-N-CA 124.287 1.035 . . . . 0.0 113.347 171.74 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 98.7 m-85 -96.77 2.89 52.44 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 125.8 1.64 . . . . 0.0 114.19 -175.43 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 70.0 m -69.98 157.49 37.38 Favored 'General case' 0 CA--C 1.544 0.748 0 N-CA-C 113.418 0.895 . . . . 0.0 113.418 174.194 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.254 1.293 0 C-N-CA 126.367 1.867 . . . . 0.0 110.795 -179.72 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 79.1 m-85 . . . . . 0 N--CA 1.487 1.422 0 N-CA-C 111.373 0.138 . . . . 0.0 111.373 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 30.1 m -133.98 160.36 41.91 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.088 0 C-N-CA 126.127 1.771 . . . . 0.0 110.735 174.727 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 3.3 m120 -122.45 144.75 48.86 Favored 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 125.508 1.523 . . . . 0.0 111.654 -179.057 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 90.4 mt-30 -146.15 157.92 43.85 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 124.921 1.288 . . . . 0.0 110.569 -177.767 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 96.8 m-70 -86.26 131.08 34.31 Favored 'General case' 0 CA--C 1.541 0.615 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 162.67 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 83.5 mt -145.53 134.2 22.21 Favored 'General case' 0 N--CA 1.464 0.244 0 C-N-CA 124.899 1.28 . . . . 0.0 109.493 -168.652 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 2.0 t -151.12 153.31 34.77 Favored 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 123.857 0.863 . . . . 0.0 111.517 -176.601 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 48.14 -126.11 14.02 Favored Glycine 0 CA--C 1.532 1.116 0 C-N-CA 125.115 1.341 . . . . 0.0 113.707 176.137 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 19.4 m -60.19 -31.49 70.18 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 124.359 1.064 . . . . 0.0 112.938 -179.001 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 99.2 m-70 -74.41 -35.46 63.42 Favored 'General case' 0 CA--C 1.54 0.589 0 O-C-N 121.157 -0.964 . . . . 0.0 111.918 178.021 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 60.0 tp -67.32 -43.03 82.62 Favored 'General case' 0 N--CA 1.47 0.551 0 O-C-N 121.749 -0.594 . . . . 0.0 111.23 170.43 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 42.7 t -59.91 -42.16 88.38 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.951 0 C-N-CA 124.151 0.98 . . . . 0.0 111.583 174.448 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -64.66 -46.1 83.9 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 124.215 1.006 . . . . 0.0 111.828 174.596 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.3 -46.27 90.45 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 123.27 0.628 . . . . 0.0 112.319 177.641 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 42.3 mt -56.55 -51.95 66.63 Favored 'General case' 0 N--CA 1.466 0.34 0 C-N-CA 124.003 0.921 . . . . 0.0 111.191 173.584 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 59.1 t80 -54.25 -43.18 70.69 Favored 'General case' 0 CA--C 1.542 0.658 0 N-CA-C 112.767 0.655 . . . . 0.0 112.767 176.298 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 91.2 mt -74.05 -36.66 64.39 Favored 'General case' 0 N--CA 1.469 0.494 0 N-CA-C 113.516 0.932 . . . . 0.0 113.516 -179.664 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 33.4 t -66.65 -43.96 90.02 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.958 0 C-N-CA 124.358 1.063 . . . . 0.0 110.637 174.206 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 79.1 m -79.78 -30.61 40.71 Favored 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 113.262 0.838 . . . . 0.0 113.262 -175.291 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 69.21 -113.32 5.08 Favored Glycine 0 CA--C 1.53 0.989 0 C-N-CA 124.489 1.042 . . . . 0.0 111.836 173.041 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 39.7 mm-40 -71.54 -22.38 61.77 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 123.884 0.874 . . . . 0.0 112.819 174.882 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 84.0 mtm180 -75.27 154.25 37.54 Favored 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 124.749 1.22 . . . . 0.0 110.954 175.137 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . -77.72 -174.21 41.71 Favored Glycine 0 N--CA 1.472 1.047 0 C-N-CA 123.814 0.721 . . . . 0.0 111.692 169.321 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 55.1 p90 -157.73 165.5 35.23 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 124.835 1.254 . . . . 0.0 112.7 178.912 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 88.6 t80 -145.68 124.08 12.36 Favored 'General case' 0 N--CA 1.466 0.333 0 C-N-CA 124.867 1.267 . . . . 0.0 111.504 170.25 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 18.1 p90 -85.58 119.26 25.73 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 125.135 1.374 . . . . 0.0 111.335 175.981 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 22.3 p -78.45 129.46 74.55 Favored Pre-proline 0 N--CA 1.473 0.717 0 CA-C-O 118.378 -0.82 . . . . 0.0 110.38 177.477 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 26.7 Cg_endo -85.33 -135.41 0.02 OUTLIER 'Trans proline' 0 CA--C 1.543 0.926 0 C-N-CA 124.36 3.373 . . . . 0.0 111.032 -170.417 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 55.8 tptt -62.82 -26.72 68.88 Favored 'General case' 0 CA--C 1.55 0.947 0 C-N-CA 125.205 1.402 . . . . 0.0 113.366 175.966 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 19.4 m . . . . . 0 C--O 1.251 1.177 0 C-N-CA 127.4 2.28 . . . . 0.0 113.211 179.947 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.784 0 N-CA-C 112.261 -0.336 . . . . 0.0 112.261 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 9.4 tp -59.59 -39.57 79.8 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.069 0 N-CA-C 113.806 1.039 . . . . 0.0 113.806 -172.065 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 91.0 t -65.63 -48.56 82.15 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.986 0 CA-C-N 119.164 0.893 . . . . 0.0 109.73 -179.296 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 59.8 tt0 -55.8 -47.9 76.33 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 123.976 0.91 . . . . 0.0 111.355 174.831 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 20.6 tt0 -62.75 -48.33 79.63 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 123.01 0.524 . . . . 0.0 111.492 -179.238 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 65.9 m -63.63 -34.37 77.68 Favored 'General case' 0 N--CA 1.466 0.373 0 N-CA-C 113.766 1.024 . . . . 0.0 113.766 178.643 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 74.7 m -77.25 -38.61 50.7 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.753 0.821 . . . . 0.0 112.277 -179.013 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 78.9 p -95.97 -23.08 17.01 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 124.87 1.268 . . . . 0.0 113.74 -174.186 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.2 t -141.95 -169.3 2.89 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 125.599 1.56 . . . . 0.0 111.154 -177.844 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 38.0 mm -86.24 133.93 28.57 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.704 0 O-C-N 120.696 -1.253 . . . . 0.0 109.793 175.87 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 16.1 p -127.11 163.53 23.6 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 124.193 0.997 . . . . 0.0 112.163 170.908 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 96.5 p -108.28 158.64 17.3 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 124.259 1.024 . . . . 0.0 112.959 -177.581 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 55.6 mt -64.22 -34.18 77.51 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 123.738 0.815 . . . . 0.0 111.391 173.402 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 82.5 t80 -62.66 -35.83 80.89 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 123.756 0.823 . . . . 0.0 113.149 172.474 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 37.1 mt-30 -73.72 -32.76 64.04 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-O 118.502 -0.761 . . . . 0.0 112.121 173.775 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 81.7 mt -65.16 -40.4 94.27 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 119.594 1.088 . . . . 0.0 111.707 168.526 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -60.81 -26.93 67.66 Favored 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 113.478 0.918 . . . . 0.0 113.478 -177.1 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 18.9 t30 -55.34 -27.76 49.33 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 123.921 0.888 . . . . 0.0 113.323 172.522 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 97.0 m-85 -98.79 5.48 47.47 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 125.838 1.655 . . . . 0.0 114.251 -175.451 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 73.5 m -68.92 160.21 31.19 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 123.719 0.808 . . . . 0.0 113.09 169.936 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.252 1.224 0 C-N-CA 126.384 1.874 . . . . 0.0 110.871 -179.427 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 83.6 m-85 . . . . . 0 N--CA 1.485 1.303 0 N-CA-C 110.481 -0.192 . . . . 0.0 110.481 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 14.2 p -146.29 145.61 19.75 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.012 0 C-N-CA 129.182 2.993 . . . . 0.0 110.479 0.219 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 55.3 m-20 -80.31 139.86 36.41 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 124.539 1.136 . . . . 0.0 110.935 -178.069 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 28.9 mm-40 -149.69 167.92 25.08 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 124.1 0.96 . . . . 0.0 112.48 -165.359 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 88.1 m-70 -79.16 138.88 38.06 Favored 'General case' 0 CA--C 1.542 0.646 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 155.092 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 43.1 mt -151.17 136.17 17.42 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 124.78 1.232 . . . . 0.0 108.61 -175.617 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 2.3 t -155.41 153.97 31.21 Favored 'General case' 0 CA--C 1.534 0.328 0 O-C-N 121.549 -0.719 . . . . 0.0 112.343 -176.357 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 54.32 -130.97 45.5 Favored Glycine 0 CA--C 1.532 1.149 0 C-N-CA 125.195 1.379 . . . . 0.0 113.617 175.034 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 25.4 p -57.59 -38.0 74.15 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 124.353 1.061 . . . . 0.0 112.803 178.323 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 73.4 m-70 -71.95 -29.51 64.34 Favored 'General case' 0 CA--C 1.544 0.735 0 O-C-N 121.107 -0.995 . . . . 0.0 112.801 177.533 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 9.7 tt -66.74 -47.19 73.06 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 119.527 1.058 . . . . 0.0 110.877 168.123 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 58.3 t -61.87 -38.78 81.42 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.897 0 C-N-CA 123.239 0.616 . . . . 0.0 111.403 178.971 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -61.73 -51.86 66.62 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 125.709 1.604 . . . . 0.0 111.509 172.425 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.58 -46.16 91.07 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 123.231 0.612 . . . . 0.0 112.01 179.608 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 46.7 tp -58.19 -51.67 68.79 Favored 'General case' 0 CA--C 1.53 0.182 0 C-N-CA 124.807 1.243 . . . . 0.0 111.014 176.699 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 56.8 t80 -54.37 -42.59 70.5 Favored 'General case' 0 CA--C 1.543 0.678 0 N-CA-C 112.868 0.692 . . . . 0.0 112.868 174.262 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 83.0 mt -71.53 -34.68 70.26 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 124.093 0.957 . . . . 0.0 113.163 178.911 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 25.2 t -64.47 -44.42 96.99 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.844 0 C-N-CA 124.534 1.133 . . . . 0.0 110.419 171.277 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 79.4 m -72.61 -34.08 67.13 Favored 'General case' 0 CA--C 1.538 0.513 0 N-CA-C 113.129 0.789 . . . . 0.0 113.129 -178.651 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 69.78 -111.63 3.96 Favored Glycine 0 CA--C 1.529 0.927 0 C-N-CA 124.743 1.163 . . . . 0.0 111.797 173.619 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -70.16 -26.65 64.02 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 124.33 1.052 . . . . 0.0 112.061 174.955 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 83.6 mtm180 -72.44 154.37 40.91 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 124.886 1.274 . . . . 0.0 111.137 176.211 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . -79.86 -167.61 35.47 Favored Glycine 0 N--CA 1.471 0.977 0 C-N-CA 124.255 0.931 . . . . 0.0 111.353 167.817 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 52.9 p90 -159.53 162.85 35.53 Favored 'General case' 0 CA--C 1.538 0.506 0 N-CA-C 113.789 1.033 . . . . 0.0 113.789 179.248 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 83.1 t80 -156.94 106.31 2.23 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 125.733 1.613 . . . . 0.0 110.025 168.908 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 29.2 p90 -77.33 170.05 17.24 Favored 'General case' 0 CA--C 1.55 0.979 0 C-N-CA 125.073 1.349 . . . . 0.0 114.067 -179.331 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 63.3 m -133.91 122.36 16.4 Favored Pre-proline 0 N--CA 1.477 0.913 0 C-N-CA 125.25 1.42 . . . . 0.0 111.407 179.634 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 28.2 Cg_endo -88.53 -124.0 0.01 OUTLIER 'Trans proline' 0 CA--C 1.542 0.885 0 C-N-CA 124.916 3.744 . . . . 0.0 109.639 170.139 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 15.8 tppt? -71.0 -30.65 66.95 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 124.604 1.162 . . . . 0.0 113.391 177.483 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 33.7 m . . . . . 0 C--O 1.254 1.296 0 C-N-CA 126.265 1.826 . . . . 0.0 110.982 -172.63 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.553 0 N-CA-C 111.838 -0.505 . . . . 0.0 111.838 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 19.1 tt -59.89 -35.99 63.94 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.079 0 CA-C-O 117.909 -1.044 . . . . 0.0 113.122 -175.524 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 29.5 t -66.25 -43.84 91.56 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.043 0 CA-C-N 120.16 1.346 . . . . 0.0 110.723 179.066 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 46.6 tt0 -62.65 -47.62 82.89 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 118.623 0.647 . . . . 0.0 111.078 174.085 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 63.1 tp60 -63.26 -37.11 85.97 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 123.005 0.522 . . . . 0.0 112.095 -177.426 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 78.2 m -85.64 -29.3 24.15 Favored 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 114.607 1.336 . . . . 0.0 114.607 -179.828 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 41.7 t -98.48 -57.16 2.26 Favored 'General case' 0 N--CA 1.473 0.724 0 N-CA-C 113.272 0.841 . . . . 0.0 113.272 -166.301 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 36.5 p -88.7 -33.02 17.69 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 124.178 0.991 . . . . 0.0 111.914 179.228 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.0 t -94.13 -162.61 0.96 Allowed 'General case' 0 CA--C 1.551 0.982 0 C-N-CA 123.531 0.733 . . . . 0.0 110.935 158.396 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 12.0 tt -118.22 146.55 22.6 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.907 0 C-N-CA 125.926 1.69 . . . . 0.0 111.048 174.95 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 14.9 p -132.45 159.23 39.95 Favored 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 113.122 0.786 . . . . 0.0 113.122 177.675 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 52.6 m -99.72 154.03 18.63 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 125.315 1.446 . . . . 0.0 112.186 -179.612 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 43.9 mt -59.37 -33.13 70.81 Favored 'General case' 0 N--CA 1.472 0.653 0 O-C-N 120.86 -1.15 . . . . 0.0 112.042 173.487 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 83.2 t80 -62.41 -30.69 71.4 Favored 'General case' 0 CA--C 1.546 0.804 0 N-CA-C 113.368 0.877 . . . . 0.0 113.368 171.673 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 94.0 mt-30 -80.15 -33.95 38.08 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 123.83 0.852 . . . . 0.0 111.365 174.895 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 56.3 mt -56.93 -48.49 78.15 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 118.841 0.746 . . . . 0.0 110.397 166.444 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -66.19 -31.7 72.69 Favored 'General case' 0 CA--C 1.544 0.712 0 N-CA-C 112.853 0.686 . . . . 0.0 112.853 179.279 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 32.8 t30 -62.9 -27.25 69.24 Favored 'General case' 0 CA--C 1.55 0.973 0 O-C-N 120.965 -1.084 . . . . 0.0 113.24 176.035 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 10.9 m-85 -80.6 -4.19 53.19 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 124.697 1.199 . . . . 0.0 113.894 172.324 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 72.1 m -102.86 172.79 6.63 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 124.905 1.282 . . . . 0.0 113.738 178.286 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 24.5 t-20 . . . . . 0 C--O 1.252 1.186 0 C-N-CA 125.167 1.387 . . . . 0.0 112.969 171.146 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 87.2 m-85 . . . . . 0 N--CA 1.485 1.285 0 N-CA-C 111.489 0.181 . . . . 0.0 111.489 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 69.0 t -80.95 136.31 23.43 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.989 0 C-N-CA 127.66 2.384 . . . . 0.0 109.758 -1.311 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -143.54 139.09 29.58 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 125.283 1.433 . . . . 0.0 111.201 -179.856 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 47.9 mm-40 -149.11 155.07 40.15 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 124.293 1.037 . . . . 0.0 110.694 -161.685 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 97.7 m-70 -87.69 122.95 32.0 Favored 'General case' 0 CA--C 1.539 0.552 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 164.545 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 77.5 mt -140.71 130.83 24.81 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 125.869 1.668 . . . . 0.0 109.139 -172.086 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 64.8 m -134.17 143.16 47.74 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 125.024 1.33 . . . . 0.0 111.091 -175.374 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 55.61 -125.66 37.31 Favored Glycine 0 N--CA 1.472 1.099 0 C-N-CA 124.763 1.173 . . . . 0.0 114.427 166.225 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 24.5 p -62.57 -34.57 77.24 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 124.382 1.073 . . . . 0.0 112.607 179.34 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 24.7 m80 -68.13 -38.7 82.5 Favored 'General case' 0 CA--C 1.541 0.622 0 O-C-N 121.275 -0.89 . . . . 0.0 111.422 176.038 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 50.4 tp -63.8 -49.43 72.91 Favored 'General case' 0 N--CA 1.464 0.272 0 C-N-CA 123.469 0.708 . . . . 0.0 111.172 170.889 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 47.8 t -58.32 -39.94 76.04 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.905 0 C-N-CA 123.093 0.557 . . . . 0.0 111.83 177.938 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -64.68 -49.75 69.71 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 123.786 0.835 . . . . 0.0 111.82 175.384 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.9 -46.89 88.86 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 123.34 0.656 . . . . 0.0 111.932 179.362 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 52.4 tp -56.0 -50.71 70.11 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 126.365 1.866 . . . . 0.0 111.409 175.482 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 91.4 t80 -61.14 -40.09 92.53 Favored 'General case' 0 CA--C 1.54 0.572 0 N-CA-C 112.998 0.74 . . . . 0.0 112.998 175.093 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 79.0 mt -72.7 -36.05 67.76 Favored 'General case' 0 N--CA 1.471 0.621 0 N-CA-C 113.284 0.846 . . . . 0.0 113.284 -179.828 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 25.5 t -63.31 -45.86 97.09 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.081 0 C-N-CA 123.43 0.692 . . . . 0.0 110.45 171.408 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 69.7 m -83.6 -19.18 35.97 Favored 'General case' 0 CA--C 1.54 0.576 0 N-CA-C 114.193 1.183 . . . . 0.0 114.193 -173.685 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 76.44 -126.09 7.98 Favored Glycine 0 CA--C 1.53 1.019 0 C-N-CA 124.724 1.154 . . . . 0.0 111.574 174.146 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -72.5 -13.39 61.41 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 123.78 0.832 . . . . 0.0 113.121 175.677 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 87.7 mtm180 -71.07 159.16 35.22 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 124.645 1.178 . . . . 0.0 112.511 178.504 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . -91.76 157.72 24.64 Favored Glycine 0 CA--C 1.528 0.873 0 C-N-CA 125.631 1.586 . . . . 0.0 112.246 174.981 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 49.1 p90 -127.42 151.8 48.35 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 125.255 1.422 . . . . 0.0 112.757 -178.553 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 30.2 t80 -94.25 162.82 13.69 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 126.38 1.872 . . . . 0.0 110.267 165.413 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 38.5 t80 -158.22 126.61 5.41 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 123.754 0.821 . . . . 0.0 112.21 -168.671 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 38.0 p -143.18 133.63 12.26 Favored Pre-proline 0 N--CA 1.478 0.946 0 C-N-CA 125.549 1.54 . . . . 0.0 112.62 -172.81 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 88.5 Cg_endo -82.04 -85.34 0.0 OUTLIER 'Trans proline' 0 CA--C 1.538 0.677 0 C-N-CA 123.75 2.967 . . . . 0.0 110.546 171.523 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 57.2 tttp -157.84 139.84 14.16 Favored 'General case' 0 CA--C 1.549 0.92 0 C-N-CA 126.519 1.928 . . . . 0.0 110.555 -175.772 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 17.8 p . . . . . 0 C--O 1.251 1.168 0 C-N-CA 128.524 2.73 . . . . 0.0 112.339 -6.563 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.651 0 N-CA-C 111.286 -0.726 . . . . 0.0 111.286 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 12.4 tt -74.57 -24.48 18.57 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.987 0 N-CA-C 114.868 1.433 . . . . 0.0 114.868 -174.697 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 91.3 t -64.26 -42.21 94.76 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.922 0 CA-C-N 119.33 0.968 . . . . 0.0 110.441 -174.403 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -62.33 -44.01 97.5 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 124.855 1.262 . . . . 0.0 111.359 176.731 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 17.5 tt0 -61.96 -56.44 19.18 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.074 0.949 . . . . 0.0 110.138 177.763 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 70.3 m -56.1 -33.43 65.08 Favored 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 113.759 1.022 . . . . 0.0 113.759 -179.728 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 12.6 t -91.38 -34.84 14.71 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 124.251 1.02 . . . . 0.0 113.691 -171.77 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 43.2 p -108.43 -26.08 10.65 Favored 'General case' 0 N--CA 1.482 1.134 0 N-CA-C 114.485 1.291 . . . . 0.0 114.485 -176.149 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 95.8 p -115.41 -131.28 0.32 Allowed 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 124.43 1.092 . . . . 0.0 109.129 162.337 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 10.0 tt -135.22 149.54 28.9 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 C-N-CA 125.219 1.408 . . . . 0.0 110.46 -177.95 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 15.6 p -140.26 157.19 45.97 Favored 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 113.427 0.899 . . . . 0.0 113.427 178.062 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 22.8 t -100.16 158.8 15.59 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-O 122.254 1.026 . . . . 0.0 113.151 178.271 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 52.7 mt -63.38 -33.92 76.6 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 123.847 0.859 . . . . 0.0 110.947 170.838 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 77.2 t80 -63.06 -29.58 70.92 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 124.103 0.961 . . . . 0.0 112.962 173.481 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 98.5 mt-30 -81.55 -38.88 25.49 Favored 'General case' 0 N--CA 1.467 0.381 0 C-N-CA 123.769 0.828 . . . . 0.0 110.736 176.101 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 86.8 mt -59.23 -36.06 74.75 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-N 119.135 0.88 . . . . 0.0 111.96 170.128 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -59.57 -26.98 65.86 Favored 'General case' 0 CA--C 1.546 0.799 0 N-CA-C 113.462 0.912 . . . . 0.0 113.462 178.722 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 26.4 t30 -60.86 -24.51 65.97 Favored 'General case' 0 CA--C 1.55 0.978 0 O-C-N 120.903 -1.123 . . . . 0.0 113.119 173.654 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 84.2 m-85 -98.47 5.96 47.59 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 126.429 1.892 . . . . 0.0 113.247 -178.079 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 71.1 m -72.63 163.6 27.8 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 123.881 0.872 . . . . 0.0 112.753 166.12 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.251 1.15 0 C-N-CA 126.595 1.958 . . . . 0.0 110.712 179.228 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 86.8 m-85 . . . . . 0 N--CA 1.49 1.556 0 N-CA-C 111.217 0.081 . . . . 0.0 111.217 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 28.5 m -138.32 158.81 32.05 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.134 0 C-N-CA 125.769 1.628 . . . . 0.0 110.457 176.019 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -121.96 142.91 49.83 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 124.89 1.276 . . . . 0.0 113.417 178.086 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 38.5 mt-30 -147.4 163.04 37.73 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 124.961 1.305 . . . . 0.0 111.434 -168.427 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 98.2 m-70 -80.11 132.68 35.99 Favored 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 109.02 -0.733 . . . . 0.0 109.02 156.74 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 76.5 mt -148.21 139.13 23.14 Favored 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 125.327 1.451 . . . . 0.0 109.082 -176.464 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 2.8 t -159.14 155.7 27.7 Favored 'General case' 0 N--CA 1.468 0.474 0 O-C-N 121.587 -0.695 . . . . 0.0 111.904 -177.472 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 54.1 -135.17 44.02 Favored Glycine 0 CA--C 1.53 1.004 0 C-N-CA 124.922 1.249 . . . . 0.0 113.593 175.072 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 20.0 m -58.15 -33.02 68.73 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 124.056 0.942 . . . . 0.0 112.552 -179.712 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 76.2 m-70 -75.67 -28.76 58.83 Favored 'General case' 0 CA--C 1.543 0.688 0 O-C-N 121.102 -0.999 . . . . 0.0 112.85 178.565 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 9.3 tt -66.15 -46.52 77.19 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 119.312 0.96 . . . . 0.0 110.757 166.198 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 95.4 t -62.36 -38.93 82.45 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.766 0 C-N-CA 122.906 0.482 . . . . 0.0 111.396 179.364 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -62.13 -51.27 68.55 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 125.751 1.62 . . . . 0.0 111.691 172.234 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.04 -46.09 92.14 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 123.159 0.584 . . . . 0.0 111.913 179.151 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 58.5 tp -57.59 -53.19 60.96 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 124.66 1.184 . . . . 0.0 110.84 175.858 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 38.6 t80 -53.73 -41.42 67.05 Favored 'General case' 0 CA--C 1.543 0.693 0 N-CA-C 112.886 0.699 . . . . 0.0 112.886 175.308 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 83.2 mt -72.93 -33.08 65.72 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 124.203 1.001 . . . . 0.0 113.457 178.813 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 25.6 t -65.83 -43.91 93.07 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.922 0 C-N-CA 124.343 1.057 . . . . 0.0 110.344 170.78 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 69.5 m -73.07 -39.56 65.78 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 122.952 0.501 . . . . 0.0 112.335 -178.206 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 62.83 -104.35 0.78 Allowed Glycine 0 CA--C 1.533 1.176 0 C-N-CA 124.244 0.926 . . . . 0.0 112.059 174.006 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -77.05 -21.42 54.51 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 124.362 1.065 . . . . 0.0 113.854 175.045 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 1.4 mpp_? -73.52 154.01 40.05 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 123.528 0.731 . . . . 0.0 109.985 166.866 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . -77.4 -171.31 35.75 Favored Glycine 0 CA--C 1.534 1.267 0 C-N-CA 124.154 0.883 . . . . 0.0 111.248 166.101 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 43.8 p90 -156.53 162.96 39.9 Favored 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 113.969 1.1 . . . . 0.0 113.969 179.405 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 92.0 t80 -155.39 109.05 2.82 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 125.436 1.494 . . . . 0.0 110.412 169.584 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 31.3 p90 -79.81 155.05 28.05 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 124.776 1.23 . . . . 0.0 112.199 173.99 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 46.2 p -117.75 86.08 23.46 Favored Pre-proline 0 N--CA 1.478 0.955 0 C-N-CA 125.317 1.447 . . . . 0.0 111.328 -176.601 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 23.5 Cg_endo -91.36 -174.79 0.66 Allowed 'Trans proline' 0 CA--C 1.541 0.868 0 C-N-CA 124.373 3.382 . . . . 0.0 112.442 -177.157 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 2.4 ptpp? -159.06 161.46 36.51 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 126.227 1.811 . . . . 0.0 112.124 164.414 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 17.4 p . . . . . 0 C--O 1.253 1.267 0 C-N-CA 125.779 1.632 . . . . 0.0 113.181 177.676 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.581 0 N-CA-C 111.833 -0.507 . . . . 0.0 111.833 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 18.8 tt -61.95 -38.52 80.89 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.986 0 N-CA-C 114.432 1.271 . . . . 0.0 114.432 -167.696 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 61.5 t -68.51 -36.26 73.94 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.075 0 CA-C-N 120.004 1.274 . . . . 0.0 110.971 -176.653 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 79.5 mm-40 -72.13 -43.32 64.89 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 118.761 0.71 . . . . 0.0 111.149 171.912 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 66.3 tp60 -63.08 -36.24 82.93 Favored 'General case' 0 CA--C 1.534 0.34 0 O-C-N 121.744 -0.598 . . . . 0.0 112.135 -178.794 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 68.3 m -85.77 -29.8 23.55 Favored 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 114.575 1.324 . . . . 0.0 114.575 179.641 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 17.6 t -107.47 -41.67 5.01 Favored 'General case' 0 N--CA 1.473 0.698 0 N-CA-C 113.59 0.959 . . . . 0.0 113.59 -169.53 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 44.3 m -84.54 -46.34 11.69 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 125.013 1.325 . . . . 0.0 109.596 176.132 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 31.4 m -96.8 -162.74 0.98 Allowed 'General case' 0 CA--C 1.55 0.961 0 C-N-CA 124.643 1.177 . . . . 0.0 111.278 166.63 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 12.1 tt -111.38 148.3 14.74 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.944 0 C-N-CA 125.469 1.508 . . . . 0.0 110.154 170.996 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 14.7 p -135.5 163.12 30.81 Favored 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 113.554 0.946 . . . . 0.0 113.554 179.911 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 36.2 t -103.0 156.45 17.66 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 124.46 1.104 . . . . 0.0 112.6 177.07 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 69.0 mt -60.12 -30.0 69.0 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 123.977 0.911 . . . . 0.0 111.606 169.964 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 77.2 t80 -65.07 -27.39 68.74 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 123.997 0.919 . . . . 0.0 113.287 171.66 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 86.9 mt-30 -85.32 -33.16 22.15 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 124.061 0.944 . . . . 0.0 110.826 175.685 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 9.5 mp -56.18 -47.52 78.16 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 118.555 0.616 . . . . 0.0 110.749 165.274 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -66.35 -31.22 71.87 Favored 'General case' 0 CA--C 1.546 0.79 0 N-CA-C 112.817 0.673 . . . . 0.0 112.817 177.68 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 24.3 t30 -64.36 -26.94 68.69 Favored 'General case' 0 CA--C 1.547 0.856 0 O-C-N 120.953 -1.092 . . . . 0.0 112.902 173.934 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 10.7 m-85 -85.03 8.07 19.16 Favored 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 125.329 1.452 . . . . 0.0 114.02 171.901 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 73.3 m -112.11 168.32 9.7 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 125.153 1.381 . . . . 0.0 113.408 175.556 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 23.7 t-20 . . . . . 0 C--O 1.253 1.241 0 C-N-CA 124.875 1.27 . . . . 0.0 113.084 179.337 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 12.7 p90 . . . . . 0 N--CA 1.485 1.3 0 N-CA-C 111.359 0.133 . . . . 0.0 111.359 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 30.6 m -137.98 160.54 33.08 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.225 0 C-N-CA 125.832 1.653 . . . . 0.0 110.857 176.315 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 44.4 p-10 -113.4 147.39 37.84 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 124.842 1.257 . . . . 0.0 113.541 177.308 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 44.8 mt-30 -150.86 158.9 44.72 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 125.796 1.638 . . . . 0.0 110.953 -172.334 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 96.9 m-70 -87.52 127.78 35.24 Favored 'General case' 0 CA--C 1.54 0.59 0 N-CA-C 108.963 -0.754 . . . . 0.0 108.963 159.989 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 87.4 mt -140.62 131.41 25.84 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 125.876 1.67 . . . . 0.0 108.715 -173.476 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 71.7 m -138.07 146.23 42.7 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 124.483 1.113 . . . . 0.0 111.56 -172.861 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 55.57 -131.67 49.33 Favored Glycine 0 N--CA 1.471 0.978 0 C-N-CA 124.961 1.267 . . . . 0.0 114.208 165.262 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 22.6 m -59.13 -33.17 70.55 Favored 'General case' 0 N--CA 1.468 0.465 0 C-N-CA 124.241 1.016 . . . . 0.0 112.375 -179.543 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 75.2 m-70 -75.88 -27.8 57.89 Favored 'General case' 0 CA--C 1.542 0.639 0 O-C-N 121.065 -1.022 . . . . 0.0 112.813 176.336 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 54.9 tp -70.15 -46.79 63.98 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-N 119.104 0.865 . . . . 0.0 110.604 167.26 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 74.4 t -55.93 -43.0 73.41 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.306 0 CA-C-N 118.744 0.702 . . . . 0.0 111.43 174.675 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -60.45 -48.99 79.37 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 125.442 1.497 . . . . 0.0 111.477 173.039 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.35 -42.87 99.4 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 123.467 0.707 . . . . 0.0 112.673 179.215 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -52.71 -55.16 24.69 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-N 119.432 1.014 . . . . 0.0 110.58 172.576 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 70.6 t80 -60.21 -35.12 74.71 Favored 'General case' 0 CA--C 1.543 0.691 0 N-CA-C 113.471 0.915 . . . . 0.0 113.471 178.753 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 83.9 mt -74.93 -34.07 62.05 Favored 'General case' 0 N--CA 1.472 0.649 0 N-CA-C 113.524 0.935 . . . . 0.0 113.524 177.43 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 49.5 t -71.16 -42.89 75.58 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.918 0 C-N-CA 123.812 0.845 . . . . 0.0 110.765 174.544 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 70.2 m -102.67 -24.63 13.74 Favored 'General case' 0 N--CA 1.468 0.463 0 N-CA-C 114.771 1.397 . . . . 0.0 114.771 -165.76 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 64.59 -140.6 42.93 Favored Glycine 0 CA--C 1.534 1.231 0 C-N-CA 124.094 0.854 . . . . 0.0 112.315 -178.536 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 57.3 mp0 -65.03 -11.87 44.03 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 125.732 1.613 . . . . 0.0 114.19 -178.412 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 82.6 mtm180 -61.95 -28.79 69.79 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 124.195 0.998 . . . . 0.0 113.322 177.662 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 81.04 162.35 28.23 Favored Glycine 0 CA--C 1.532 1.155 0 C-N-CA 124.53 1.062 . . . . 0.0 112.918 -178.195 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 54.7 p90 -143.54 158.75 43.41 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 125.201 1.4 . . . . 0.0 113.48 -169.501 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 78.3 m-85 -108.0 159.37 16.61 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 126.573 1.949 . . . . 0.0 110.648 169.912 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 62.2 t80 -157.87 126.68 5.65 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 125.158 1.383 . . . . 0.0 110.682 -169.0 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 11.8 t -169.62 143.73 2.28 Favored Pre-proline 0 N--CA 1.482 1.164 0 C-N-CA 125.162 1.385 . . . . 0.0 112.679 -170.752 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 41.2 Cg_endo -81.42 -132.8 0.01 OUTLIER 'Trans proline' 0 CA--C 1.54 0.8 0 C-N-CA 125.051 3.834 . . . . 0.0 110.179 172.826 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 28.4 ttpp -60.59 119.91 9.0 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 124.294 1.038 . . . . 0.0 112.592 -174.993 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 8.2 p . . . . . 0 C--O 1.253 1.248 0 C-N-CA 126.934 2.094 . . . . 0.0 112.423 -179.403 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.467 0 N-CA-C 111.841 -0.504 . . . . 0.0 111.841 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 48.5 pt -59.97 -29.46 43.42 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.968 0 C-N-CA 124.08 0.952 . . . . 0.0 113.142 -176.91 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 56.1 t -61.55 -31.66 51.28 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.07 0 CA-C-N 118.918 0.781 . . . . 0.0 112.08 177.938 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 14.4 mm-40 -82.84 -56.25 3.93 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 118.286 0.493 . . . . 0.0 110.618 167.333 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 1.2 tm0? -60.86 -46.41 90.71 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 123.035 0.534 . . . . 0.0 112.237 -166.673 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 70.4 m -76.65 -21.41 55.49 Favored 'General case' 0 N--CA 1.467 0.398 0 N-CA-C 114.289 1.218 . . . . 0.0 114.289 -177.339 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 10.6 t -100.69 -32.3 10.8 Favored 'General case' 0 CA--C 1.541 0.598 0 N-CA-C 113.244 0.831 . . . . 0.0 113.244 -173.851 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 44.5 p -95.76 -14.63 23.16 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 125.211 1.404 . . . . 0.0 113.429 176.586 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 84.3 p -144.34 -174.49 4.32 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 125.546 1.538 . . . . 0.0 110.173 174.279 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 16.9 tt -91.38 138.05 20.54 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.817 0 O-C-N 120.614 -1.304 . . . . 0.0 110.388 178.652 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 8.7 p -132.29 159.05 40.25 Favored 'General case' 0 N--CA 1.469 0.51 0 O-C-N 121.207 -0.933 . . . . 0.0 113.014 178.547 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 36.7 m -106.96 162.32 13.94 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 124.787 1.235 . . . . 0.0 111.145 -175.852 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 24.8 mt -59.32 -33.0 70.58 Favored 'General case' 0 CA--C 1.535 0.393 0 O-C-N 121.164 -0.96 . . . . 0.0 110.934 172.108 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 89.3 t80 -60.15 -33.16 71.78 Favored 'General case' 0 CA--C 1.546 0.815 0 N-CA-C 113.821 1.045 . . . . 0.0 113.821 170.68 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 14.0 mm100 -75.18 -33.92 61.5 Favored 'General case' 0 N--CA 1.471 0.589 0 O-C-N 121.537 -0.727 . . . . 0.0 111.217 174.941 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 93.2 mt -65.85 -44.33 85.8 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-N 118.307 0.503 . . . . 0.0 111.165 170.45 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -68.67 -26.83 65.51 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 125.325 1.45 . . . . 0.0 112.94 -177.078 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 18.6 t30 -52.73 -32.65 44.18 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 124.922 1.289 . . . . 0.0 113.771 179.773 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 84.3 m-85 -96.1 0.37 51.32 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 125.112 1.365 . . . . 0.0 114.365 -177.366 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 88.8 m -91.35 167.03 12.59 Favored 'General case' 0 CA--C 1.542 0.635 0 N-CA-C 114.333 1.234 . . . . 0.0 114.333 178.941 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.252 1.204 0 C-N-CA 127.129 2.172 . . . . 0.0 110.919 -176.008 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 67.0 m-85 . . . . . 0 N--CA 1.484 1.257 0 CA-C-O 119.807 -0.139 . . . . 0.0 111.184 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 7.1 p -158.45 155.83 4.32 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.082 0 C-N-CA 125.005 1.322 . . . . 0.0 111.1 -175.982 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 44.2 p-10 -69.18 146.99 51.96 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 124.541 1.136 . . . . 0.0 112.403 172.806 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 41.4 mt-30 -148.34 162.55 39.3 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.039 0.936 . . . . 0.0 111.625 -160.535 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 95.7 m-70 -88.26 132.63 34.31 Favored 'General case' 0 CA--C 1.54 0.57 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 157.689 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 91.5 mt -144.43 132.5 21.6 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 125.347 1.459 . . . . 0.0 109.406 -174.668 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 62.6 m -139.52 151.2 45.94 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 125.159 1.384 . . . . 0.0 110.641 -175.909 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 57.78 -133.14 52.79 Favored Glycine 0 N--CA 1.473 1.112 0 C-N-CA 124.499 1.047 . . . . 0.0 114.466 165.558 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 13.5 t -59.1 -39.41 82.14 Favored 'General case' 0 N--CA 1.472 0.645 0 O-C-N 121.928 -0.748 . . . . 0.0 111.776 -179.875 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 22.1 m-70 -67.39 -29.56 69.1 Favored 'General case' 0 CA--C 1.544 0.716 0 O-C-N 120.524 -1.36 . . . . 0.0 112.62 178.285 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 55.9 tp -69.46 -40.32 77.21 Favored 'General case' 0 CA--C 1.54 0.572 0 O-C-N 121.524 -0.735 . . . . 0.0 111.508 169.753 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 85.5 t -60.87 -45.49 98.07 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.269 0 C-N-CA 123.101 0.56 . . . . 0.0 110.794 172.926 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -61.26 -48.1 82.98 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 124.039 0.936 . . . . 0.0 111.138 177.639 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.48 -47.59 84.95 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 118.499 0.59 . . . . 0.0 111.686 -179.612 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 61.6 tp -55.3 -52.67 62.71 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 124.57 1.148 . . . . 0.0 111.571 176.164 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 25.9 t80 -57.55 -42.27 82.64 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 123.733 0.813 . . . . 0.0 112.629 175.863 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 81.8 mt -74.95 -32.25 61.69 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 124.145 0.978 . . . . 0.0 113.195 -177.678 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 26.8 t -66.08 -47.42 85.0 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.857 0 C-N-CA 123.882 0.873 . . . . 0.0 110.405 171.563 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 85.7 m -84.1 -27.46 28.19 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 113.059 0.763 . . . . 0.0 113.059 -172.2 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 69.1 -118.33 8.65 Favored Glycine 0 N--CA 1.468 0.786 0 C-N-CA 124.837 1.208 . . . . 0.0 112.221 169.141 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -70.58 -19.53 62.85 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 124.38 1.072 . . . . 0.0 113.702 175.591 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 89.3 mtm180 -72.59 158.77 35.04 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 124.976 1.31 . . . . 0.0 111.524 177.433 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . -78.22 147.62 31.86 Favored Glycine 0 N--CA 1.467 0.745 0 N-CA-C 110.939 -0.864 . . . . 0.0 110.939 175.152 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 52.6 p90 -128.02 160.1 32.96 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 124.141 0.976 . . . . 0.0 113.054 179.572 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 27.6 t80 -138.46 119.56 14.51 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 124.818 1.247 . . . . 0.0 110.67 175.376 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 81.4 t80 -87.57 89.63 8.07 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 125.808 1.643 . . . . 0.0 110.255 -175.319 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 27.8 p -72.44 123.9 90.11 Favored Pre-proline 0 N--CA 1.472 0.631 0 C-N-CA 123.287 0.635 . . . . 0.0 111.662 -172.426 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 16.5 Cg_endo -86.72 -142.11 0.02 OUTLIER 'Trans proline' 0 CA--C 1.54 0.797 0 C-N-CA 124.432 3.422 . . . . 0.0 111.724 -166.574 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 71.3 mmtt -69.78 12.47 0.2 Allowed 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 128.721 2.809 . . . . 0.0 115.081 -177.033 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 14.2 p . . . . . 0 C--O 1.252 1.205 0 C-N-CA 126.216 1.807 . . . . 0.0 113.985 176.682 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.765 0 N-CA-C 111.854 -0.498 . . . . 0.0 111.854 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 10.5 tp -59.69 -31.49 47.22 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.159 0 C-N-CA 124.116 0.967 . . . . 0.0 113.118 -174.258 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 82.9 t -59.22 -45.2 93.11 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.963 0 CA-C-N 118.465 0.575 . . . . 0.0 111.422 176.308 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -70.63 -42.79 70.42 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-N 119.108 0.867 . . . . 0.0 111.15 176.02 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 71.0 tp60 -58.96 -42.83 90.84 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 123.172 0.589 . . . . 0.0 111.647 -179.62 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 97.9 m -76.1 -31.35 58.66 Favored 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 114.487 1.292 . . . . 0.0 114.487 177.707 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 30.3 t -98.06 -43.5 7.02 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 113.468 0.914 . . . . 0.0 113.468 -167.852 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 64.3 m -88.97 -38.47 14.43 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 125.216 1.406 . . . . 0.0 110.926 179.81 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 9.5 t -107.91 -155.86 0.56 Allowed 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 124.923 1.289 . . . . 0.0 110.758 167.561 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 29.8 pt -107.81 152.39 9.55 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.565 0 C-N-CA 125.715 1.606 . . . . 0.0 111.609 172.912 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 14.0 p -139.57 164.21 30.52 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 123.799 0.84 . . . . 0.0 112.276 171.997 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 32.8 t -107.23 156.65 18.62 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 124.111 0.964 . . . . 0.0 113.068 179.251 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 62.9 mt -60.21 -33.08 71.74 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 124.176 0.991 . . . . 0.0 111.081 170.051 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 79.9 t80 -61.85 -28.6 69.6 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 124.685 1.194 . . . . 0.0 113.287 172.241 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 86.1 mt-30 -82.1 -39.56 23.19 Favored 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 123.642 0.777 . . . . 0.0 110.955 174.033 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 40.5 mt -58.16 -37.52 74.86 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-N 118.905 0.775 . . . . 0.0 112.218 172.662 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -59.01 -30.81 68.27 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 124.271 1.028 . . . . 0.0 113.181 179.216 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 89.0 m-20 -66.46 -18.78 65.55 Favored 'General case' 0 CA--C 1.544 0.725 0 O-C-N 121.127 -0.983 . . . . 0.0 113.511 179.196 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 92.2 m-85 -92.93 -7.41 46.13 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.177 1.391 . . . . 0.0 113.341 177.163 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 13.7 t -72.38 154.34 40.96 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 124.835 1.254 . . . . 0.0 112.162 171.323 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 20.1 t-20 . . . . . 0 C--O 1.251 1.144 0 C-N-CA 124.562 1.145 . . . . 0.0 111.929 170.446 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 20.7 p90 . . . . . 0 N--CA 1.486 1.368 0 N-CA-C 111.346 0.128 . . . . 0.0 111.346 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 27.1 m -141.14 158.38 22.74 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.113 0 C-N-CA 125.782 1.633 . . . . 0.0 111.162 -179.582 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 11.2 p30 -108.33 149.41 28.7 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 124.857 1.263 . . . . 0.0 112.562 173.235 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 39.3 mt-30 -151.69 167.81 26.99 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.836 1.654 . . . . 0.0 111.224 -171.857 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 99.5 m-70 -87.02 133.34 33.6 Favored 'General case' 0 CA--C 1.541 0.63 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 153.312 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 85.4 mt -145.55 138.72 26.25 Favored 'General case' 0 N--CA 1.466 0.374 0 C-N-CA 126.039 1.736 . . . . 0.0 108.806 -177.812 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 3.3 t -155.79 153.88 30.51 Favored 'General case' 0 N--CA 1.47 0.53 0 O-C-N 121.373 -0.83 . . . . 0.0 112.357 -175.899 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 50.6 -127.44 26.9 Favored Glycine 0 N--CA 1.472 1.042 0 C-N-CA 125.185 1.374 . . . . 0.0 113.69 175.327 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 16.1 m -58.27 -34.75 70.85 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 124.193 0.997 . . . . 0.0 112.556 178.881 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 80.5 m-70 -76.19 -27.54 56.94 Favored 'General case' 0 CA--C 1.541 0.614 0 O-C-N 121.363 -0.836 . . . . 0.0 113.121 178.477 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 56.3 tp -69.17 -45.41 70.08 Favored 'General case' 0 N--CA 1.469 0.492 0 O-C-N 121.423 -0.798 . . . . 0.0 110.889 168.042 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 77.7 t -62.59 -37.28 78.52 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.08 0 C-N-CA 123.607 0.763 . . . . 0.0 111.467 175.715 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 43.9 tt0 -63.54 -48.55 77.02 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 125.174 1.389 . . . . 0.0 111.462 172.507 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.51 -43.54 98.57 Favored 'General case' 0 CA--C 1.54 0.593 0 O-C-N 121.563 -0.71 . . . . 0.0 112.253 178.243 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 18.4 mt -54.7 -48.69 72.15 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 124.244 1.017 . . . . 0.0 111.008 171.67 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 80.6 t80 -62.85 -37.33 86.41 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 113.201 0.815 . . . . 0.0 113.201 176.193 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 78.5 mt -72.95 -34.65 66.66 Favored 'General case' 0 N--CA 1.47 0.564 0 O-C-N 121.266 -0.896 . . . . 0.0 112.891 178.551 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 44.8 t -73.3 -41.86 57.62 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 C-N-CA 124.236 1.014 . . . . 0.0 111.299 174.935 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 44.5 t -90.05 -30.73 17.53 Favored 'General case' 0 CA--C 1.537 0.479 0 N-CA-C 113.957 1.095 . . . . 0.0 113.957 -171.995 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 71.01 -155.71 52.89 Favored Glycine 0 CA--C 1.532 1.102 0 C-N-CA 124.223 0.916 . . . . 0.0 112.078 -171.093 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -71.34 -3.77 22.44 Favored 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 124.746 1.218 . . . . 0.0 113.98 179.734 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 58.5 mtp180 -57.8 -34.09 69.26 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 124.845 1.258 . . . . 0.0 113.178 175.49 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 88.04 147.0 12.5 Favored Glycine 0 CA--C 1.531 1.061 0 C-N-CA 125.349 1.452 . . . . 0.0 112.83 178.746 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 52.2 p90 -137.87 166.66 23.49 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 125.27 1.428 . . . . 0.0 112.21 -173.234 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 88.7 t80 -146.42 103.35 3.68 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 124.661 1.184 . . . . 0.0 110.279 174.377 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 44.6 p90 -76.07 178.84 6.03 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 125.246 1.418 . . . . 0.0 112.765 176.093 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 12.2 t -136.94 128.77 16.87 Favored Pre-proline 0 N--CA 1.476 0.843 0 C-N-CA 124.287 1.035 . . . . 0.0 111.673 173.017 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 42.5 Cg_endo -84.49 -175.65 2.22 Favored 'Trans proline' 0 C--N 1.351 0.659 0 C-N-CA 123.841 3.027 . . . . 0.0 112.102 -177.801 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 80.6 tttt -72.78 -25.39 61.15 Favored 'General case' 0 CA--C 1.55 0.943 0 C-N-CA 123.827 0.851 . . . . 0.0 112.843 168.671 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 8.3 m . . . . . 0 C--O 1.253 1.241 0 C-N-CA 127.011 2.125 . . . . 0.0 113.368 -175.279 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 1.275 0 N-CA-C 110.465 -1.054 . . . . 0.0 110.465 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 10.3 tp -111.15 -30.64 2.28 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.126 0 N-CA-C 113.161 0.8 . . . . 0.0 113.161 174.076 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 86.5 t -63.47 -44.85 98.98 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.036 0 CA-C-N 119.792 1.178 . . . . 0.0 112.334 -176.459 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -73.8 -36.44 65.01 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 119.344 0.974 . . . . 0.0 111.312 175.595 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 8.0 tt0 -61.42 -36.79 81.32 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 124.317 1.047 . . . . 0.0 111.882 179.699 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 95.6 m -88.65 -27.93 20.96 Favored 'General case' 0 CA--C 1.534 0.353 0 N-CA-C 114.679 1.363 . . . . 0.0 114.679 176.807 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 20.7 t -102.04 -46.05 4.98 Favored 'General case' 0 N--CA 1.475 0.781 0 N-CA-C 113.281 0.845 . . . . 0.0 113.281 -169.456 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 22.8 m -86.24 -44.72 11.93 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 125.39 1.476 . . . . 0.0 109.829 178.636 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 69.0 m -95.26 -169.55 2.0 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 124.567 1.147 . . . . 0.0 110.739 163.251 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 32.4 pt -108.35 144.94 16.03 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.755 0 C-N-CA 124.914 1.286 . . . . 0.0 110.403 169.485 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 19.3 p -126.41 151.82 47.17 Favored 'General case' 0 N--CA 1.47 0.575 0 C-N-CA 123.744 0.818 . . . . 0.0 112.332 176.683 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 90.1 p -91.05 166.93 12.74 Favored 'General case' 0 C--N 1.323 -0.56 0 C-N-CA 124.392 1.077 . . . . 0.0 113.428 174.648 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 46.6 mt -61.65 -34.78 76.3 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 123.339 0.656 . . . . 0.0 111.505 169.74 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 59.5 m-85 -66.4 -33.92 76.8 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.599 1.159 . . . . 0.0 112.698 175.001 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 85.5 mt-30 -75.29 -35.27 61.33 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 124.323 1.049 . . . . 0.0 112.026 173.056 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 93.3 mt -61.52 -42.04 98.21 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-N 119.582 1.083 . . . . 0.0 111.049 168.19 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -60.0 -30.18 68.96 Favored 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 123.936 0.895 . . . . 0.0 112.682 179.463 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 15.9 t-20 -64.54 -22.49 66.98 Favored 'General case' 0 CA--C 1.55 0.962 0 N-CA-C 113.402 0.889 . . . . 0.0 113.402 176.486 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 61.7 m-85 -99.34 2.4 45.32 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.644 1.578 . . . . 0.0 114.126 178.905 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 37.7 m -65.74 147.89 52.65 Favored 'General case' 0 N--CA 1.474 0.73 0 O-C-N 121.144 -0.973 . . . . 0.0 111.135 163.124 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.252 1.204 0 C-N-CA 123.835 0.854 . . . . 0.0 112.764 174.327 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 77.7 m-85 . . . . . 0 N--CA 1.486 1.357 0 CA-C-O 119.885 -0.102 . . . . 0.0 110.769 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 2.0 t 61.62 36.93 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.334 0 C-N-CA 125.27 1.428 . . . . 0.0 111.943 -179.185 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 9.3 m120 -79.71 138.11 37.24 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 125.854 1.662 . . . . 0.0 111.557 178.194 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 43.5 mt-30 -145.5 159.33 43.27 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 125.212 1.405 . . . . 0.0 110.64 -174.628 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 62.4 m-70 -82.31 127.46 33.24 Favored 'General case' 0 CA--C 1.537 0.456 0 N-CA-C 108.766 -0.827 . . . . 0.0 108.766 156.359 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 93.0 mt -141.87 132.68 25.75 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 126.014 1.726 . . . . 0.0 108.092 -177.726 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 3.0 t -153.84 153.92 32.99 Favored 'General case' 0 N--CA 1.468 0.434 0 O-C-N 121.044 -1.035 . . . . 0.0 112.279 -173.91 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 55.45 -129.54 46.59 Favored Glycine 0 CA--C 1.529 0.96 0 C-N-CA 125.097 1.332 . . . . 0.0 113.331 176.676 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 20.5 p -60.96 -33.99 74.05 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 124.506 1.123 . . . . 0.0 112.734 177.718 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 26.1 m80 -68.7 -36.66 78.76 Favored 'General case' 0 CA--C 1.542 0.652 0 O-C-N 121.229 -0.919 . . . . 0.0 111.708 176.292 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 55.7 tp -67.07 -46.04 75.49 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 123.072 0.549 . . . . 0.0 111.004 171.409 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 55.1 t -58.52 -42.56 84.86 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.992 0 C-N-CA 122.959 0.503 . . . . 0.0 111.126 177.011 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -64.98 -47.81 76.24 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 124.175 0.99 . . . . 0.0 111.415 176.562 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.7 -47.5 83.36 Favored 'General case' 0 CA--C 1.54 0.568 0 O-C-N 121.42 -0.8 . . . . 0.0 111.789 -179.508 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 31.0 tp -60.87 -45.65 93.7 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 124.388 1.075 . . . . 0.0 111.019 177.778 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 83.9 t80 -56.79 -43.66 81.14 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 123.621 0.768 . . . . 0.0 112.926 172.758 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 79.7 mt -72.75 -33.41 66.35 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 123.677 0.791 . . . . 0.0 113.04 -179.619 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 41.2 t -68.14 -43.34 85.13 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.739 0 C-N-CA 123.742 0.817 . . . . 0.0 111.105 172.837 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 83.5 m -82.35 -30.27 30.46 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 113.664 0.987 . . . . 0.0 113.664 -175.407 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 62.77 -131.24 43.36 Favored Glycine 0 CA--C 1.531 1.053 0 C-N-CA 124.487 1.041 . . . . 0.0 112.176 -178.771 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 31.1 mm-40 -64.9 -18.95 65.64 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 124.929 1.292 . . . . 0.0 114.193 -176.246 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -70.52 -43.08 70.34 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 124.128 0.971 . . . . 0.0 112.763 -174.19 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 86.19 -179.44 49.58 Favored Glycine 0 CA--C 1.534 1.28 0 C-N-CA 124.359 0.98 . . . . 0.0 113.017 -168.278 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 43.4 p90 -152.65 166.31 32.5 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 125.35 1.46 . . . . 0.0 113.261 -170.032 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 47.7 t80 -114.42 108.08 16.41 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.648 1.179 . . . . 0.0 110.01 169.137 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 60.2 t80 -75.05 94.48 2.89 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 125.089 1.355 . . . . 0.0 110.979 -177.112 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 52.1 m -93.52 117.47 67.35 Favored Pre-proline 0 N--CA 1.475 0.808 0 C-N-CA 124.4 1.08 . . . . 0.0 111.139 -168.623 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 67.0 Cg_endo -75.12 -169.5 0.65 Allowed 'Trans proline' 0 C--N 1.352 0.733 0 C-N-CA 124.504 3.469 . . . . 0.0 111.759 -176.613 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 22.9 tptm -55.02 121.9 9.74 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 123.865 0.866 . . . . 0.0 111.676 171.065 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 25.5 p . . . . . 0 C--O 1.254 1.32 0 C-N-CA 124.882 1.273 . . . . 0.0 112.634 176.272 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.684 0 N-CA-C 111.684 -0.566 . . . . 0.0 111.684 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 24.7 pt -85.24 -24.07 7.07 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.374 0 CA-C-N 118.805 1.302 . . . . 0.0 114.132 -179.37 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 45.4 t -63.19 -44.84 99.53 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.032 0 C-N-CA 123.9 0.88 . . . . 0.0 111.144 -168.194 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 14.2 pm0 -69.55 -30.61 68.46 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 125.398 1.479 . . . . 0.0 112.651 176.828 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 33.5 tt0 -73.5 -45.4 54.15 Favored 'General case' 0 N--CA 1.465 0.315 0 C-N-CA 124.093 0.957 . . . . 0.0 110.422 177.25 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 67.0 m -60.01 -24.07 64.18 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 124.545 1.138 . . . . 0.0 113.326 170.835 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 9.5 t -84.78 -51.36 6.84 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 124.129 0.972 . . . . 0.0 111.095 -179.644 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 47.2 p -79.68 -23.47 42.43 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 125.531 1.532 . . . . 0.0 113.721 -175.913 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.5 t -140.37 -173.7 3.75 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 125.857 1.663 . . . . 0.0 110.818 175.008 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 39.1 pt -81.86 144.37 10.49 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.398 0 O-C-N 120.905 -1.122 . . . . 0.0 111.539 175.634 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 12.6 p -137.29 165.69 25.57 Favored 'General case' 0 N--CA 1.466 0.329 0 C-N-CA 124.677 1.191 . . . . 0.0 110.979 166.958 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 96.0 p -108.54 166.55 10.7 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 124.374 1.07 . . . . 0.0 113.73 -174.92 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 56.1 mt -64.38 -35.26 80.32 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 123.376 0.67 . . . . 0.0 112.092 175.013 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 29.1 p90 -68.95 -32.23 71.67 Favored 'General case' 0 N--CA 1.468 0.452 0 O-C-N 121.103 -0.998 . . . . 0.0 113.19 174.034 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 39.0 mt-30 -70.92 -33.69 70.77 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-O 118.819 -0.61 . . . . 0.0 112.187 171.819 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 76.0 mt -65.29 -40.39 93.79 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-N 119.417 1.008 . . . . 0.0 111.608 167.086 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 23.1 tt0 -62.54 -24.02 67.29 Favored 'General case' 0 CA--C 1.54 0.579 0 N-CA-C 113.213 0.82 . . . . 0.0 113.213 -178.125 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 19.9 t-20 -57.58 -26.39 61.41 Favored 'General case' 0 CA--C 1.552 1.034 0 O-C-N 120.967 -1.083 . . . . 0.0 113.367 171.883 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 2.4 m-30 -89.73 -10.35 46.0 Favored 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 125.008 1.323 . . . . 0.0 113.839 174.705 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 64.0 m -70.41 158.76 35.41 Favored 'General case' 0 N--CA 1.479 1.003 0 CA-C-N 120.315 1.416 . . . . 0.0 111.823 171.77 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.253 1.255 0 N-CA-C 112.743 0.645 . . . . 0.0 112.743 166.86 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 69.5 m-85 . . . . . 0 N--CA 1.488 1.436 0 CA-C-O 120.466 0.174 . . . . 0.0 111.438 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 12.6 p -154.74 153.78 7.75 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.83 0 C-N-CA 126.558 1.943 . . . . 0.0 109.396 179.258 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -126.97 142.72 51.48 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 124.842 1.257 . . . . 0.0 113.414 179.54 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 44.7 mt-30 -149.06 163.93 36.11 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 125.683 1.593 . . . . 0.0 110.904 -170.822 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 36.0 m-70 -81.96 132.49 35.26 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 108.915 -0.772 . . . . 0.0 108.915 156.345 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 86.7 mt -146.11 135.2 22.68 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 126.541 1.936 . . . . 0.0 108.851 -177.06 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 4.4 t -151.91 153.57 34.39 Favored 'General case' 0 N--CA 1.467 0.424 0 O-C-N 121.445 -0.785 . . . . 0.0 112.395 -173.386 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 51.53 -132.05 35.02 Favored Glycine 0 CA--C 1.531 1.075 0 C-N-CA 125.38 1.466 . . . . 0.0 113.831 174.817 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 19.8 m -58.56 -36.7 74.32 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 124.341 1.056 . . . . 0.0 112.108 -179.899 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 19.5 m-70 -71.54 -30.8 66.32 Favored 'General case' 0 CA--C 1.541 0.603 0 O-C-N 121.148 -0.97 . . . . 0.0 112.478 179.007 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 7.8 tt -67.01 -44.54 80.08 Favored 'General case' 0 C--N 1.343 0.288 0 O-C-N 121.37 -0.831 . . . . 0.0 111.227 166.381 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 72.4 t -60.1 -38.3 76.42 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.072 0 CA-C-N 118.907 0.776 . . . . 0.0 111.525 177.467 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -63.74 -50.49 68.9 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.496 1.118 . . . . 0.0 111.669 171.604 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.45 -44.23 97.47 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 118.578 0.626 . . . . 0.0 112.21 179.946 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 48.0 tp -57.99 -53.05 62.66 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 125.738 1.615 . . . . 0.0 110.698 175.375 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 51.9 t80 -54.34 -42.21 69.97 Favored 'General case' 0 CA--C 1.543 0.676 0 N-CA-C 112.952 0.723 . . . . 0.0 112.952 174.053 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 77.3 mt -69.94 -35.44 74.52 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 123.983 0.913 . . . . 0.0 112.857 178.682 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 39.6 t -64.21 -44.39 97.45 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.853 0 C-N-CA 124.483 1.113 . . . . 0.0 111.039 170.603 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 56.5 m -73.17 -29.04 62.56 Favored 'General case' 0 CA--C 1.54 0.591 0 N-CA-C 112.961 0.726 . . . . 0.0 112.961 -179.002 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 70.57 -120.1 8.84 Favored Glycine 0 CA--C 1.529 0.918 0 C-N-CA 125.03 1.3 . . . . 0.0 110.748 177.492 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 37.4 mp0 -67.3 -22.4 65.63 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 124.581 1.152 . . . . 0.0 112.659 173.566 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 56.2 mtm-85 -79.18 153.97 29.63 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 124.479 1.111 . . . . 0.0 111.451 -179.724 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . -86.76 -178.35 49.21 Favored Glycine 0 CA--C 1.529 0.943 0 C-N-CA 125.128 1.347 . . . . 0.0 112.618 172.327 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 42.0 p90 -146.06 151.94 38.53 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 124.659 1.183 . . . . 0.0 114.15 -176.74 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 64.1 t80 -81.21 160.38 24.32 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 126.458 1.903 . . . . 0.0 109.76 161.151 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 68.8 t80 -159.41 139.12 11.6 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 124.966 1.306 . . . . 0.0 111.718 -178.886 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 9.6 t -170.0 127.42 0.78 Allowed Pre-proline 0 N--CA 1.479 0.987 0 C-N-CA 126.144 1.778 . . . . 0.0 111.486 171.585 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 21.5 Cg_endo -87.96 -156.5 0.06 OUTLIER 'Trans proline' 0 CA--C 1.54 0.79 0 C-N-CA 124.641 3.561 . . . . 0.0 111.268 179.767 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 47.2 tttp -60.53 139.45 57.76 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 124.271 1.028 . . . . 0.0 113.34 176.646 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 28.4 m . . . . . 0 C--O 1.253 1.247 0 C-N-CA 125.986 1.714 . . . . 0.0 111.065 165.225 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.533 0 N-CA-C 111.533 -0.627 . . . . 0.0 111.533 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 13.9 tt -166.97 -58.6 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.474 0.761 0 C-N-CA 126.374 1.869 . . . . 0.0 112.801 -171.557 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 78.0 t -74.56 -23.94 18.29 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.321 0 CA-C-N 120.798 1.636 . . . . 0.0 113.525 -169.217 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 68.5 mm-40 -100.79 -44.12 5.89 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 119.074 0.852 . . . . 0.0 109.923 164.378 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 54.7 tt0 -59.21 -45.26 91.56 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 123.967 0.907 . . . . 0.0 113.159 -172.354 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 2.6 t -84.71 -16.74 40.71 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-N 119.756 1.162 . . . . 0.0 113.381 -177.07 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 79.5 m -76.53 -41.67 45.93 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 123.966 0.906 . . . . 0.0 111.809 170.992 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 72.3 p -93.94 -36.31 12.24 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 125.147 1.379 . . . . 0.0 112.928 -175.001 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.9 t -121.08 -160.2 0.84 Allowed 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 126.268 1.827 . . . . 0.0 110.255 174.342 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 69.5 mt -103.3 144.39 14.0 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.746 0 C-N-CA 125.555 1.542 . . . . 0.0 110.163 -178.129 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 15.1 p -130.92 157.7 42.23 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 123.845 0.858 . . . . 0.0 112.749 164.472 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 59.6 p -95.33 162.91 13.48 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 124.784 1.234 . . . . 0.0 113.234 177.358 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 51.6 mt -61.47 -33.39 73.68 Favored 'General case' 0 N--CA 1.468 0.462 0 O-C-N 121.502 -0.749 . . . . 0.0 111.781 172.027 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 58.2 m-85 -65.15 -33.9 77.12 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 123.853 0.861 . . . . 0.0 112.654 173.824 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 90.0 mt-30 -75.76 -34.41 60.25 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 124.061 0.944 . . . . 0.0 111.567 174.166 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 83.3 mt -62.45 -41.11 98.5 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 119.767 1.167 . . . . 0.0 111.49 167.967 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 31.8 tt0 -62.92 -27.32 69.29 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 123.669 0.788 . . . . 0.0 112.89 -179.482 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 15.5 t-20 -59.79 -21.89 61.44 Favored 'General case' 0 CA--C 1.549 0.919 0 N-CA-C 113.485 0.92 . . . . 0.0 113.485 175.237 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 86.5 m-85 -97.39 -0.58 46.05 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 125.419 1.488 . . . . 0.0 114.266 178.255 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 55.5 m -66.66 149.87 49.88 Favored 'General case' 0 CA--C 1.543 0.676 0 O-C-N 121.071 -1.018 . . . . 0.0 111.356 167.424 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 33.3 m120 . . . . . 0 C--O 1.251 1.139 0 C-N-CA 124.896 1.278 . . . . 0.0 112.63 173.478 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 30.6 p90 . . . . . 0 N--CA 1.484 1.243 0 CA-C-O 119.642 -0.218 . . . . 0.0 110.63 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . 0.277 26.9 m 45.65 66.87 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.173 0 C-N-CA 126.097 1.759 . . . . 0.0 113.012 -169.954 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 1.5 p-10 -148.54 142.62 25.96 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 124.894 1.278 . . . . 0.0 112.974 -172.787 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 28.6 mm-40 -152.57 167.94 27.21 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 125.302 1.441 . . . . 0.0 112.041 -169.041 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 98.2 m-70 -83.21 138.23 33.7 Favored 'General case' 0 CA--C 1.543 0.682 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 155.903 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 79.2 mt -151.86 133.95 15.07 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 124.907 1.283 . . . . 0.0 109.08 -175.156 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 2.0 t -151.59 152.05 32.37 Favored 'General case' 0 N--CA 1.465 0.318 0 N-CA-C 112.8 0.667 . . . . 0.0 112.8 -177.815 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 60.99 -130.68 47.95 Favored Glycine 0 CA--C 1.529 0.969 0 C-N-CA 124.886 1.231 . . . . 0.0 113.472 175.543 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 19.8 p -61.3 -33.69 73.99 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 124.016 0.927 . . . . 0.0 112.161 179.481 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 11.6 m80 -64.36 -40.95 96.86 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 124.461 1.104 . . . . 0.0 111.557 176.472 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 60.2 tp -68.33 -43.67 77.02 Favored 'General case' 0 N--CA 1.468 0.433 0 C-N-CA 124.119 0.968 . . . . 0.0 111.461 176.001 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 79.5 t -64.35 -37.77 80.81 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.958 0 C-N-CA 123.422 0.689 . . . . 0.0 111.858 176.172 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -67.19 -45.44 76.88 Favored 'General case' 0 N--CA 1.466 0.375 0 C-N-CA 124.196 0.999 . . . . 0.0 111.581 173.722 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.43 -45.29 91.98 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 123.173 0.589 . . . . 0.0 111.735 176.976 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 27.4 mt -53.63 -54.79 32.67 Favored 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 124.29 1.036 . . . . 0.0 111.526 171.371 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 90.0 t80 -54.86 -42.48 72.06 Favored 'General case' 0 CA--C 1.543 0.688 0 N-CA-C 112.763 0.653 . . . . 0.0 112.763 177.774 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 92.4 mt -74.65 -35.36 62.85 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 124.158 0.983 . . . . 0.0 113.274 -178.893 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 33.9 t -68.07 -43.89 84.98 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 C-N-CA 124.034 0.934 . . . . 0.0 110.664 173.661 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 84.6 m -77.43 -32.11 54.41 Favored 'General case' 0 CA--C 1.54 0.591 0 N-CA-C 112.782 0.66 . . . . 0.0 112.782 -176.409 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 69.14 -119.76 9.85 Favored Glycine 0 N--CA 1.467 0.746 0 C-N-CA 124.354 0.978 . . . . 0.0 111.438 174.927 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -64.25 -24.49 67.68 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 124.839 1.255 . . . . 0.0 112.658 174.203 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 83.9 mtm180 -75.56 146.22 40.62 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 124.625 1.17 . . . . 0.0 110.95 175.896 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . -75.72 178.62 47.98 Favored Glycine 0 N--CA 1.475 1.248 0 C-N-CA 123.4 0.524 . . . . 0.0 111.968 166.514 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 55.0 p90 -148.27 161.23 41.93 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 124.074 0.949 . . . . 0.0 113.231 174.343 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 83.3 t80 -146.22 99.37 3.23 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 124.896 1.278 . . . . 0.0 110.145 171.613 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -68.27 167.12 15.02 Favored 'General case' 0 CA--C 1.553 1.06 0 C-N-CA 125.183 1.393 . . . . 0.0 113.589 168.305 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 16.8 p -57.58 -36.39 45.08 Favored Pre-proline 0 N--CA 1.483 1.204 0 N-CA-C 116.699 2.111 . . . . 0.0 116.699 -159.22 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 17.0 Cg_endo -102.17 65.21 0.38 Allowed 'Cis proline' 0 CA--C 1.541 0.873 0 CA-C-N 122.992 2.104 . . . . 0.0 110.112 -24.182 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -151.48 6.18 0.47 Allowed 'General case' 0 N--CA 1.482 1.16 0 N-CA-C 114.714 1.375 . . . . 0.0 114.714 -174.737 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 20.0 p . . . . . 0 C--O 1.248 1.026 0 C-N-CA 128.317 2.647 . . . . 0.0 109.057 -178.638 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.658 0 N-CA-C 111.607 -0.597 . . . . 0.0 111.607 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 45.7 pt -93.91 4.49 8.0 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.441 0 N-CA-C 115.042 1.497 . . . . 0.0 115.042 -169.074 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 60.5 t -54.34 -44.07 64.76 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.273 0 C-N-CA 124.74 1.216 . . . . 0.0 112.553 -176.541 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -76.44 -44.0 37.68 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 122.858 0.463 . . . . 0.0 110.83 173.602 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -59.22 -49.17 78.87 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 124.827 1.251 . . . . 0.0 111.822 -173.063 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 8.1 t -74.91 -17.99 60.48 Favored 'General case' 0 N--CA 1.472 0.626 0 N-CA-C 113.542 0.941 . . . . 0.0 113.542 -176.696 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 42.3 t -90.06 -41.41 11.7 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 124.977 1.311 . . . . 0.0 112.46 177.286 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 50.1 m -82.35 -44.68 15.87 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 126.718 2.007 . . . . 0.0 110.572 -177.784 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 73.0 m -108.77 -132.4 0.32 Allowed 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 125.948 1.699 . . . . 0.0 108.512 165.851 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 29.8 pt -136.73 161.9 35.64 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.776 0 C-N-CA 125.843 1.657 . . . . 0.0 112.184 -174.363 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 13.8 p -150.81 162.96 39.74 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 123.664 0.786 . . . . 0.0 112.38 167.046 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 10.8 t -106.88 164.11 12.39 Favored 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 125.3 1.44 . . . . 0.0 112.752 -177.919 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 28.5 mt -60.36 -35.62 76.11 Favored 'General case' 0 N--CA 1.468 0.425 0 C-N-CA 124.724 1.209 . . . . 0.0 111.945 -178.526 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 80.3 t80 -62.93 -29.98 71.21 Favored 'General case' 0 CA--C 1.543 0.685 0 N-CA-C 113.665 0.987 . . . . 0.0 113.665 172.349 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 75.8 mt-30 -82.2 -30.95 30.59 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 123.724 0.809 . . . . 0.0 111.376 176.649 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 88.4 mt -60.81 -48.91 79.64 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-N 118.503 0.592 . . . . 0.0 110.667 164.862 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 28.7 tt0 -63.0 -24.48 67.94 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 123.873 0.869 . . . . 0.0 112.938 -176.524 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 26.4 t30 -57.68 -27.26 62.74 Favored 'General case' 0 CA--C 1.549 0.932 0 O-C-N 121.118 -0.989 . . . . 0.0 113.422 174.893 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 64.7 m-85 -89.25 -3.8 58.41 Favored 'General case' 0 CA--C 1.548 0.887 0 C-N-CA 125.215 1.406 . . . . 0.0 113.714 176.965 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 79.8 m -93.83 164.51 13.09 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 124.857 1.263 . . . . 0.0 113.203 176.141 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.247 0.962 0 C-N-CA 125.781 1.633 . . . . 0.0 110.521 170.154 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 53.6 m-85 . . . . . 0 N--CA 1.489 1.482 0 CA-C-O 118.978 -0.534 . . . . 0.0 110.445 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 7.5 p -165.92 131.42 0.47 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.039 0 C-N-CA 125.261 1.425 . . . . 0.0 110.356 -177.656 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 11.9 p30 -97.98 150.3 21.51 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 124.867 1.267 . . . . 0.0 113.209 -179.674 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 39.6 mt-30 -147.36 160.79 42.14 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 125.247 1.419 . . . . 0.0 110.657 -178.162 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 98.1 m-70 -81.36 127.11 32.4 Favored 'General case' 0 CA--C 1.54 0.576 0 N-CA-C 108.432 -0.951 . . . . 0.0 108.432 155.926 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 90.7 mt -143.28 130.0 20.33 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 124.679 1.192 . . . . 0.0 109.907 -177.204 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 83.8 m -128.72 141.23 51.39 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 124.805 1.242 . . . . 0.0 111.787 -174.926 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 49.0 -120.16 6.76 Favored Glycine 0 N--CA 1.473 1.153 0 C-N-CA 125.652 1.596 . . . . 0.0 114.525 164.556 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 25.3 m -58.2 -38.54 76.94 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 123.979 0.912 . . . . 0.0 112.481 -179.623 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 80.2 m-70 -75.37 -28.18 59.43 Favored 'General case' 0 CA--C 1.541 0.628 0 O-C-N 121.203 -0.936 . . . . 0.0 112.804 177.765 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 51.4 tp -67.23 -46.96 72.21 Favored 'General case' 0 N--CA 1.469 0.507 0 O-C-N 121.345 -0.847 . . . . 0.0 110.824 169.952 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 75.6 t -66.87 -33.88 66.3 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.019 0 C-N-CA 123.752 0.821 . . . . 0.0 111.651 176.591 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 43.2 tt0 -63.69 -49.82 71.65 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 124.987 1.315 . . . . 0.0 111.254 171.781 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -58.94 -45.61 90.01 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 123.159 0.584 . . . . 0.0 112.003 176.845 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 59.9 tp -55.37 -51.44 66.81 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 125.522 1.529 . . . . 0.0 111.745 174.633 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 80.9 t80 -58.61 -40.12 82.37 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 123.823 0.849 . . . . 0.0 112.849 175.062 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 85.8 mt -76.83 -34.35 57.89 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 124.075 0.95 . . . . 0.0 113.246 -177.913 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 27.3 t -63.22 -47.05 94.11 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.843 0 C-N-CA 124.267 1.027 . . . . 0.0 110.25 172.297 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 84.5 m -87.78 -23.78 23.98 Favored 'General case' 0 N--CA 1.471 0.579 0 N-CA-C 113.821 1.045 . . . . 0.0 113.821 -172.82 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 66.48 -115.06 7.0 Favored Glycine 0 CA--C 1.529 0.909 0 C-N-CA 124.625 1.107 . . . . 0.0 111.846 172.464 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -72.56 -19.88 61.42 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 123.844 0.858 . . . . 0.0 112.854 175.257 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 71.6 mtp180 -75.8 133.04 40.76 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 123.969 0.908 . . . . 0.0 109.72 172.932 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . -89.67 167.74 33.93 Favored Glycine 0 N--CA 1.469 0.842 0 C-N-CA 125.268 1.413 . . . . 0.0 113.094 -178.668 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 45.4 p90 -135.36 163.83 29.13 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 124.986 1.314 . . . . 0.0 113.595 -179.502 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 85.1 t80 -126.83 143.89 51.13 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 126.161 1.784 . . . . 0.0 108.484 162.478 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -146.89 144.86 29.58 Favored 'General case' 0 N--CA 1.476 0.833 0 N-CA-C 113.486 0.921 . . . . 0.0 113.486 -166.724 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 10.7 m -151.11 140.01 13.37 Favored Pre-proline 0 N--CA 1.476 0.843 0 C-N-CA 125.131 1.372 . . . . 0.0 109.57 -169.675 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 65.9 Cg_endo -77.38 -169.96 0.84 Allowed 'Trans proline' 0 CA--C 1.541 0.84 0 C-N-CA 123.676 2.917 . . . . 0.0 111.972 173.508 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 38.5 ttpt -63.41 -33.33 75.31 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 124.042 0.937 . . . . 0.0 113.483 179.961 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 22.4 p . . . . . 0 C--O 1.253 1.256 0 C-N-CA 126.05 1.74 . . . . 0.0 113.362 -176.854 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.549 0 N-CA-C 111.772 -0.531 . . . . 0.0 111.772 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 47.8 pt -90.61 -28.46 4.91 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.207 0 N-CA-C 114.855 1.428 . . . . 0.0 114.855 -172.398 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 16.6 t -66.84 -41.81 88.25 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.296 0 CA-C-N 119.795 1.179 . . . . 0.0 110.254 -171.071 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 4.9 pm0 -71.41 -0.09 9.47 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 127.322 2.249 . . . . 0.0 113.905 174.007 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 33.4 tt0 -104.72 -60.06 1.65 Allowed 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 123.861 0.865 . . . . 0.0 109.638 161.982 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 92.7 m -58.16 -30.9 66.75 Favored 'General case' 0 N--CA 1.467 0.411 0 N-CA-C 115.308 1.595 . . . . 0.0 115.308 -171.175 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 16.6 t -84.71 -38.94 19.11 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 123.194 0.598 . . . . 0.0 112.604 -172.553 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 22.0 p -99.97 -31.8 11.29 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 125.609 1.563 . . . . 0.0 113.618 -177.727 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.8 t -117.78 -166.2 1.18 Allowed 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 126.112 1.765 . . . . 0.0 110.206 172.603 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 14.9 tt -96.56 149.84 4.65 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.66 0 C-N-CA 124.631 1.172 . . . . 0.0 110.782 176.654 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 15.6 p -141.93 157.11 45.35 Favored 'General case' 0 N--CA 1.471 0.594 0 O-C-N 121.267 -0.896 . . . . 0.0 113.135 174.266 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 35.6 m -103.12 152.57 21.26 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 124.022 0.929 . . . . 0.0 112.335 -171.805 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 42.6 mt -60.27 -32.7 71.42 Favored 'General case' 0 N--CA 1.473 0.719 0 O-C-N 121.101 -0.999 . . . . 0.0 111.7 176.019 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 56.4 m-85 -61.77 -31.94 72.17 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 124.392 1.077 . . . . 0.0 113.534 172.422 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 97.1 mt-30 -79.96 -35.55 37.44 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 124.705 1.202 . . . . 0.0 110.833 175.415 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 63.1 mt -61.74 -39.01 90.08 Favored 'General case' 0 N--CA 1.473 0.684 0 CA-C-N 118.499 0.59 . . . . 0.0 111.946 168.662 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 28.8 tt0 -63.56 -30.53 71.63 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 123.419 0.688 . . . . 0.0 112.769 179.295 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 45.4 t30 -62.3 -20.77 64.66 Favored 'General case' 0 CA--C 1.55 0.977 0 O-C-N 120.924 -1.11 . . . . 0.0 113.007 173.417 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 1.4 m-85 -97.16 5.13 50.71 Favored 'General case' 0 CA--C 1.549 0.909 0 C-N-CA 125.989 1.715 . . . . 0.0 114.089 175.81 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 79.5 m -68.28 159.3 31.58 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-N 119.355 0.98 . . . . 0.0 112.682 169.034 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.253 1.278 0 C-N-CA 126.939 2.096 . . . . 0.0 110.504 179.478 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 40.0 t80 . . . . . 0 N--CA 1.486 1.374 0 CA-C-O 118.733 -0.651 . . . . 0.0 110.877 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 13.7 t -138.4 46.37 0.36 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.582 0 C-N-CA 126.357 1.863 . . . . 0.0 108.273 177.508 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 25.0 p-10 -163.72 144.32 8.73 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 125.834 1.654 . . . . 0.0 113.125 -160.035 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 45.5 mm-40 -153.4 164.51 38.03 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 125.486 1.514 . . . . 0.0 111.979 -169.516 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 98.4 m-70 -83.74 133.08 34.8 Favored 'General case' 0 CA--C 1.542 0.637 0 O-C-N 121.653 -0.655 . . . . 0.0 109.259 158.359 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 84.0 mt -150.49 135.17 17.4 Favored 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 124.83 1.252 . . . . 0.0 109.97 -170.722 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 3.6 t -154.45 155.54 35.12 Favored 'General case' 0 N--CA 1.468 0.439 0 O-C-N 121.488 -0.757 . . . . 0.0 111.869 -179.925 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 52.84 -129.3 38.37 Favored Glycine 0 N--CA 1.47 0.944 0 C-N-CA 124.923 1.249 . . . . 0.0 113.536 176.393 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 28.3 p -56.78 -36.48 69.9 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 125.028 1.331 . . . . 0.0 113.065 178.662 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 75.3 m-70 -73.76 -29.62 62.32 Favored 'General case' 0 CA--C 1.541 0.631 0 O-C-N 120.883 -1.136 . . . . 0.0 113.07 177.181 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 35.9 tp -71.59 -42.1 68.16 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 119.172 0.896 . . . . 0.0 110.774 170.291 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 49.7 t -59.07 -41.48 83.59 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.074 0 C-N-CA 124.032 0.933 . . . . 0.0 111.526 172.24 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 43.3 tt0 -63.78 -47.29 81.52 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 125.631 1.572 . . . . 0.0 111.779 174.655 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.8 -43.86 97.69 Favored 'General case' 0 CA--C 1.537 0.447 0 O-C-N 121.749 -0.594 . . . . 0.0 111.61 179.168 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 40.1 mt -56.69 -52.45 64.89 Favored 'General case' 0 N--CA 1.465 0.318 0 C-N-CA 123.675 0.79 . . . . 0.0 111.307 172.181 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 77.2 t80 -53.16 -41.39 65.11 Favored 'General case' 0 CA--C 1.542 0.658 0 N-CA-C 112.803 0.668 . . . . 0.0 112.803 176.044 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 88.6 mt -75.24 -36.44 61.29 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 124.401 1.08 . . . . 0.0 113.525 179.962 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 36.9 t -71.25 -41.38 74.8 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.038 0 C-N-CA 124.249 1.02 . . . . 0.0 110.617 176.186 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 86.3 m -81.47 -38.77 25.85 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 123.825 0.85 . . . . 0.0 112.246 -175.175 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 62.26 -100.52 0.31 Allowed Glycine 0 N--CA 1.472 1.048 0 C-N-CA 124.483 1.039 . . . . 0.0 112.813 172.051 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -69.93 -31.29 68.98 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 124.824 1.249 . . . . 0.0 112.458 174.302 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 1.3 mpp_? -75.52 153.88 37.21 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.072 0.949 . . . . 0.0 110.426 170.243 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . -81.44 -164.9 33.74 Favored Glycine 0 CA--C 1.531 1.064 0 C-N-CA 124.027 0.822 . . . . 0.0 111.26 165.12 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 51.3 p90 -154.63 156.92 37.39 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 124.192 0.997 . . . . 0.0 113.503 177.847 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 60.3 t80 -91.24 -40.54 11.47 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 125.08 1.352 . . . . 0.0 113.704 -176.103 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 48.1 t80 64.6 -59.74 0.22 Allowed 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 128.494 2.718 . . . . 0.0 116.291 179.066 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 23.9 p -62.94 147.92 93.21 Favored Pre-proline 0 N--CA 1.478 0.954 0 C-N-CA 124.856 1.262 . . . . 0.0 114.19 -158.117 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 91.2 Cg_endo -73.26 178.78 6.16 Favored 'Trans proline' 0 C--N 1.354 0.836 0 C-N-CA 124.312 3.341 . . . . 0.0 111.981 179.217 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 63.3 pttt -64.23 -16.85 62.86 Favored 'General case' 0 CA--C 1.547 0.861 0 N-CA-C 115.6 1.704 . . . . 0.0 115.6 -176.023 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 12.9 t . . . . . 0 C--O 1.252 1.209 0 C-N-CA 126.549 1.94 . . . . 0.0 112.235 -176.447 . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 1.279 0 N-CA-C 111.178 -0.769 . . . . 0.0 111.178 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 15.2 pt -97.62 -23.85 4.52 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.25 0 N-CA-C 114.282 1.216 . . . . 0.0 114.282 -179.974 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 99.1 t -74.73 -46.53 41.33 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.083 0 CA-C-N 119.224 0.92 . . . . 0.0 110.809 -166.844 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 5.5 pm0 -67.5 -32.45 73.27 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 124.388 1.075 . . . . 0.0 111.265 171.904 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 8.5 tt0 -66.41 -38.19 86.92 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 124.24 1.016 . . . . 0.0 111.617 179.726 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 3.3 t -88.79 -16.76 31.3 Favored 'General case' 0 CA--C 1.544 0.719 0 N-CA-C 114.247 1.203 . . . . 0.0 114.247 176.01 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 52.5 t -97.92 -53.53 3.37 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 124.864 1.266 . . . . 0.0 113.633 -175.819 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 38.5 m -77.97 -47.36 18.72 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 125.396 1.478 . . . . 0.0 109.701 -179.245 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 74.7 m -90.47 -152.85 0.28 Allowed 'General case' 0 CA--C 1.551 1.01 0 C-N-CA 123.737 0.815 . . . . 0.0 109.888 158.224 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 28.8 pt -132.13 154.57 40.37 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.99 0 O-C-N 120.485 -1.384 . . . . 0.0 111.902 -176.821 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 1.1 p -149.94 164.89 34.24 Favored 'General case' 0 N--CA 1.468 0.468 0 N-CA-C 112.98 0.733 . . . . 0.0 112.98 168.89 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 2.8 t -111.9 166.41 11.24 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 124.674 1.19 . . . . 0.0 113.521 -177.414 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 71.1 mt -59.15 -34.42 72.05 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 124.359 1.064 . . . . 0.0 111.967 178.107 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 78.1 m-85 -63.97 -28.77 70.04 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 124.276 1.03 . . . . 0.0 113.476 173.671 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 55.8 mt-30 -81.17 -37.76 28.22 Favored 'General case' 0 N--CA 1.467 0.405 0 C-N-CA 123.778 0.831 . . . . 0.0 110.916 173.65 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 45.0 mt -56.02 -44.89 79.16 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 119.132 0.878 . . . . 0.0 111.086 170.524 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -60.84 -30.91 70.4 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 124.117 0.967 . . . . 0.0 112.959 177.448 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 27.2 t30 -80.64 -31.44 36.47 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 124.341 1.056 . . . . 0.0 112.832 174.608 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 19.6 m-30 -68.15 -37.17 80.76 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 123.975 0.91 . . . . 0.0 112.212 173.466 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 72.1 m -64.98 163.46 14.57 Favored 'General case' 0 N--CA 1.473 0.717 0 N-CA-C 113.602 0.964 . . . . 0.0 113.602 178.482 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.252 1.225 0 C-N-CA 125.382 1.473 . . . . 0.0 111.532 -179.357 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 70.1 m-85 . . . . . 0 N--CA 1.486 1.355 0 N-CA-C 110.374 -0.232 . . . . 0.0 110.374 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 19.0 m -73.56 145.22 11.81 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.123 0 C-N-CA 128.318 2.647 . . . . 0.0 113.469 3.214 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 11.0 m120 72.81 128.21 0.04 OUTLIER 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 129.306 3.043 . . . . 0.0 112.951 176.934 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 27.7 mm-40 -145.15 164.81 30.14 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 125.373 1.469 . . . . 0.0 110.511 178.499 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 90.4 m-70 -83.59 117.21 23.0 Favored 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 107.785 -1.191 . . . . 0.0 107.785 160.832 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 94.3 mt -129.22 131.74 47.12 Favored 'General case' 0 N--CA 1.462 0.164 0 C-N-CA 124.859 1.263 . . . . 0.0 108.532 178.704 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -142.97 153.76 43.34 Favored 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 124.267 1.027 . . . . 0.0 111.517 -173.867 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 48.23 -126.69 15.55 Favored Glycine 0 N--CA 1.471 0.98 0 C-N-CA 125.578 1.561 . . . . 0.0 114.338 170.047 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 16.0 p -59.88 -38.91 83.58 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 124.579 1.152 . . . . 0.0 112.618 179.46 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 26.7 m170 -65.23 -37.87 88.63 Favored 'General case' 0 CA--C 1.544 0.718 0 O-C-N 121.076 -1.015 . . . . 0.0 111.803 177.74 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 56.6 tp -67.9 -44.23 77.44 Favored 'General case' 0 N--CA 1.466 0.37 0 C-N-CA 123.405 0.682 . . . . 0.0 111.117 172.234 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 53.5 t -59.02 -38.8 76.09 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.973 0 CA-C-N 118.836 0.744 . . . . 0.0 111.978 174.92 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -66.3 -45.71 79.44 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 123.87 0.868 . . . . 0.0 111.579 173.815 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.07 -46.37 90.92 Favored 'General case' 0 CA--C 1.543 0.681 0 CA-C-N 119.296 0.953 . . . . 0.0 111.901 176.794 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 32.5 mt -54.76 -50.28 68.82 Favored 'General case' 0 N--CA 1.466 0.333 0 C-N-CA 124.574 1.149 . . . . 0.0 111.436 173.174 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 88.4 t80 -62.36 -36.55 82.59 Favored 'General case' 0 CA--C 1.543 0.706 0 O-C-N 121.2 -0.938 . . . . 0.0 113.331 177.04 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 76.3 mt -73.01 -33.12 65.56 Favored 'General case' 0 N--CA 1.469 0.495 0 O-C-N 121.155 -0.966 . . . . 0.0 113.296 177.677 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 84.5 t -81.21 -37.1 15.49 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.93 0 C-N-CA 123.945 0.898 . . . . 0.0 111.469 176.869 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 44.0 m -124.8 6.03 8.09 Favored 'General case' 0 N--CA 1.473 0.691 0 N-CA-C 115.587 1.699 . . . . 0.0 115.587 -163.05 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . -57.53 -27.16 58.14 Favored Glycine 0 N--CA 1.479 1.533 0 N-CA-C 116.302 1.281 . . . . 0.0 116.302 -166.523 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -81.39 -21.55 38.91 Favored 'General case' 0 CA--C 1.548 0.871 0 N-CA-C 114.13 1.159 . . . . 0.0 114.13 174.709 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 75.9 mtp180 -91.52 -42.36 10.29 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 126.199 1.8 . . . . 0.0 112.23 177.961 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 97.31 136.98 9.35 Favored Glycine 0 CA--C 1.531 1.049 0 C-N-CA 125.651 1.596 . . . . 0.0 110.558 -163.155 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 46.8 p90 -105.1 165.12 11.31 Favored 'General case' 0 CA--C 1.538 0.519 0 N-CA-C 114.198 1.184 . . . . 0.0 114.198 -172.625 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 69.9 t80 -108.81 148.98 29.74 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 126.391 1.876 . . . . 0.0 109.92 175.609 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 64.8 t80 -160.96 117.86 2.31 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 124.673 1.189 . . . . 0.0 111.1 -175.843 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 20.2 p -142.45 114.85 6.23 Favored Pre-proline 0 N--CA 1.475 0.809 0 C-N-CA 125.186 1.394 . . . . 0.0 112.128 -174.704 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_endo -82.36 178.1 6.53 Favored 'Trans proline' 0 C--N 1.35 0.634 0 C-N-CA 124.184 3.256 . . . . 0.0 112.407 173.667 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 14.7 ptmm? -73.85 169.39 17.5 Favored 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 124.385 1.074 . . . . 0.0 113.058 169.706 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 21.6 m . . . . . 0 C--O 1.254 1.324 0 C-N-CA 125.271 1.428 . . . . 0.0 111.514 169.249 . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.563 0 CA-C-O 121.44 0.467 . . . . 0.0 112.039 . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 1.7 pp -70.58 -21.09 22.73 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.095 0 N-CA-C 114.006 1.113 . . . . 0.0 114.006 -164.994 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 45.3 t -58.83 -36.79 62.9 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.084 0 CA-C-N 118.947 0.794 . . . . 0.0 111.53 171.699 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 24.6 tt0 -78.8 -44.04 24.03 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-O 118.935 -0.555 . . . . 0.0 111.308 174.599 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -58.58 -49.79 76.18 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-N 118.572 0.624 . . . . 0.0 111.455 -177.558 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 16.5 m -60.89 -22.5 64.38 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 124.183 0.993 . . . . 0.0 113.392 176.935 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 49.7 t -96.93 -50.41 4.65 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 124.586 1.155 . . . . 0.0 112.824 -173.677 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 3.1 t -78.39 -35.46 47.16 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.398 1.079 . . . . 0.0 112.054 -179.221 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 30.9 m -107.74 -161.6 0.79 Allowed 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.235 1.414 . . . . 0.0 109.183 165.146 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 26.8 pt -109.49 157.55 9.83 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.734 0 C-N-CA 124.515 1.126 . . . . 0.0 110.878 174.787 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 18.1 p -140.62 160.39 40.13 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-O 121.615 0.721 . . . . 0.0 112.387 171.835 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 4.1 m -96.08 149.36 21.69 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 124.874 1.269 . . . . 0.0 111.896 -169.414 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 55.5 mt -57.27 -33.26 67.44 Favored 'General case' 0 N--CA 1.474 0.73 0 O-C-N 121.09 -1.006 . . . . 0.0 111.833 167.893 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 80.6 t80 -63.71 -30.81 71.86 Favored 'General case' 0 CA--C 1.543 0.682 0 N-CA-C 113.46 0.911 . . . . 0.0 113.46 172.491 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 45.9 mm-40 -80.99 -34.46 32.98 Favored 'General case' 0 CA--C 1.534 0.358 0 O-C-N 121.46 -0.775 . . . . 0.0 111.05 174.099 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 38.4 mt -58.18 -37.2 74.26 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 119.602 1.092 . . . . 0.0 111.296 167.095 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.43 ' HA ' ' SG ' ' A' ' 20' ' ' CYS . 24.7 tt0 -68.97 -35.3 76.58 Favored 'General case' 0 CA--C 1.545 0.768 0 N-CA-C 112.619 0.6 . . . . 0.0 112.619 173.74 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 62.3 t30 -64.74 -22.92 67.09 Favored 'General case' 0 CA--C 1.553 1.072 0 O-C-N 121.009 -1.057 . . . . 0.0 112.257 171.988 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 16.0 m-30 -91.65 -0.16 57.55 Favored 'General case' 0 CA--C 1.551 1.008 0 C-N-CA 125.802 1.641 . . . . 0.0 113.562 177.378 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.43 ' SG ' ' HA ' ' A' ' 17' ' ' GLU . 81.6 m -66.73 160.42 25.75 Favored 'General case' 0 N--CA 1.474 0.752 0 O-C-N 121.063 -1.023 . . . . 0.0 113.639 172.572 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 7.7 t-20 . . . . . 0 C--O 1.251 1.18 0 C-N-CA 128.661 2.784 . . . . 0.0 113.686 177.29 . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 68.3 m-85 . . . . . 0 N--CA 1.487 1.413 0 CA-C-O 120.332 0.111 . . . . 0.0 111.055 . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 11.0 p -154.46 150.18 12.06 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.988 0 C-N-CA 125.562 1.545 . . . . 0.0 110.335 178.991 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 61.6 m-20 -109.54 146.69 34.23 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 124.905 1.282 . . . . 0.0 111.601 179.301 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 38.3 mt-30 -143.26 158.7 43.4 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 124.445 1.098 . . . . 0.0 111.229 -179.257 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 95.8 m-70 -80.28 127.33 32.24 Favored 'General case' 0 CA--C 1.539 0.522 0 N-CA-C 108.639 -0.874 . . . . 0.0 108.639 156.623 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 98.5 mt -140.23 123.0 16.41 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 125.59 1.556 . . . . 0.0 109.242 -175.142 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 57.7 m -130.73 138.81 50.16 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 124.891 1.277 . . . . 0.0 110.727 -174.176 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 54.43 -123.67 28.78 Favored Glycine 0 N--CA 1.473 1.101 0 C-N-CA 124.86 1.219 . . . . 0.0 114.029 166.522 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 17.8 p -59.9 -35.47 74.93 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 124.35 1.06 . . . . 0.0 112.387 179.973 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 24.2 m80 -67.69 -38.27 83.44 Favored 'General case' 0 CA--C 1.541 0.607 0 O-C-N 121.25 -0.906 . . . . 0.0 111.714 177.817 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 60.1 tp -67.5 -44.92 77.32 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 123.639 0.776 . . . . 0.0 111.213 172.206 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 53.1 t -60.45 -38.54 78.25 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.131 0 C-N-CA 123.614 0.766 . . . . 0.0 111.761 177.023 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 33.2 mm-40 -68.62 -43.89 75.41 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 123.855 0.862 . . . . 0.0 111.91 173.258 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.36 -43.62 98.56 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-N 119.278 0.944 . . . . 0.0 112.253 176.746 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 44.5 mt -55.48 -54.57 42.26 Favored 'General case' 0 N--CA 1.467 0.412 0 C-N-CA 124.803 1.241 . . . . 0.0 110.84 171.771 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 81.9 t80 -55.19 -40.75 71.11 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 123.48 0.712 . . . . 0.0 112.884 177.471 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 83.0 mt -75.74 -34.38 60.3 Favored 'General case' 0 CA--C 1.534 0.358 0 N-CA-C 113.645 0.979 . . . . 0.0 113.645 -179.121 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 42.9 t -72.73 -42.35 61.98 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.922 0 CA-C-N 118.666 0.666 . . . . 0.0 110.642 174.29 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 75.5 m -83.43 -35.6 24.88 Favored 'General case' 0 N--CA 1.466 0.37 0 N-CA-C 113.539 0.941 . . . . 0.0 113.539 -173.21 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 62.54 -131.43 44.09 Favored Glycine 0 CA--C 1.532 1.094 0 C-N-CA 123.839 0.733 . . . . 0.0 111.66 -175.973 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -63.28 -18.85 64.02 Favored 'General case' 0 CA--C 1.55 0.96 0 C-N-CA 124.942 1.297 . . . . 0.0 113.512 179.452 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 85.4 mtm180 -66.17 -21.9 66.34 Favored 'General case' 0 N--CA 1.477 0.919 0 N-CA-C 113.924 1.083 . . . . 0.0 113.924 -177.567 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.73 -178.43 39.5 Favored Glycine 0 CA--C 1.534 1.236 0 C-N-CA 124.658 1.123 . . . . 0.0 112.154 -172.934 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 53.4 p90 -159.86 164.57 33.48 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 124.368 1.067 . . . . 0.0 113.421 -177.299 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 93.6 t80 -146.26 121.83 10.42 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 124.776 1.23 . . . . 0.0 110.635 171.744 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 44.4 p90 -101.87 155.21 18.29 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 125.975 1.71 . . . . 0.0 111.911 172.569 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 39.8 p -102.17 137.14 19.38 Favored Pre-proline 0 N--CA 1.472 0.673 0 C-N-CA 124.568 1.147 . . . . 0.0 110.078 167.279 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 68.8 Cg_endo -76.25 -168.87 0.6 Allowed 'Trans proline' 0 C--N 1.349 0.6 0 C-N-CA 124.657 3.571 . . . . 0.0 112.287 -169.705 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 27.7 mtpp -58.25 -30.0 66.2 Favored 'General case' 0 CA--C 1.549 0.92 0 O-C-N 121.106 -0.996 . . . . 0.0 113.561 173.222 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 24.5 m . . . . . 0 N--CA 1.486 1.332 0 C-N-CA 129.053 2.941 . . . . 0.0 111.779 173.599 . . . . . . . . 0 0 . 1 . 026 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.728 0 N-CA-C 112.003 -0.439 . . . . 0.0 112.003 . . . . . . . . . 0 0 . 1 . 026 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 14.0 tt -55.38 -42.08 65.43 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.259 0 C-N-CA 124.748 1.219 . . . . 0.0 113.966 -171.934 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 83.5 t -63.03 -45.94 97.53 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.1 0 CA-C-N 119.306 0.957 . . . . 0.0 111.028 -176.707 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 78.5 mm-40 -70.68 -40.8 72.73 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-N 118.465 0.575 . . . . 0.0 111.329 176.597 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 63.9 tp60 -64.77 -38.9 92.56 Favored 'General case' 0 N--CA 1.463 0.222 0 O-C-N 121.83 -0.544 . . . . 0.0 112.052 -179.252 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 88.3 m -83.03 -31.5 27.39 Favored 'General case' 0 CA--C 1.53 0.204 0 N-CA-C 114.268 1.211 . . . . 0.0 114.268 178.607 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 30.5 t -103.46 -48.47 3.97 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 113.153 0.798 . . . . 0.0 113.153 -169.369 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 34.6 m -79.33 -47.12 16.37 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 124.526 1.131 . . . . 0.0 109.536 178.699 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 71.0 m -94.74 -164.32 1.15 Allowed 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 124.625 1.17 . . . . 0.0 111.255 164.112 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 40.4 pt -109.5 149.35 12.66 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 C-N-CA 124.694 1.198 . . . . 0.0 110.885 169.254 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 17.5 p -128.33 158.42 38.27 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 123.567 0.747 . . . . 0.0 112.028 174.149 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 61.5 p -98.67 160.03 14.55 Favored 'General case' 0 N--CA 1.468 0.441 0 N-CA-C 114.003 1.112 . . . . 0.0 114.003 -179.857 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 59.7 mt -60.88 -35.46 76.7 Favored 'General case' 0 CA--C 1.54 0.573 0 O-C-N 121.646 -0.659 . . . . 0.0 111.452 172.107 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 91.6 t80 -62.57 -35.45 79.54 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 124.118 0.967 . . . . 0.0 112.896 172.641 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 84.3 mt-30 -74.16 -35.4 64.03 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 123.866 0.866 . . . . 0.0 111.884 173.349 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 56.8 mt -63.28 -39.02 93.4 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 119.599 1.091 . . . . 0.0 111.923 171.433 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -60.91 -26.73 67.67 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 124.621 1.168 . . . . 0.0 113.319 -178.989 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 26.3 t30 -57.4 -28.69 63.46 Favored 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 124.261 1.024 . . . . 0.0 113.307 175.521 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 98.2 m-85 -95.07 -2.28 50.47 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 125.146 1.378 . . . . 0.0 114.022 -174.174 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 86.3 m -70.67 151.61 44.75 Favored 'General case' 0 CA--C 1.541 0.629 0 N-CA-C 113.938 1.088 . . . . 0.0 113.938 178.701 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.25 1.11 0 C-N-CA 126.378 1.871 . . . . 0.0 110.223 170.522 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 1.8 p90 . . . . . 0 N--CA 1.485 1.307 0 N-CA-C 111.54 0.2 . . . . 0.0 111.54 . . . . . . . . . 0 0 . 1 . 026 nuclear nobuild full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 96.8 t -85.94 143.14 12.11 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.072 0 C-N-CA 124.554 1.142 . . . . 0.0 109.786 173.888 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 51.4 p30 -134.45 149.7 50.76 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 125.303 1.441 . . . . 0.0 112.864 173.103 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 40.9 mt-30 -151.29 162.53 40.74 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 124.922 1.289 . . . . 0.0 111.722 -164.754 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 84.0 m-70 -82.67 130.16 35.08 Favored 'General case' 0 CA--C 1.541 0.633 0 N-CA-C 109.522 -0.548 . . . . 0.0 109.522 154.589 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 78.5 mt -144.07 126.88 16.24 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 126.391 1.876 . . . . 0.0 108.996 -178.5 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 62.3 m -134.74 140.68 46.12 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 124.986 1.315 . . . . 0.0 110.455 -174.754 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 51.7 -118.88 7.6 Favored Glycine 0 N--CA 1.473 1.137 0 C-N-CA 124.88 1.229 . . . . 0.0 114.022 169.147 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 19.3 m -59.48 -33.92 71.92 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 124.475 1.11 . . . . 0.0 112.688 -179.804 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 93.2 m-70 -72.67 -38.83 67.48 Favored 'General case' 0 CA--C 1.539 0.55 0 O-C-N 121.409 -0.807 . . . . 0.0 111.163 178.196 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 55.7 tp -63.81 -45.87 87.7 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 124.053 0.941 . . . . 0.0 111.056 171.827 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 21.8 t -59.59 -43.28 90.67 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.952 0 C-N-CA 124.614 1.166 . . . . 0.0 111.751 176.171 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -65.57 -46.42 79.53 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 123.175 0.59 . . . . 0.0 111.65 175.683 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.07 -44.01 98.02 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 123.533 0.733 . . . . 0.0 112.058 179.961 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 21.4 mt -54.94 -55.51 29.82 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 124.301 1.041 . . . . 0.0 111.132 173.0 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 79.9 t80 -58.15 -34.51 70.36 Favored 'General case' 0 N--CA 1.472 0.666 0 N-CA-C 113.512 0.93 . . . . 0.0 113.512 179.417 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 86.1 mt -74.79 -40.94 60.85 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 124.661 1.184 . . . . 0.0 113.559 175.062 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 38.7 t -64.49 -42.77 96.19 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.021 0 C-N-CA 123.956 0.903 . . . . 0.0 111.052 174.24 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 61.6 m -73.58 -25.7 60.48 Favored 'General case' 0 CA--C 1.538 0.518 0 N-CA-C 112.611 0.597 . . . . 0.0 112.611 179.264 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 83.77 49.29 4.89 Favored Glycine 0 N--CA 1.471 1.008 0 C-N-CA 124.648 1.118 . . . . 0.0 112.184 171.944 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 36.4 mt-10 78.06 -7.93 1.74 Allowed 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 127.997 2.519 . . . . 0.0 113.362 -177.418 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 32.2 mtp180 -66.47 162.48 20.54 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 125.238 1.415 . . . . 0.0 111.927 168.278 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . -63.63 159.42 38.59 Favored Glycine 0 CA--C 1.532 1.145 0 C-N-CA 124.154 0.883 . . . . 0.0 112.939 174.668 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 56.1 p90 -153.8 175.44 13.3 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 125.518 1.527 . . . . 0.0 111.675 -172.288 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 61.0 t80 -138.88 118.46 12.99 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 124.416 1.086 . . . . 0.0 110.884 178.081 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 37.3 p90 -112.3 -13.0 13.5 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 125.67 1.588 . . . . 0.0 114.068 -178.273 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 8.6 m -69.23 137.63 89.23 Favored Pre-proline 0 N--CA 1.473 0.682 0 C-N-CA 125.803 1.641 . . . . 0.0 111.668 -161.812 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 81.2 Cg_endo -72.37 163.66 37.94 Favored 'Trans proline' 0 CA--C 1.537 0.672 0 C-N-CA 123.252 2.635 . . . . 0.0 111.928 175.584 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 11.4 mmpt? -73.63 152.55 40.48 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 123.39 0.676 . . . . 0.0 112.546 174.426 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 21.8 m . . . . . 0 C--O 1.254 1.296 0 C-N-CA 126.089 1.756 . . . . 0.0 112.396 -179.272 . . . . . . . . 0 0 . 1 . 027 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.755 0 N-CA-C 112.244 -0.342 . . . . 0.0 112.244 . . . . . . . . . 0 0 . 1 . 027 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 42.2 pt -89.87 -15.86 8.59 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.959 0 C-N-CA 128.592 2.757 . . . . 0.0 114.215 -4.828 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 25.0 t -51.34 -37.7 18.87 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.659 0 CA-C-N 120.858 1.663 . . . . 0.0 112.135 178.627 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -68.74 -16.52 63.83 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.536 1.134 . . . . 0.0 113.391 -179.867 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 36.7 tt0 -91.82 -57.11 2.85 Favored 'General case' 0 C--O 1.225 -0.207 0 C-N-CA 123.633 0.773 . . . . 0.0 109.474 162.73 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 64.0 m -63.28 -29.89 71.13 Favored 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 114.779 1.4 . . . . 0.0 114.779 -165.412 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 26.7 t -96.18 -38.87 9.96 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 123.872 0.869 . . . . 0.0 112.458 -175.513 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 27.3 m -83.08 -39.21 21.45 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 125.536 1.534 . . . . 0.0 111.766 -179.425 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 22.6 t -114.29 -135.7 0.36 Allowed 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 126.953 2.101 . . . . 0.0 108.768 168.291 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 16.0 pt -133.2 151.18 33.45 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.727 0 C-N-CA 125.901 1.681 . . . . 0.0 111.964 -178.507 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 66.9 m -125.41 158.32 34.64 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 125.392 1.477 . . . . 0.0 111.096 170.38 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 10.5 t -109.52 158.36 18.07 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 124.248 1.019 . . . . 0.0 112.49 175.566 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 45.0 mt -58.87 -35.26 72.69 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 125.297 1.439 . . . . 0.0 111.735 178.942 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 76.2 t80 -62.46 -29.9 70.86 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 124.33 1.052 . . . . 0.0 113.188 173.34 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 94.9 mt-30 -81.63 -33.68 31.3 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 124.313 1.045 . . . . 0.0 110.529 176.586 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 44.1 mt -65.56 -37.98 88.24 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 123.546 0.738 . . . . 0.0 112.129 171.76 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 29.1 tt0 -60.04 -24.32 64.43 Favored 'General case' 0 CA--C 1.544 0.73 0 N-CA-C 113.62 0.971 . . . . 0.0 113.62 -178.901 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 17.3 t-20 -58.47 -23.35 57.57 Favored 'General case' 0 CA--C 1.549 0.939 0 N-CA-C 113.637 0.977 . . . . 0.0 113.637 174.774 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 96.5 m-85 -97.92 0.98 47.52 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.479 1.511 . . . . 0.0 114.195 -177.601 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 60.3 m -68.84 161.26 28.97 Favored 'General case' 0 N--CA 1.473 0.722 0 N-CA-C 113.226 0.824 . . . . 0.0 113.226 173.29 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 20.9 t-20 . . . . . 0 C--O 1.251 1.15 0 C-N-CA 126.027 1.731 . . . . 0.0 112.526 -178.881 . . . . . . . . 0 0 . 1 . 027 nuclear nobuild full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 60.0 m-85 . . . . . 0 N--CA 1.488 1.436 0 CA-C-O 119.189 -0.434 . . . . 0.0 110.781 . . . . . . . . . 0 0 . 1 . 027 nuclear nobuild full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 11.9 p -166.8 136.59 0.65 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.074 0 C-N-CA 125.306 1.442 . . . . 0.0 110.902 -175.35 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 10.6 m120 -89.76 142.12 27.98 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 124.429 1.092 . . . . 0.0 112.063 176.674 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 38.1 mt-30 -144.87 157.34 44.19 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.16 1.384 . . . . 0.0 110.985 -177.985 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 99.2 m-70 -79.57 127.1 31.74 Favored 'General case' 0 CA--C 1.538 0.508 0 N-CA-C 108.61 -0.885 . . . . 0.0 108.61 160.774 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 98.8 mt -143.21 120.76 11.75 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 125.489 1.516 . . . . 0.0 109.914 -173.165 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 58.1 m -127.54 136.94 52.41 Favored 'General case' 0 N--CA 1.467 0.41 0 C-N-CA 125.066 1.346 . . . . 0.0 110.703 -176.878 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 48.43 -116.57 3.21 Favored Glycine 0 CA--C 1.531 1.046 0 C-N-CA 125.208 1.385 . . . . 0.0 114.275 167.556 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 21.1 m -59.31 -34.6 72.52 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 124.39 1.076 . . . . 0.0 112.651 -178.986 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 94.8 m-70 -72.22 -36.74 69.23 Favored 'General case' 0 CA--C 1.542 0.67 0 O-C-N 121.268 -0.895 . . . . 0.0 111.404 177.891 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 58.8 tp -65.77 -45.51 82.24 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 123.69 0.796 . . . . 0.0 110.99 171.963 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 53.6 t -62.65 -37.15 78.25 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.042 0 C-N-CA 124.381 1.073 . . . . 0.0 111.76 176.916 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -66.19 -47.08 75.1 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 123.627 0.771 . . . . 0.0 111.336 172.593 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.57 -43.53 97.18 Favored 'General case' 0 CA--C 1.539 0.539 0 O-C-N 121.521 -0.737 . . . . 0.0 111.996 177.792 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 18.3 mt -53.16 -56.16 18.57 Favored 'General case' 0 N--CA 1.468 0.448 0 C-N-CA 124.673 1.189 . . . . 0.0 111.175 172.037 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 71.5 t80 -55.82 -41.99 75.03 Favored 'General case' 0 CA--C 1.542 0.646 0 N-CA-C 113.151 0.797 . . . . 0.0 113.151 177.41 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 87.6 mt -72.36 -34.72 68.18 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 124.281 1.032 . . . . 0.0 113.134 -179.461 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 28.6 t -66.79 -43.92 89.54 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.909 0 C-N-CA 123.804 0.842 . . . . 0.0 110.624 172.464 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 82.6 m -72.43 -35.98 68.46 Favored 'General case' 0 CA--C 1.539 0.557 0 N-CA-C 112.206 0.447 . . . . 0.0 112.206 -177.85 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 68.51 -109.51 2.94 Favored Glycine 0 CA--C 1.528 0.885 0 C-N-CA 125.136 1.35 . . . . 0.0 112.112 170.512 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -68.85 -27.75 66.1 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 124.362 1.065 . . . . 0.0 112.199 173.575 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 82.6 mtm180 -74.16 154.59 39.03 Favored 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 124.968 1.307 . . . . 0.0 111.019 175.323 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . -80.62 -173.1 46.39 Favored Glycine 0 CA--C 1.527 0.801 0 C-N-CA 123.985 0.802 . . . . 0.0 111.316 168.721 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 15.3 p90 -162.0 165.43 27.39 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 124.7 1.2 . . . . 0.0 112.213 176.161 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 88.2 t80 -152.18 126.34 9.21 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 123.544 0.738 . . . . 0.0 111.696 167.074 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 60.0 t80 -164.29 151.49 11.75 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 126.828 2.051 . . . . 0.0 111.511 172.204 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 9.8 t -164.47 142.84 5.65 Favored Pre-proline 0 N--CA 1.475 0.792 0 C-N-CA 127.134 2.174 . . . . 0.0 109.523 172.381 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 48.4 Cg_endo -64.06 155.48 64.49 Favored 'Trans proline' 0 C--N 1.353 0.812 0 C-N-CA 123.272 2.648 . . . . 0.0 111.665 176.038 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 24.4 pttm -75.03 -3.0 29.87 Favored 'General case' 0 N--CA 1.477 0.88 0 N-CA-C 115.261 1.578 . . . . 0.0 115.261 -174.91 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 21.0 p . . . . . 0 C--O 1.253 1.255 0 C-N-CA 126.775 2.03 . . . . 0.0 113.884 -178.35 . . . . . . . . 0 0 . 1 . 028 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.388 0 N-CA-C 111.728 -0.549 . . . . 0.0 111.728 . . . . . . . . . 0 0 . 1 . 028 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 9.5 tp -104.2 -25.3 3.74 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.306 0 C-N-CA 127.823 2.449 . . . . 0.0 115.407 12.436 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 76.2 t -66.79 -46.07 86.37 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.031 0 N-CA-C 113.406 0.891 . . . . 0.0 113.406 -152.705 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 67.3 mm-40 -69.21 -42.58 75.56 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 118.693 0.679 . . . . 0.0 111.389 177.517 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 17.0 tm0? -61.72 -48.45 80.67 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 123.895 0.878 . . . . 0.0 111.346 -174.49 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 5.0 t -75.66 -12.45 60.2 Favored 'General case' 0 N--CA 1.472 0.646 0 N-CA-C 113.642 0.979 . . . . 0.0 113.642 -179.866 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 25.2 t -87.25 -43.47 12.17 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 124.88 1.272 . . . . 0.0 112.519 177.119 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 74.2 p -86.37 -43.26 13.0 Favored 'General case' 0 N--CA 1.478 0.966 0 C-N-CA 124.408 1.083 . . . . 0.0 112.268 177.952 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 17.5 t -104.52 -149.6 0.41 Allowed 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 125.807 1.643 . . . . 0.0 109.75 169.589 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 27.6 pt -125.94 157.03 36.08 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.728 0 C-N-CA 125.577 1.551 . . . . 0.0 112.286 -178.081 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 17.3 p -143.1 159.66 41.86 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 124.307 1.043 . . . . 0.0 112.157 170.779 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 8.5 t -105.76 162.81 13.22 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 124.885 1.274 . . . . 0.0 112.799 -177.646 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 53.0 mt -58.64 -35.59 72.75 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 124.773 1.229 . . . . 0.0 111.882 179.646 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 69.7 t80 -64.17 -28.58 69.85 Favored 'General case' 0 CA--C 1.547 0.829 0 N-CA-C 113.722 1.008 . . . . 0.0 113.722 173.598 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 75.2 mt-30 -83.32 -33.26 25.96 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 124.269 1.028 . . . . 0.0 110.997 175.495 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 83.2 mt -63.32 -38.14 90.01 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-N 118.576 0.626 . . . . 0.0 111.907 168.858 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 28.8 tt0 -62.23 -23.77 66.85 Favored 'General case' 0 CA--C 1.542 0.651 0 N-CA-C 113.566 0.951 . . . . 0.0 113.566 -179.691 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 29.7 t30 -57.25 -25.92 59.92 Favored 'General case' 0 CA--C 1.549 0.918 0 O-C-N 120.969 -1.082 . . . . 0.0 113.309 173.425 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 97.4 m-85 -96.73 0.84 50.18 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 125.411 1.484 . . . . 0.0 113.735 -175.744 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 61.2 m -67.54 156.49 36.58 Favored 'General case' 0 N--CA 1.474 0.727 0 CA-C-N 119.252 0.933 . . . . 0.0 113.143 175.69 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 22.1 t-20 . . . . . 0 C--O 1.254 1.321 0 C-N-CA 125.877 1.671 . . . . 0.0 112.79 -175.786 . . . . . . . . 0 0 . 1 . 028 nuclear nobuild full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 57.2 m-85 . . . . . 0 N--CA 1.488 1.457 0 CA-C-O 119.07 -0.49 . . . . 0.0 110.76 . . . . . . . . . 0 0 . 1 . 028 nuclear nobuild full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 7.5 p -168.99 134.19 0.4 Allowed 'Isoleucine or valine' 0 N--CA 1.479 0.993 0 C-N-CA 125.539 1.536 . . . . 0.0 110.194 -176.865 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 39.4 p30 -99.6 143.59 29.66 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 124.614 1.166 . . . . 0.0 113.401 179.778 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 39.0 mt-30 -147.48 160.35 42.69 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 125.234 1.413 . . . . 0.0 110.947 -170.22 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 99.3 m-70 -82.18 129.11 34.75 Favored 'General case' 0 CA--C 1.539 0.537 0 N-CA-C 108.156 -1.053 . . . . 0.0 108.156 159.51 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 87.0 mt -145.17 134.18 22.59 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 125.025 1.33 . . . . 0.0 109.211 -176.972 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 4.1 t -151.97 153.82 34.83 Favored 'General case' 0 C--O 1.235 0.342 0 C-N-CA 123.02 0.528 . . . . 0.0 111.786 -174.867 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 49.62 -128.66 24.75 Favored Glycine 0 CA--C 1.53 0.97 0 C-N-CA 125.465 1.507 . . . . 0.0 113.799 175.743 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 18.6 m -58.78 -33.45 70.32 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 124.53 1.132 . . . . 0.0 112.824 -179.136 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 80.8 m-70 -76.78 -26.74 54.81 Favored 'General case' 0 CA--C 1.54 0.578 0 O-C-N 121.073 -1.017 . . . . 0.0 112.875 177.857 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 42.6 tp -72.58 -42.26 64.79 Favored 'General case' 0 N--CA 1.468 0.457 0 O-C-N 121.225 -0.922 . . . . 0.0 111.07 168.28 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 55.8 t -59.28 -41.7 84.88 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.003 0 C-N-CA 123.794 0.838 . . . . 0.0 111.378 172.714 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 43.7 tt0 -62.47 -47.35 84.39 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 125.633 1.573 . . . . 0.0 111.823 173.44 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.25 -44.95 95.38 Favored 'General case' 0 CA--C 1.539 0.541 0 O-C-N 121.927 -0.483 . . . . 0.0 112.245 178.276 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 39.6 mt -55.92 -51.48 67.47 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 124.204 1.002 . . . . 0.0 111.092 173.265 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 68.1 t80 -55.32 -43.66 75.1 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 123.619 0.768 . . . . 0.0 113.058 175.262 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 89.8 mt -74.75 -32.86 62.21 Favored 'General case' 0 N--CA 1.471 0.619 0 N-CA-C 113.595 0.961 . . . . 0.0 113.595 -178.478 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 30.4 t -70.91 -43.58 76.67 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 C-N-CA 123.998 0.919 . . . . 0.0 110.466 173.655 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 76.1 m -81.62 -36.55 28.79 Favored 'General case' 0 CA--C 1.533 0.302 0 N-CA-C 113.533 0.938 . . . . 0.0 113.533 -173.855 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . -50.84 131.89 32.04 Favored Glycine 0 CA--C 1.538 1.521 0 C-N-CA 124.324 0.964 . . . . 0.0 113.37 -168.415 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -80.14 -3.59 49.46 Favored 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 128.468 2.707 . . . . 0.0 115.496 10.908 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 75.3 mtm180 -64.2 155.32 32.17 Favored 'General case' 0 N--CA 1.475 0.798 0 CA-C-N 119.567 1.076 . . . . 0.0 110.708 174.628 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . -78.69 -174.08 43.96 Favored Glycine 0 N--CA 1.471 0.972 0 C-N-CA 124.147 0.88 . . . . 0.0 111.519 169.825 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 45.6 p90 -157.02 155.69 31.64 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 123.882 0.873 . . . . 0.0 112.927 -179.075 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 68.3 t80 -100.33 148.68 24.43 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 125.628 1.571 . . . . 0.0 111.205 173.068 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 66.1 t80 -159.12 138.09 11.15 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 125.524 1.53 . . . . 0.0 111.14 179.797 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 11.5 t -168.22 132.46 1.41 Allowed Pre-proline 0 N--CA 1.476 0.854 0 C-N-CA 126.181 1.792 . . . . 0.0 109.877 173.938 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 91.0 Cg_endo -80.65 155.72 21.08 Favored 'Trans proline' 0 C--N 1.349 0.565 0 C-N-CA 122.735 2.29 . . . . 0.0 112.494 -172.334 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 67.4 mttm 66.18 1.66 2.05 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 126.62 1.968 . . . . 0.0 115.534 172.463 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 88.8 m . . . . . 0 C--O 1.252 1.194 0 C-N-CA 125.992 1.717 . . . . 0.0 110.528 164.016 . . . . . . . . 0 0 . 1 . 029 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.806 0 N-CA-C 111.097 -0.801 . . . . 0.0 111.097 . . . . . . . . . 0 0 . 1 . 029 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 17.6 tt -62.06 -38.62 81.27 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.267 0 CA-C-N 118.722 1.261 . . . . 0.0 114.005 -168.544 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 47.2 t -66.07 -34.19 68.57 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.12 0 C-N-CA 123.467 0.707 . . . . 0.0 111.343 -179.021 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -70.75 -54.94 9.82 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 124.114 0.965 . . . . 0.0 110.099 169.956 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 6.7 tt0 -56.91 -49.08 76.68 Favored 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 123.999 0.919 . . . . 0.0 112.117 -174.121 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 63.7 m -62.33 -28.24 69.61 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 114.006 1.113 . . . . 0.0 114.006 -179.094 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 18.6 t -102.1 -36.39 8.57 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 123.806 0.842 . . . . 0.0 112.763 -171.736 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 92.4 m -82.78 -29.51 29.57 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 126.228 1.811 . . . . 0.0 111.713 175.524 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 9.9 t -135.98 -156.26 0.7 Allowed 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 125.616 1.566 . . . . 0.0 110.697 177.124 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 28.1 mm -93.5 147.35 5.55 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.74 0 C-N-CA 125.408 1.483 . . . . 0.0 109.814 172.047 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 19.1 p -132.73 159.01 40.92 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 123.514 0.726 . . . . 0.0 112.486 163.665 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 53.3 p -100.08 162.72 12.8 Favored 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 113.788 1.033 . . . . 0.0 113.788 -175.22 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 78.4 mt -64.22 -33.54 76.03 Favored 'General case' 0 CA--C 1.536 0.421 0 O-C-N 121.344 -0.848 . . . . 0.0 111.5 172.126 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 87.2 t80 -66.78 -34.01 76.89 Favored 'General case' 0 CA--C 1.544 0.713 0 O-C-N 121.459 -0.776 . . . . 0.0 112.845 173.058 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 78.3 mt-30 -71.38 -37.04 71.61 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 123.556 0.742 . . . . 0.0 111.312 173.36 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 95.6 mt -60.98 -42.68 98.82 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-N 119.144 0.884 . . . . 0.0 111.245 167.346 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 56.6 tt0 -64.75 -31.13 72.22 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 123.353 0.661 . . . . 0.0 112.722 178.495 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 18.6 t-20 -64.2 -22.49 66.96 Favored 'General case' 0 CA--C 1.551 0.987 0 O-C-N 121.044 -1.035 . . . . 0.0 112.846 173.129 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 23.5 m-85 -95.73 0.47 52.52 Favored 'General case' 0 CA--C 1.55 0.958 0 C-N-CA 125.686 1.595 . . . . 0.0 113.338 171.661 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 76.4 m -83.82 161.83 20.79 Favored 'General case' 0 CA--C 1.542 0.639 0 O-C-N 120.649 -1.282 . . . . 0.0 112.133 165.772 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 44.0 t30 . . . . . 0 C--O 1.252 1.195 0 C-N-CA 125.074 1.35 . . . . 0.0 111.661 170.946 . . . . . . . . 0 0 . 1 . 029 nuclear nobuild full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 71.0 t80 . . . . . 0 N--CA 1.488 1.469 0 CA-C-O 119.63 -0.224 . . . . 0.0 110.783 . . . . . . . . . 0 0 . 1 . 029 nuclear nobuild full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 63.8 t -83.07 130.71 35.26 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.935 0 C-N-CA 124.125 0.97 . . . . 0.0 109.943 -178.217 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . 0.316 6.2 p30 69.3 131.09 0.03 OUTLIER 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 129.231 3.012 . . . . 0.0 114.162 -174.953 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 78.1 mt-30 -156.09 168.42 27.33 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 123.734 0.814 . . . . 0.0 113.149 -162.939 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 93.5 m-70 -84.52 134.21 34.43 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 123.628 0.771 . . . . 0.0 109.53 158.173 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 75.4 mt -148.34 131.91 16.78 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 126.277 1.831 . . . . 0.0 109.895 -176.861 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 85.5 m -135.97 144.52 45.44 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 124.992 1.317 . . . . 0.0 110.911 -177.596 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 52.46 -125.21 28.35 Favored Glycine 0 N--CA 1.474 1.199 0 C-N-CA 125.464 1.507 . . . . 0.0 114.248 165.414 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 27.5 m -58.21 -38.46 76.82 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 123.671 0.788 . . . . 0.0 112.296 -179.196 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 17.5 m-70 -72.33 -32.17 66.29 Favored 'General case' 0 CA--C 1.54 0.565 0 O-C-N 121.142 -0.974 . . . . 0.0 112.237 179.253 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 59.2 tp -65.43 -43.6 89.96 Favored 'General case' 0 CA--C 1.534 0.346 0 O-C-N 121.629 -0.669 . . . . 0.0 111.112 168.708 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 55.4 t -62.3 -40.49 88.03 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.942 0 C-N-CA 123.696 0.798 . . . . 0.0 111.661 175.684 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -62.93 -48.14 80.2 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 124.218 1.007 . . . . 0.0 111.613 173.368 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.63 -44.72 96.02 Favored 'General case' 0 CA--C 1.538 0.497 0 O-C-N 121.759 -0.588 . . . . 0.0 112.224 178.709 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 60.7 tp -57.07 -53.37 58.89 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 123.995 0.918 . . . . 0.0 110.571 174.494 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 9.9 m-30 -55.72 -38.62 69.98 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 123.328 0.651 . . . . 0.0 112.514 178.038 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 76.5 mt -71.65 -35.44 70.36 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 124.42 1.088 . . . . 0.0 113.137 177.758 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 55.3 t -70.44 -40.58 77.71 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.055 0 C-N-CA 123.754 0.822 . . . . 0.0 110.972 173.324 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 57.7 m -75.64 -35.52 60.42 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 113.075 0.769 . . . . 0.0 113.075 -178.747 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 59.02 -129.63 49.89 Favored Glycine 0 CA--C 1.532 1.107 0 N-CA-C 111.544 -0.622 . . . . 0.0 111.544 -174.942 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -75.66 -9.92 59.0 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 124.528 1.131 . . . . 0.0 114.035 179.566 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 60.1 mtp180 -65.95 -35.51 80.79 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 123.957 0.903 . . . . 0.0 113.251 -176.009 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 95.46 158.79 32.72 Favored Glycine 0 CA--C 1.532 1.152 0 C-N-CA 125.366 1.46 . . . . 0.0 113.069 -169.714 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 33.0 p90 -122.77 168.12 12.63 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 125.848 1.659 . . . . 0.0 113.117 -173.192 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 80.9 t80 -131.88 138.07 48.29 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 125.823 1.649 . . . . 0.0 109.239 161.057 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 69.6 t80 -154.07 139.1 17.3 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 123.84 0.856 . . . . 0.0 112.493 -175.084 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 10.2 t -173.6 138.77 0.77 Allowed Pre-proline 0 N--CA 1.476 0.871 0 C-N-CA 127.002 2.121 . . . . 0.0 109.639 174.983 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -74.19 136.8 22.74 Favored 'Trans proline' 0 C--N 1.351 0.668 0 C-N-CA 122.942 2.428 . . . . 0.0 110.812 174.669 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 22.4 ptmt -163.88 148.43 10.38 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 124.497 1.119 . . . . 0.0 113.255 -175.236 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 22.6 p . . . . . 0 C--O 1.253 1.274 0 C-N-CA 125.962 1.705 . . . . 0.0 111.048 174.125 . . . . . . . . 0 0 . 1 . 030 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.805 0 N-CA-C 111.419 -0.672 . . . . 0.0 111.419 . . . . . . . . . 0 0 . 1 . 030 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 43.8 pt -58.92 -31.9 46.25 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.131 0 N-CA-C 114.748 1.388 . . . . 0.0 114.748 -164.552 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 11.0 t -61.85 -34.95 65.12 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.996 0 C-N-CA 123.619 0.768 . . . . 0.0 111.08 178.461 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 29.7 mm-40 -79.15 8.88 5.11 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.963 1.305 . . . . 0.0 112.535 178.402 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -115.71 -53.63 2.57 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 124.729 1.212 . . . . 0.0 109.993 162.314 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 11.7 m -65.85 -28.48 69.0 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 115.392 1.627 . . . . 0.0 115.392 -173.954 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 42.6 t -92.86 -45.41 8.0 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-N 118.667 0.667 . . . . 0.0 111.927 -178.12 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 23.1 p -68.76 -35.98 77.75 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 126.806 2.042 . . . . 0.0 112.601 -179.308 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 65.0 m -132.76 -171.43 2.66 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 126.42 1.888 . . . . 0.0 110.775 179.064 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 30.3 mm -75.88 142.27 14.68 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.793 0 O-C-N 120.565 -1.335 . . . . 0.0 110.767 172.341 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 14.1 p -134.15 160.58 37.39 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 123.547 0.739 . . . . 0.0 112.461 158.758 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 37.4 t -101.99 159.79 15.06 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 124.889 1.276 . . . . 0.0 112.523 -178.225 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 40.2 mt -63.35 -30.41 71.55 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 123.594 0.758 . . . . 0.0 111.518 170.685 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 26.6 m-85 -65.6 -28.74 69.35 Favored 'General case' 0 CA--C 1.544 0.714 0 N-CA-C 113.304 0.853 . . . . 0.0 113.304 171.881 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 79.0 mt-30 -78.78 -38.36 38.67 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-O 118.558 -0.734 . . . . 0.0 110.593 172.598 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 42.6 mt -58.01 -37.96 75.27 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 119.099 0.863 . . . . 0.0 111.549 168.708 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 25.4 tt0 -66.37 -31.99 73.1 Favored 'General case' 0 CA--C 1.546 0.818 0 CA-C-N 118.688 0.676 . . . . 0.0 112.65 175.891 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 32.8 t30 -68.2 -23.97 64.89 Favored 'General case' 0 CA--C 1.548 0.892 0 O-C-N 121.043 -1.035 . . . . 0.0 112.685 171.947 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 10.5 m-30 -86.7 -5.7 59.05 Favored 'General case' 0 CA--C 1.549 0.917 0 C-N-CA 125.326 1.45 . . . . 0.0 113.545 177.455 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 58.2 m -65.46 155.47 35.45 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 123.562 0.745 . . . . 0.0 112.342 169.614 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 93.3 m-20 . . . . . 0 C--O 1.256 1.413 0 C-N-CA 124.414 1.086 . . . . 0.0 113.072 178.475 . . . . . . . . 0 0 . 1 . 030 nuclear nobuild full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 42.8 p90 . . . . . 0 N--CA 1.487 1.422 0 N-CA-C 110.678 -0.119 . . . . 0.0 110.678 . . . . . . . . . 0 0 . 1 . 030 nuclear nobuild full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 93.0 t -72.81 130.05 35.75 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.914 0 O-C-N 121.426 -0.797 . . . . 0.0 110.008 -178.811 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 4.1 p30 -151.94 132.25 13.68 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 125.504 1.522 . . . . 0.0 110.406 177.456 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 36.2 mt-30 -153.37 166.17 33.48 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 123.821 0.849 . . . . 0.0 112.36 -159.264 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 51.3 m-70 -81.8 132.3 35.28 Favored 'General case' 0 CA--C 1.542 0.664 0 N-CA-C 108.519 -0.919 . . . . 0.0 108.519 156.298 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 72.5 mt -140.73 126.83 19.56 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 125.698 1.599 . . . . 0.0 109.062 -178.263 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 68.7 m -131.14 143.95 51.02 Favored 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 125.053 1.341 . . . . 0.0 110.986 -173.77 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 56.47 -128.42 46.32 Favored Glycine 0 CA--C 1.528 0.866 0 C-N-CA 124.807 1.194 . . . . 0.0 113.927 166.433 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 23.5 p -61.5 -31.79 71.8 Favored 'General case' 0 N--CA 1.467 0.401 0 C-N-CA 124.482 1.113 . . . . 0.0 112.864 179.742 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 26.5 m80 -69.27 -39.99 78.05 Favored 'General case' 0 CA--C 1.54 0.565 0 O-C-N 121.042 -1.037 . . . . 0.0 111.395 175.792 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 50.5 tp -65.13 -45.28 85.71 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 123.379 0.671 . . . . 0.0 111.226 171.917 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 65.8 t -59.55 -43.02 89.93 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.008 0 C-N-CA 123.265 0.626 . . . . 0.0 111.656 176.381 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -65.01 -47.78 76.24 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 123.776 0.83 . . . . 0.0 111.529 177.214 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.92 -46.78 89.32 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 123.022 0.529 . . . . 0.0 111.653 178.632 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 43.8 tp -59.39 -49.99 75.67 Favored 'General case' 0 CA--C 1.533 0.327 0 C-N-CA 124.783 1.233 . . . . 0.0 111.229 176.981 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 63.2 t80 -55.43 -42.56 74.35 Favored 'General case' 0 CA--C 1.54 0.569 0 N-CA-C 113.122 0.786 . . . . 0.0 113.122 174.158 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 88.0 mt -73.88 -31.52 63.18 Favored 'General case' 0 N--CA 1.469 0.517 0 N-CA-C 113.104 0.779 . . . . 0.0 113.104 -179.324 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 41.1 t -68.65 -45.8 80.86 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.763 0 C-N-CA 123.538 0.735 . . . . 0.0 110.618 171.126 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 76.0 m -76.83 -35.15 57.75 Favored 'General case' 0 N--CA 1.469 0.498 0 N-CA-C 113.232 0.827 . . . . 0.0 113.232 -175.207 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 62.62 -130.82 43.53 Favored Glycine 0 CA--C 1.53 1.019 0 C-N-CA 124.284 0.945 . . . . 0.0 111.182 -175.762 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -64.38 -19.75 65.69 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 124.913 1.285 . . . . 0.0 113.57 179.182 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 83.7 mtm180 -64.2 -31.77 73.1 Favored 'General case' 0 N--CA 1.474 0.754 0 N-CA-C 113.661 0.986 . . . . 0.0 113.661 -176.073 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 75.19 178.87 42.9 Favored Glycine 0 CA--C 1.535 1.284 0 C-N-CA 124.412 1.006 . . . . 0.0 112.852 -172.06 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 51.4 p90 -154.78 166.51 33.24 Favored 'General case' 0 CA--C 1.539 0.554 0 N-CA-C 114.179 1.177 . . . . 0.0 114.179 -170.626 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 83.3 t80 -109.16 144.69 36.9 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 125.826 1.65 . . . . 0.0 110.149 167.06 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 39.5 t80 -154.29 136.18 14.56 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 124.832 1.253 . . . . 0.0 111.765 -174.269 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 9.0 t -177.44 145.7 0.6 Allowed Pre-proline 0 N--CA 1.482 1.141 0 C-N-CA 127.036 2.134 . . . . 0.0 110.699 176.115 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 90.9 Cg_endo -76.33 -33.09 3.54 Favored 'Trans proline' 0 CA--C 1.537 0.665 0 C-N-CA 122.863 2.375 . . . . 0.0 112.251 166.173 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 1.3 tmmt? -163.84 135.58 4.8 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 124.734 1.214 . . . . 0.0 111.925 -168.454 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 8.9 t . . . . . 0 C--O 1.254 1.294 0 C-N-CA 126.829 2.051 . . . . 0.0 111.556 178.618 . . . . . . . . 0 0 . 1 . 031 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 1.272 0 N-CA-C 112.211 -0.356 . . . . 0.0 112.211 . . . . . . . . . 0 0 . 1 . 031 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 22.4 pt -101.72 -36.02 4.45 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.32 0 C-N-CA 127.545 2.338 . . . . 0.0 114.346 -4.868 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 21.5 t -63.43 -32.22 55.8 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.239 0 CA-C-N 119.391 0.996 . . . . 0.0 112.94 -165.834 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -85.65 -48.26 9.04 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 125.157 1.383 . . . . 0.0 111.405 176.529 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 62.9 tt0 -69.7 -43.68 71.95 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 124.582 1.153 . . . . 0.0 112.193 -172.436 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 74.0 m -74.15 -15.68 61.02 Favored 'General case' 0 N--CA 1.464 0.256 0 N-CA-C 113.595 0.961 . . . . 0.0 113.595 -179.763 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 44.6 t -85.22 -52.62 5.79 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 125.519 1.528 . . . . 0.0 111.783 172.283 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 37.4 p -74.14 -44.32 54.12 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 124.693 1.197 . . . . 0.0 112.476 -176.525 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 50.9 m -101.54 -161.25 0.84 Allowed 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 125.415 1.486 . . . . 0.0 109.737 164.596 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 27.3 pt -112.31 151.38 14.3 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.708 0 O-C-N 120.801 -1.187 . . . . 0.0 111.311 175.309 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 69.6 m -131.1 161.25 32.48 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 124.741 1.216 . . . . 0.0 111.83 172.841 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 47.1 p -97.77 165.19 12.07 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 124.548 1.139 . . . . 0.0 113.385 176.555 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 58.0 mt -63.81 -33.13 74.98 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 123.571 0.748 . . . . 0.0 111.988 171.492 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 88.5 t80 -67.35 -33.66 75.69 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 123.663 0.785 . . . . 0.0 112.891 173.644 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 92.2 mt-30 -73.09 -33.81 65.82 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 123.464 0.705 . . . . 0.0 111.751 173.553 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 90.9 mt -64.94 -39.59 93.73 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 118.766 0.712 . . . . 0.0 111.701 166.555 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 29.8 tt0 -64.2 -30.64 71.69 Favored 'General case' 0 CA--C 1.543 0.698 0 N-CA-C 112.822 0.675 . . . . 0.0 112.822 179.748 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 18.4 t-20 -60.35 -21.62 62.3 Favored 'General case' 0 CA--C 1.551 1.014 0 O-C-N 121.177 -0.952 . . . . 0.0 113.362 172.794 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 27.6 m-85 -99.89 4.97 45.37 Favored 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 126.301 1.84 . . . . 0.0 113.89 177.128 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 74.7 m -65.57 150.37 48.53 Favored 'General case' 0 N--CA 1.473 0.682 0 O-C-N 120.65 -1.281 . . . . 0.0 111.877 167.303 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 4.8 t30 . . . . . 0 C--O 1.251 1.158 0 C-N-CA 125.646 1.578 . . . . 0.0 112.028 177.176 . . . . . . . . 0 0 . 1 . 031 nuclear nobuild full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 95.0 m-85 . . . . . 0 N--CA 1.485 1.305 0 CA-C-O 119.657 -0.211 . . . . 0.0 110.846 . . . . . . . . . 0 0 . 1 . 031 nuclear nobuild full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 10.8 p -68.52 140.98 18.1 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.051 0 CA-C-N 118.47 0.577 . . . . 0.0 110.902 173.882 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 4.6 m-80 -116.82 145.01 43.82 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 125.308 1.443 . . . . 0.0 111.312 175.998 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 41.9 mt-30 -146.42 157.49 43.77 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 124.549 1.14 . . . . 0.0 111.423 -174.74 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 81.8 m-70 -79.3 125.76 29.91 Favored 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 108.173 -1.047 . . . . 0.0 108.173 157.513 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 93.2 mt -137.93 121.51 17.33 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 125.187 1.395 . . . . 0.0 109.612 -176.086 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 59.0 m -128.48 138.58 52.35 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 125.136 1.375 . . . . 0.0 110.633 -174.402 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 52.64 -121.59 15.69 Favored Glycine 0 N--CA 1.473 1.13 0 C-N-CA 124.773 1.178 . . . . 0.0 113.484 167.369 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 31.7 p -61.96 -31.73 72.1 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 124.799 1.24 . . . . 0.0 113.293 -179.789 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 93.0 m-70 -69.75 -37.53 76.46 Favored 'General case' 0 CA--C 1.54 0.591 0 O-C-N 120.896 -1.128 . . . . 0.0 111.436 174.748 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 6.9 tt -68.0 -43.44 78.88 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-O 118.581 -0.724 . . . . 0.0 110.98 172.035 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 53.2 t -55.86 -45.56 79.8 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.004 0 CA-C-N 118.985 0.811 . . . . 0.0 111.253 173.647 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 7.1 tp10 -63.21 -46.96 84.56 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 123.573 0.749 . . . . 0.0 111.281 178.002 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.64 -48.14 80.67 Favored 'General case' 0 CA--C 1.537 0.481 0 O-C-N 121.609 -0.682 . . . . 0.0 111.808 178.881 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 44.1 tp -60.2 -46.62 89.09 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 125.356 1.462 . . . . 0.0 111.124 178.726 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 67.5 t80 -57.69 -42.67 84.14 Favored 'General case' 0 CA--C 1.539 0.522 0 N-CA-C 113.012 0.745 . . . . 0.0 113.012 173.481 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 83.6 mt -74.45 -32.43 62.6 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 123.771 0.828 . . . . 0.0 112.784 -179.741 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 25.8 t -66.29 -46.91 85.96 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.884 0 C-N-CA 124.268 1.027 . . . . 0.0 110.456 171.471 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 75.8 m -80.44 -32.55 37.26 Favored 'General case' 0 N--CA 1.467 0.398 0 N-CA-C 113.628 0.973 . . . . 0.0 113.628 -174.345 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 64.3 -134.13 39.29 Favored Glycine 0 CA--C 1.529 0.914 0 C-N-CA 124.167 0.889 . . . . 0.0 111.454 -176.397 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -68.84 -12.08 61.16 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 124.497 1.119 . . . . 0.0 113.956 179.448 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 86.5 mtm180 -65.25 -32.27 73.86 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 124.162 0.985 . . . . 0.0 113.058 179.802 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 79.26 -179.98 52.51 Favored Glycine 0 CA--C 1.533 1.16 0 C-N-CA 124.517 1.056 . . . . 0.0 112.626 -171.329 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 48.3 p90 -151.73 161.45 42.65 Favored 'General case' 0 N--CA 1.468 0.449 0 N-CA-C 114.057 1.132 . . . . 0.0 114.057 -174.645 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 82.7 t80 -105.13 125.74 51.31 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 125.807 1.643 . . . . 0.0 109.216 167.627 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 62.2 t80 -99.15 -32.26 11.33 Favored 'General case' 0 N--CA 1.475 0.814 0 N-CA-C 114.945 1.461 . . . . 0.0 114.945 -170.265 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 24.2 m -60.83 123.7 76.1 Favored Pre-proline 0 N--CA 1.477 0.877 0 C-N-CA 124.557 1.143 . . . . 0.0 111.615 -162.567 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 68.6 Cg_endo -82.31 171.3 12.61 Favored 'Trans proline' 0 C--N 1.351 0.696 0 C-N-CA 123.322 2.681 . . . . 0.0 111.857 -179.457 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 63.5 tttp -59.07 134.27 56.84 Favored 'General case' 0 CA--C 1.551 1.009 0 C-N-CA 124.058 0.943 . . . . 0.0 112.211 167.764 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 29.9 m . . . . . 0 N--CA 1.489 1.503 0 C-N-CA 129.02 2.928 . . . . 0.0 111.739 176.924 . . . . . . . . 0 0 . 1 . 032 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.74 0 N-CA-C 111.218 -0.753 . . . . 0.0 111.218 . . . . . . . . . 0 0 . 1 . 032 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 25.0 pt -61.72 -28.03 43.36 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.158 0 O-C-N 121.335 -1.097 . . . . 0.0 113.673 -167.677 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 37.9 t -65.83 -23.49 32.45 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.898 0 CA-C-N 118.916 0.78 . . . . 0.0 111.819 -177.925 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -77.68 -57.82 3.6 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-N 118.722 0.692 . . . . 0.0 110.201 168.318 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 62.5 tp60 -55.72 -49.83 71.98 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 124.786 1.235 . . . . 0.0 112.76 -174.662 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 89.3 m -62.21 -26.01 68.12 Favored 'General case' 0 N--CA 1.466 0.348 0 C-N-CA 124.644 1.178 . . . . 0.0 113.711 179.295 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 14.0 t -98.4 -39.73 8.64 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 124.278 1.031 . . . . 0.0 112.257 -171.902 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 1.7 t -83.36 -27.61 29.57 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 125.052 1.341 . . . . 0.0 112.828 178.315 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 21.1 t -140.82 -153.23 0.45 Allowed 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 126.277 1.831 . . . . 0.0 108.828 176.583 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 43.6 pt -101.09 156.24 4.4 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.401 0 C-N-CA 123.889 0.876 . . . . 0.0 111.608 175.329 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 18.1 p -140.17 165.95 26.0 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 124.252 1.021 . . . . 0.0 111.898 173.567 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 88.3 p -104.17 155.72 18.48 Favored 'General case' 0 C--O 1.236 0.383 0 C-N-CA 124.291 1.036 . . . . 0.0 112.481 -175.112 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 57.2 mt -59.02 -29.02 66.95 Favored 'General case' 0 CA--C 1.533 0.293 0 O-C-N 121.294 -0.878 . . . . 0.0 112.058 170.557 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 84.4 t80 -67.2 -29.77 69.53 Favored 'General case' 0 CA--C 1.542 0.653 0 N-CA-C 113.648 0.981 . . . . 0.0 113.648 171.648 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 -78.98 -33.0 45.52 Favored 'General case' 0 N--CA 1.468 0.464 0 O-C-N 121.43 -0.794 . . . . 0.0 110.637 174.333 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 10.8 mp -60.89 -44.46 97.08 Favored 'General case' 0 CA--C 1.542 0.658 0 CA-C-N 118.124 0.42 . . . . 0.0 111.076 164.891 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 31.9 tt0 -63.64 -37.17 86.31 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 123.969 0.908 . . . . 0.0 112.492 179.266 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 21.3 t-20 -61.27 -22.85 65.23 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 123.933 0.893 . . . . 0.0 112.955 173.904 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -94.82 -0.94 53.69 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 125.562 1.545 . . . . 0.0 114.01 176.823 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 38.3 m -65.95 140.66 58.33 Favored 'General case' 0 N--CA 1.471 0.597 0 O-C-N 120.657 -1.277 . . . . 0.0 110.731 163.447 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.254 1.303 0 N-CA-C 112.96 0.726 . . . . 0.0 112.96 177.93 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 73.1 m-85 . . . . . 0 N--CA 1.488 1.435 0 N-CA-C 111.222 0.082 . . . . 0.0 111.222 . . . . . . . . . 0 0 . 1 . 032 nuclear nobuild full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 25.1 m -142.72 155.18 17.82 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.113 0 C-N-CA 125.19 1.396 . . . . 0.0 111.52 177.346 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 39.9 m-20 -69.9 151.94 45.07 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 124.759 1.223 . . . . 0.0 111.003 168.047 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 45.0 mt-30 -143.89 159.81 41.9 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 123.723 0.809 . . . . 0.0 112.049 -172.254 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 96.4 m-70 -78.3 133.4 37.64 Favored 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 108.936 -0.765 . . . . 0.0 108.936 155.02 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 93.6 mt -150.53 129.91 12.92 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 125.413 1.485 . . . . 0.0 108.259 -174.6 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 4.1 t -156.82 151.82 26.1 Favored 'General case' 0 N--CA 1.469 0.52 0 O-C-N 121.155 -0.966 . . . . 0.0 112.246 -178.677 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 56.94 -132.16 52.3 Favored Glycine 0 CA--C 1.531 1.033 0 C-N-CA 124.708 1.147 . . . . 0.0 112.698 -179.241 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 25.4 m -61.58 -29.32 69.95 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 124.27 1.028 . . . . 0.0 112.146 -177.615 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 14.9 m80 -68.71 -42.4 77.75 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 124.311 1.044 . . . . 0.0 111.008 178.398 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 51.2 tp -68.7 -44.15 74.56 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-O 118.458 -0.782 . . . . 0.0 110.663 172.806 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 53.7 t -58.57 -40.74 79.94 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.895 0 CA-C-N 119.042 0.837 . . . . 0.0 111.72 177.176 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -66.57 -48.58 69.17 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 123.614 0.766 . . . . 0.0 111.459 175.536 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.51 -44.21 97.47 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-O 121.318 0.58 . . . . 0.0 111.809 179.564 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 40.6 tp -60.95 -46.34 91.11 Favored 'General case' 0 C--N 1.333 -0.124 0 C-N-CA 124.905 1.282 . . . . 0.0 111.058 175.9 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 50.7 t80 -64.59 -26.17 68.29 Favored 'General case' 0 CA--C 1.543 0.691 0 N-CA-C 113.69 0.996 . . . . 0.0 113.69 173.814 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 73.7 mt -75.6 -32.44 60.31 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-N 119.71 1.141 . . . . 0.0 113.087 172.341 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 92.6 t -76.85 -38.9 29.91 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.252 0 C-N-CA 124.163 0.985 . . . . 0.0 111.311 173.237 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 63.5 m -105.58 14.68 28.15 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 126.044 1.738 . . . . 0.0 114.158 -172.566 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . -56.98 -36.71 75.0 Favored Glycine 0 N--CA 1.477 1.413 0 CA-C-N 119.275 0.943 . . . . 0.0 114.958 -168.686 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 4.4 mp0 -77.54 -11.75 59.89 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 124.917 1.287 . . . . 0.0 113.494 175.816 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 24.2 mmm180 -111.45 -53.03 2.74 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 126.225 1.81 . . . . 0.0 113.415 -169.467 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 92.18 162.61 37.44 Favored Glycine 0 CA--C 1.536 1.358 0 C-N-CA 124.706 1.146 . . . . 0.0 111.317 -153.641 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 49.5 p90 -142.02 156.58 45.43 Favored 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 114.403 1.26 . . . . 0.0 114.403 -170.94 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 57.3 t80 -94.27 158.57 15.52 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 127.393 2.277 . . . . 0.0 110.008 165.098 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 53.2 t80 -156.32 125.07 5.92 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 124.223 1.009 . . . . 0.0 111.96 -173.404 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 13.9 t -171.69 146.25 1.83 Allowed Pre-proline 0 N--CA 1.483 1.175 0 C-N-CA 125.794 1.638 . . . . 0.0 112.281 177.612 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 92.9 Cg_endo -81.13 -26.83 3.23 Favored 'Trans proline' 0 C--N 1.35 0.628 0 C-N-CA 123.145 2.563 . . . . 0.0 112.512 166.692 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 10.8 ptmt 174.59 -26.79 0.0 OUTLIER 'General case' 0 N--CA 1.481 1.115 0 C-N-CA 127.563 2.345 . . . . 0.0 113.995 -170.135 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 15.3 m . . . . . 0 C--O 1.254 1.298 0 C-N-CA 126.886 2.074 . . . . 0.0 112.846 178.08 . . . . . . . . 0 0 . 1 . 033 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.738 0 N-CA-C 112.589 -0.204 . . . . 0.0 112.589 . . . . . . . . . 0 0 . 1 . 033 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 25.3 pt -59.53 -42.96 89.72 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.167 0 N-CA-C 114.559 1.318 . . . . 0.0 114.559 -167.817 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 70.6 t -60.44 -27.96 41.17 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.281 0 CA-C-N 119.564 1.074 . . . . 0.0 112.166 -179.913 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 -79.64 -64.52 1.17 Allowed 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 123.594 0.758 . . . . 0.0 109.352 170.347 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 11.1 tt0 -58.69 -47.28 85.06 Favored 'General case' 0 N--CA 1.465 0.29 0 C-N-CA 125.063 1.345 . . . . 0.0 112.442 -168.048 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 87.3 m -64.86 -23.08 67.12 Favored 'General case' 0 C--O 1.234 0.255 0 N-CA-C 113.645 0.98 . . . . 0.0 113.645 -178.526 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 8.4 t -101.98 -31.41 10.68 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 123.49 0.716 . . . . 0.0 112.597 -172.377 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 80.7 p -88.6 -28.16 20.88 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 124.532 1.133 . . . . 0.0 112.9 172.399 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 11.8 t -139.13 -160.05 1.02 Allowed 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 126.492 1.917 . . . . 0.0 109.622 178.495 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 42.6 pt -96.51 156.98 3.3 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.476 0 C-N-CA 124.416 1.086 . . . . 0.0 111.731 176.061 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 18.2 p -147.35 160.55 42.41 Favored 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 124.219 1.008 . . . . 0.0 112.695 175.409 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 50.8 m -109.6 155.41 21.47 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 124.568 1.147 . . . . 0.0 111.774 -174.979 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 33.1 mt -60.41 -31.13 70.09 Favored 'General case' 0 N--CA 1.469 0.48 0 O-C-N 120.949 -1.094 . . . . 0.0 112.078 177.762 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 33.4 m-85 -61.09 -30.16 70.18 Favored 'General case' 0 CA--C 1.542 0.66 0 N-CA-C 113.558 0.947 . . . . 0.0 113.558 171.22 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 96.2 mt-30 -81.78 -34.55 30.28 Favored 'General case' 0 N--CA 1.465 0.294 0 C-N-CA 123.94 0.896 . . . . 0.0 110.298 177.355 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 8.3 mp -62.12 -40.39 95.73 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 118.775 0.716 . . . . 0.0 111.785 166.653 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -59.16 -28.35 66.51 Favored 'General case' 0 CA--C 1.541 0.596 0 C-N-CA 124.587 1.155 . . . . 0.0 113.105 -178.146 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 5.4 m-80 -66.29 -16.33 63.95 Favored 'General case' 0 CA--C 1.546 0.816 0 N-CA-C 113.795 1.035 . . . . 0.0 113.795 175.559 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 72.5 m-85 -102.21 5.2 40.04 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 125.908 1.683 . . . . 0.0 113.458 177.609 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 86.0 m -66.42 153.84 41.74 Favored 'General case' 0 N--CA 1.473 0.701 0 O-C-N 121.018 -1.052 . . . . 0.0 112.422 167.735 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 28.1 t30 . . . . . 0 C--O 1.252 1.203 0 C-N-CA 125.577 1.551 . . . . 0.0 112.185 175.763 . . . . . . . . 0 0 . 1 . 033 nuclear nobuild full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 50.9 p90 . . . . . 0 N--CA 1.488 1.431 0 N-CA-C 110.807 -0.072 . . . . 0.0 110.807 . . . . . . . . . 0 0 . 1 . 033 nuclear nobuild full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 9.0 p -156.64 154.57 6.01 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.052 0 C-N-CA 124.736 1.214 . . . . 0.0 111.473 -177.219 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 10.4 p30 -127.02 148.01 50.12 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 125.617 1.567 . . . . 0.0 111.569 171.973 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 38.7 mt-30 -150.43 167.42 27.17 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 124.444 1.098 . . . . 0.0 111.479 -166.673 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 92.4 m-70 -86.72 136.74 32.9 Favored 'General case' 0 CA--C 1.542 0.671 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 152.675 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 93.3 mt -148.93 136.03 19.99 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 125.582 1.553 . . . . 0.0 109.412 -176.875 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 73.0 m -140.74 145.29 36.23 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 124.742 1.217 . . . . 0.0 110.526 -179.11 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 52.53 -125.71 29.81 Favored Glycine 0 N--CA 1.473 1.135 0 C-N-CA 124.772 1.177 . . . . 0.0 114.503 165.381 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 23.6 m -60.39 -36.92 79.21 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 124.061 0.944 . . . . 0.0 111.941 -177.656 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 27.5 m170 -68.62 -37.93 80.13 Favored 'General case' 0 CA--C 1.54 0.559 0 O-C-N 121.325 -0.86 . . . . 0.0 111.809 178.25 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 9.6 tt -64.14 -45.94 86.29 Favored 'General case' 0 C--O 1.223 -0.305 0 C-N-CA 123.993 0.917 . . . . 0.0 110.796 170.074 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 41.7 t -61.65 -37.18 77.34 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.963 0 C-N-CA 123.602 0.761 . . . . 0.0 111.836 178.4 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -68.31 -45.43 72.99 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 124.022 0.929 . . . . 0.0 111.804 173.364 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.76 -43.67 97.72 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 119.352 0.978 . . . . 0.0 111.756 175.248 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 51.4 tp -61.15 -48.76 80.12 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 125.222 1.409 . . . . 0.0 111.022 177.109 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 46.9 t80 -54.35 -40.02 67.66 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 123.49 0.716 . . . . 0.0 112.659 172.436 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 82.2 mt -74.9 -33.9 62.1 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 123.961 0.904 . . . . 0.0 113.248 178.703 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 40.0 t -65.85 -44.7 92.7 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.924 0 C-N-CA 124.413 1.085 . . . . 0.0 110.98 172.15 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 58.5 m -83.41 -29.81 27.82 Favored 'General case' 0 N--CA 1.469 0.504 0 N-CA-C 113.676 0.991 . . . . 0.0 113.676 -175.087 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 67.61 -144.89 44.63 Favored Glycine 0 CA--C 1.532 1.129 0 C-N-CA 124.224 0.916 . . . . 0.0 112.012 -174.499 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -68.96 -7.42 35.05 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 124.65 1.18 . . . . 0.0 114.139 -178.953 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 80.0 mtt85 -61.31 -31.88 71.74 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 124.733 1.213 . . . . 0.0 113.389 177.049 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 86.34 179.35 49.55 Favored Glycine 0 CA--C 1.533 1.164 0 C-N-CA 125.112 1.339 . . . . 0.0 112.441 -170.654 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 52.6 p90 -159.65 167.32 28.69 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 124.729 1.212 . . . . 0.0 112.833 -173.274 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 81.7 t80 -132.97 96.27 3.74 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 125.999 1.72 . . . . 0.0 108.314 172.209 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 21.6 p90 -73.49 -19.16 61.0 Favored 'General case' 0 CA--C 1.541 0.605 0 N-CA-C 115.029 1.492 . . . . 0.0 115.029 -167.883 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 26.8 m -57.33 126.68 75.18 Favored Pre-proline 0 N--CA 1.473 0.711 0 C-N-CA 125.769 1.627 . . . . 0.0 110.196 -175.408 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 68.4 Cg_endo -74.2 -24.32 14.76 Favored 'Trans proline' 0 C--N 1.349 0.563 0 C-N-CA 123.173 2.582 . . . . 0.0 114.346 -166.649 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 25.4 ttmt -137.01 -2.61 2.07 Favored 'General case' 0 CA--C 1.551 0.982 0 N-CA-C 114.377 1.251 . . . . 0.0 114.377 -165.131 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 23.7 m . . . . . 0 N--CA 1.487 1.414 0 C-N-CA 128.976 2.91 . . . . 0.0 112.67 177.974 . . . . . . . . 0 0 . 1 . 034 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.729 0 CA-C-O 119.293 -0.726 . . . . 0.0 111.467 . . . . . . . . . 0 0 . 1 . 034 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 17.8 tt -60.16 -25.23 32.78 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.274 0 N-CA-C 115.142 1.534 . . . . 0.0 115.142 -167.367 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 74.7 t -52.87 -39.42 31.69 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.041 0 CA-C-N 119.447 1.021 . . . . 0.0 111.396 170.884 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 18.8 tt0 -79.17 0.89 26.49 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 123.642 0.777 . . . . 0.0 113.027 -179.519 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 6.7 tp60 -104.54 -63.05 1.25 Allowed 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 124.458 1.103 . . . . 0.0 109.643 166.032 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 64.5 m -66.19 -26.18 67.28 Favored 'General case' 0 N--CA 1.467 0.424 0 N-CA-C 115.151 1.537 . . . . 0.0 115.151 -170.152 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 12.1 t -87.61 -33.36 18.88 Favored 'General case' 0 N--CA 1.471 0.585 0 O-C-N 121.708 -0.62 . . . . 0.0 112.594 -172.117 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 20.7 p -105.69 -35.29 7.44 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 126.29 1.836 . . . . 0.0 112.826 -175.806 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.1 t -112.18 -171.79 1.92 Allowed 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 125.48 1.512 . . . . 0.0 110.31 169.579 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 11.1 tt -92.83 146.72 6.03 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.686 0 C-N-CA 124.807 1.243 . . . . 0.0 110.329 173.624 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 27.2 p -133.56 158.21 43.73 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-O 121.805 0.812 . . . . 0.0 112.448 175.285 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 83.8 p -104.78 158.29 16.62 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 125.006 1.322 . . . . 0.0 111.939 -179.802 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 55.8 mt -60.16 -30.29 69.22 Favored 'General case' 0 N--CA 1.466 0.34 0 O-C-N 121.083 -1.011 . . . . 0.0 111.927 173.87 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 76.9 t80 -65.7 -31.98 73.29 Favored 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 113.398 0.888 . . . . 0.0 113.398 171.249 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 40.5 mt-30 -73.73 -36.84 65.22 Favored 'General case' 0 N--CA 1.468 0.458 0 O-C-N 121.5 -0.75 . . . . 0.0 110.483 173.144 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 7.0 mp -61.59 -40.12 93.64 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-N 118.608 0.64 . . . . 0.0 111.603 168.992 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 27.5 tt0 -68.51 -32.41 72.35 Favored 'General case' 0 CA--C 1.544 0.737 0 N-CA-C 112.786 0.661 . . . . 0.0 112.786 178.83 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 6.3 m-80 -66.21 -15.11 62.89 Favored 'General case' 0 CA--C 1.549 0.936 0 O-C-N 120.914 -1.116 . . . . 0.0 112.976 171.05 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 14.0 m-85 -97.75 1.33 48.32 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 125.889 1.676 . . . . 0.0 113.639 172.381 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 39.4 m -65.41 146.68 54.59 Favored 'General case' 0 CA--C 1.546 0.789 0 CA-C-N 119.93 1.241 . . . . 0.0 110.794 162.144 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.252 1.196 0 C-N-CA 123.713 0.805 . . . . 0.0 112.974 174.949 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 63.7 m-85 . . . . . 0 N--CA 1.487 1.384 0 CA-C-O 119.64 -0.219 . . . . 0.0 111.167 . . . . . . . . . 0 0 . 1 . 034 nuclear nobuild full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 22.0 m -141.79 152.07 18.98 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.104 0 C-N-CA 125.096 1.358 . . . . 0.0 111.842 177.292 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 65.4 m-20 -80.52 150.23 29.71 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 125.071 1.348 . . . . 0.0 110.426 169.836 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 41.9 mt-30 -146.03 159.29 43.47 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 123.575 0.75 . . . . 0.0 112.02 -166.908 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 99.0 m-70 -86.13 133.24 33.88 Favored 'General case' 0 CA--C 1.54 0.576 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 154.772 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 96.3 mt -146.66 135.52 22.33 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 125.375 1.47 . . . . 0.0 108.668 -172.007 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 4.2 t -160.45 154.8 23.46 Favored 'General case' 0 N--CA 1.466 0.348 0 O-C-N 121.538 -0.726 . . . . 0.0 111.99 -175.584 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 62.97 -139.61 44.92 Favored Glycine 0 N--CA 1.47 0.943 0 C-N-CA 123.969 0.795 . . . . 0.0 112.691 -178.845 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 23.9 p -61.83 -29.09 69.94 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 124.675 1.19 . . . . 0.0 112.411 179.64 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 15.7 m80 -62.6 -42.09 99.36 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 124.311 1.044 . . . . 0.0 111.939 176.668 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 40.4 tp -71.72 -40.0 69.75 Favored 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 123.628 0.771 . . . . 0.0 111.432 175.299 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 88.1 t -58.5 -43.19 86.37 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.202 0 C-N-CA 123.094 0.558 . . . . 0.0 111.406 173.31 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -67.31 -43.41 81.75 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 124.291 1.037 . . . . 0.0 111.752 176.443 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.36 -44.49 97.08 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 122.942 0.497 . . . . 0.0 111.671 177.14 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 34.9 mt -60.43 -46.59 89.48 Favored 'General case' 0 N--CA 1.467 0.407 0 C-N-CA 124.046 0.938 . . . . 0.0 111.084 174.408 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 84.2 t80 -56.56 -39.57 73.68 Favored 'General case' 0 CA--C 1.543 0.705 0 CA-C-N 118.725 0.693 . . . . 0.0 112.75 174.263 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 89.8 mt -77.62 -36.01 52.12 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 124.074 0.949 . . . . 0.0 113.47 179.805 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 41.1 t -69.14 -44.46 80.86 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.921 0 C-N-CA 124.036 0.934 . . . . 0.0 110.741 174.571 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 75.0 m -85.72 -30.75 22.88 Favored 'General case' 0 N--CA 1.47 0.531 0 N-CA-C 113.374 0.879 . . . . 0.0 113.374 -173.205 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 63.49 -132.08 41.42 Favored Glycine 0 CA--C 1.531 1.046 0 C-N-CA 123.975 0.797 . . . . 0.0 111.377 -177.508 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -69.74 -11.72 61.07 Favored 'General case' 0 CA--C 1.547 0.849 0 N-CA-C 113.8 1.037 . . . . 0.0 113.8 179.797 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 83.8 mtm180 -64.73 -37.45 87.65 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-N 119.13 0.877 . . . . 0.0 112.898 -179.459 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 83.07 169.68 45.02 Favored Glycine 0 CA--C 1.534 1.269 0 C-N-CA 124.513 1.054 . . . . 0.0 112.822 -170.356 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 53.5 p90 -153.34 160.61 42.72 Favored 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 114.198 1.184 . . . . 0.0 114.198 -170.398 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 46.0 t80 -101.42 154.51 18.75 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 126.317 1.847 . . . . 0.0 110.219 164.59 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 47.9 t80 -143.11 -35.14 0.41 Allowed 'General case' 0 CA--C 1.543 0.707 0 N-CA-C 114.604 1.335 . . . . 0.0 114.604 -172.029 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 11.6 m -51.89 138.49 33.85 Favored Pre-proline 0 N--CA 1.478 0.944 0 C-N-CA 126.338 1.855 . . . . 0.0 112.912 -163.742 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_exo -57.82 166.43 5.24 Favored 'Trans proline' 0 C--N 1.351 0.684 0 C-N-CA 124.07 3.18 . . . . 0.0 113.861 173.566 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -64.75 -39.56 93.83 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 123.693 0.797 . . . . 0.0 111.994 171.928 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 34.0 m . . . . . 0 N--CA 1.488 1.462 0 C-N-CA 129.669 3.188 . . . . 0.0 111.79 178.172 . . . . . . . . 0 0 . 1 . 035 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.663 0 N-CA-C 112.57 -0.212 . . . . 0.0 112.57 . . . . . . . . . 0 0 . 1 . 035 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 10.5 tp -126.3 -32.98 0.91 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.233 0 C-N-CA 127.615 2.366 . . . . 0.0 114.185 1.938 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 54.7 t -60.74 -59.85 3.56 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.27 0 CA-C-N 120.178 1.353 . . . . 0.0 112.553 -170.611 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -71.42 -33.68 69.63 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 118.187 0.449 . . . . 0.0 111.354 -178.873 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 18.1 tt0 -59.66 -56.89 16.26 Favored 'General case' 0 N--CA 1.466 0.334 0 C-N-CA 123.411 0.684 . . . . 0.0 110.987 177.948 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 2.1 t -73.45 -15.9 61.32 Favored 'General case' 0 N--CA 1.469 0.515 0 N-CA-C 113.547 0.943 . . . . 0.0 113.547 -174.276 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 26.2 t -90.29 -35.41 15.29 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 123.853 0.861 . . . . 0.0 112.999 178.634 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 76.8 p -95.58 -37.03 11.03 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 124.417 1.087 . . . . 0.0 113.097 177.833 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 17.7 t -113.46 -147.54 0.42 Allowed 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 126.923 2.089 . . . . 0.0 108.74 168.075 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 44.5 pt -118.01 168.49 9.86 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 C-N-CA 125.113 1.365 . . . . 0.0 112.616 -179.767 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 20.1 p -147.44 159.09 44.11 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 124.501 1.121 . . . . 0.0 111.661 166.663 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 88.6 p -96.17 162.12 13.67 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 125.142 1.377 . . . . 0.0 112.43 174.822 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 57.5 mt -60.42 -34.2 73.61 Favored 'General case' 0 N--CA 1.468 0.464 0 O-C-N 121.391 -0.818 . . . . 0.0 111.535 173.292 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 79.9 m-85 -65.6 -34.04 77.3 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 123.81 0.844 . . . . 0.0 113.014 173.028 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 45.2 mt-30 -72.28 -35.88 68.82 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-O 118.468 -0.777 . . . . 0.0 111.98 171.718 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 68.5 mt -58.57 -46.4 86.99 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 119.143 0.883 . . . . 0.0 110.949 169.276 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 22.5 tt0 -69.53 -27.34 65.08 Favored 'General case' 0 CA--C 1.541 0.597 0 N-CA-C 113.307 0.855 . . . . 0.0 113.307 -178.251 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.7 m-80 -62.65 -22.42 66.43 Favored 'General case' 0 CA--C 1.546 0.791 0 O-C-N 120.954 -1.091 . . . . 0.0 113.504 176.579 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 62.6 m-85 -99.91 0.81 41.99 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 125.169 1.388 . . . . 0.0 113.709 174.231 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 89.7 m -83.79 166.56 17.88 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 124.197 0.999 . . . . 0.0 113.188 171.838 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 32.3 m120 . . . . . 0 C--O 1.254 1.316 0 C-N-CA 124.771 1.228 . . . . 0.0 112.287 174.113 . . . . . . . . 0 0 . 1 . 035 nuclear nobuild full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 77.6 m-85 . . . . . 0 N--CA 1.486 1.363 0 N-CA-C 111.286 0.106 . . . . 0.0 111.286 . . . . . . . . . 0 0 . 1 . 035 nuclear nobuild full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 15.9 m -139.61 36.99 0.43 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.367 0 C-N-CA 126.052 1.741 . . . . 0.0 111.134 177.329 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 8.1 p-10 -165.8 147.1 7.0 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 125.723 1.609 . . . . 0.0 112.745 -157.381 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 41.7 mt-30 -152.14 169.16 23.11 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 125.11 1.364 . . . . 0.0 111.885 -169.29 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 98.4 m-70 -88.17 135.35 33.48 Favored 'General case' 0 CA--C 1.542 0.673 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 150.276 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 86.6 mt -145.09 132.28 20.49 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 125.063 1.345 . . . . 0.0 110.53 -179.055 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 63.6 m -131.51 141.87 49.83 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 125.568 1.547 . . . . 0.0 110.295 178.097 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 51.57 -120.26 9.83 Favored Glycine 0 N--CA 1.475 1.28 0 C-N-CA 124.843 1.211 . . . . 0.0 114.372 165.543 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 29.3 m -60.13 -33.8 72.64 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 124.234 1.014 . . . . 0.0 112.627 -177.742 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 97.1 m-70 -72.16 -38.21 69.21 Favored 'General case' 0 CA--C 1.54 0.574 0 O-C-N 121.324 -0.86 . . . . 0.0 111.324 177.554 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 62.6 tp -65.13 -45.34 85.45 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 123.718 0.807 . . . . 0.0 111.126 172.392 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 27.5 t -60.38 -41.69 88.21 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.898 0 C-N-CA 124.246 1.018 . . . . 0.0 111.771 175.61 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -63.77 -47.41 81.07 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 123.631 0.772 . . . . 0.0 111.423 174.498 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.49 -43.87 97.75 Favored 'General case' 0 CA--C 1.541 0.62 0 O-C-N 121.691 -0.631 . . . . 0.0 112.477 179.549 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 25.5 mt -54.27 -50.93 66.1 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 124.45 1.1 . . . . 0.0 110.913 172.354 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 57.7 t80 -63.75 -33.06 74.82 Favored 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 113.463 0.912 . . . . 0.0 113.463 176.9 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 74.5 mt -74.69 -36.28 62.75 Favored 'General case' 0 N--CA 1.472 0.631 0 O-C-N 121.044 -1.035 . . . . 0.0 113.175 177.394 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 53.2 t -71.72 -43.44 70.18 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.875 0 C-N-CA 123.762 0.825 . . . . 0.0 111.066 175.709 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 65.1 m -104.72 -17.77 14.52 Favored 'General case' 0 N--CA 1.475 0.783 0 N-CA-C 114.467 1.284 . . . . 0.0 114.467 -166.593 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 67.72 -155.57 52.87 Favored Glycine 0 CA--C 1.531 1.081 0 C-N-CA 124.927 1.251 . . . . 0.0 113.18 179.642 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -71.83 -1.75 15.28 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 124.526 1.13 . . . . 0.0 113.297 175.606 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 29.1 ttp180 -60.83 -26.21 67.16 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 125.45 1.5 . . . . 0.0 112.886 176.531 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 111.5 139.52 7.9 Favored Glycine 0 CA--C 1.53 1.001 0 C-N-CA 126.392 1.949 . . . . 0.0 112.863 177.093 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 40.9 p90 -144.07 166.92 23.63 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 125.671 1.589 . . . . 0.0 112.167 -176.647 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 44.5 t80 -153.38 141.67 20.56 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-O 121.74 0.781 . . . . 0.0 112.564 169.588 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 19.4 p90 -88.58 80.69 7.27 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 126.626 1.97 . . . . 0.0 110.597 175.558 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 55.8 m -62.5 122.0 70.79 Favored Pre-proline 0 N--CA 1.478 0.966 0 C-N-CA 125.678 1.591 . . . . 0.0 112.229 -176.09 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 66.4 Cg_endo -80.06 169.36 17.81 Favored 'Trans proline' 0 CA--C 1.537 0.65 0 C-N-CA 124.128 3.219 . . . . 0.0 111.7 176.097 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 33.7 ttmt -66.27 140.26 58.12 Favored 'General case' 0 CA--C 1.549 0.917 0 C-N-CA 123.694 0.798 . . . . 0.0 112.041 172.446 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 18.8 m . . . . . 0 C--O 1.253 1.275 0 C-N-CA 126.278 1.831 . . . . 0.0 112.889 -178.336 . . . . . . . . 0 0 . 1 . 036 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.67 0 N-CA-C 112.52 -0.232 . . . . 0.0 112.52 . . . . . . . . . 0 0 . 1 . 036 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 20.1 pt -63.11 -37.34 79.13 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.249 0 N-CA-C 115.086 1.513 . . . . 0.0 115.086 -163.973 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 85.2 t -63.99 -35.87 74.92 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.259 0 CA-C-N 118.952 0.796 . . . . 0.0 110.909 176.102 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -74.04 -47.81 34.29 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 123.097 0.559 . . . . 0.0 110.102 176.379 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 13.3 tm0? -58.74 -47.07 85.9 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 124.499 1.12 . . . . 0.0 111.693 -177.409 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 12.4 m -59.15 -23.89 62.56 Favored 'General case' 0 N--CA 1.47 0.525 0 N-CA-C 113.727 1.01 . . . . 0.0 113.727 174.988 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 49.4 t -98.13 -49.23 4.81 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 124.97 1.308 . . . . 0.0 113.324 -172.191 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 77.0 p -79.04 -36.11 41.57 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 124.641 1.176 . . . . 0.0 112.087 -179.662 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 13.2 t -106.77 -154.68 0.53 Allowed 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 125.554 1.542 . . . . 0.0 109.319 164.438 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 26.7 pt -117.29 155.6 18.88 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.624 0 C-N-CA 125.704 1.602 . . . . 0.0 111.474 178.036 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 16.1 p -145.87 162.32 38.0 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 124.041 0.936 . . . . 0.0 111.935 171.772 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 32.6 t -101.85 156.27 17.62 Favored 'General case' 0 N--CA 1.465 0.318 0 C-N-CA 124.071 0.948 . . . . 0.0 112.74 -173.383 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 55.5 mt -59.56 -31.95 69.9 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 124.178 0.991 . . . . 0.0 111.461 174.192 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 3.5 m-30 -67.62 -25.26 65.66 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 124.307 1.043 . . . . 0.0 112.727 173.703 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 89.2 mt-30 -88.41 -31.04 19.03 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 124.405 1.082 . . . . 0.0 110.527 178.505 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 10.9 mp -57.28 -52.65 64.48 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 122.964 0.506 . . . . 0.0 110.578 161.694 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 5.6 tm-20 -58.95 -29.51 67.19 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 124.956 1.303 . . . . 0.0 113.413 -173.971 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 22.3 t30 -51.76 -30.01 21.04 Favored 'General case' 0 CA--C 1.549 0.918 0 C-N-CA 124.934 1.293 . . . . 0.0 114.29 175.087 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 95.2 m-85 -94.79 0.45 54.93 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 125.347 1.459 . . . . 0.0 113.993 -177.343 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 75.3 m -87.36 160.87 18.21 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 124.303 1.041 . . . . 0.0 113.409 177.77 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.253 1.242 0 C-N-CA 124.785 1.234 . . . . 0.0 112.62 179.913 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 94.4 m-85 . . . . . 0 N--CA 1.486 1.349 0 CA-C-O 119.089 -0.481 . . . . 0.0 110.755 . . . . . . . . . 0 0 . 1 . 036 nuclear nobuild full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 7.2 p -165.75 121.89 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.046 0 C-N-CA 125.189 1.396 . . . . 0.0 109.522 171.344 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 40.3 m-80 -99.92 145.66 27.55 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 124.567 1.147 . . . . 0.0 113.331 -168.512 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 36.9 mt-30 -145.57 164.19 32.45 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 125.69 1.596 . . . . 0.0 110.552 177.656 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 98.9 m-70 -81.45 128.98 34.45 Favored 'General case' 0 CA--C 1.538 0.5 0 N-CA-C 108.711 -0.848 . . . . 0.0 108.711 157.889 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 89.9 mt -142.24 124.69 15.7 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 125.498 1.519 . . . . 0.0 109.169 -176.302 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 61.5 m -127.67 137.55 52.54 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 124.256 1.022 . . . . 0.0 111.251 -173.646 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 45.59 -118.85 3.25 Favored Glycine 0 N--CA 1.472 1.075 0 C-N-CA 126.04 1.781 . . . . 0.0 114.708 165.404 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 19.1 m -60.0 -33.11 71.54 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 124.33 1.052 . . . . 0.0 112.693 -178.655 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 83.0 m-70 -78.77 -29.91 45.34 Favored 'General case' 0 CA--C 1.543 0.686 0 O-C-N 121.083 -1.01 . . . . 0.0 112.659 176.885 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 54.4 tp -65.48 -45.44 83.64 Favored 'General case' 0 N--CA 1.47 0.571 0 O-C-N 121.444 -0.785 . . . . 0.0 110.991 167.909 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 77.1 t -65.89 -35.02 74.12 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.022 0 C-N-CA 123.869 0.868 . . . . 0.0 111.934 175.95 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -63.87 -50.4 68.95 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 124.799 1.239 . . . . 0.0 111.569 171.623 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -58.76 -43.55 90.36 Favored 'General case' 0 CA--C 1.54 0.567 0 O-C-N 121.895 -0.503 . . . . 0.0 111.594 176.564 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 52.9 tp -58.8 -47.74 83.71 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 124.818 1.247 . . . . 0.0 111.677 177.23 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 89.7 t80 -59.27 -40.46 86.12 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 123.613 0.765 . . . . 0.0 112.452 173.119 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 90.0 mt -75.61 -35.22 60.58 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 124.113 0.965 . . . . 0.0 113.314 -178.156 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 41.4 t -65.24 -44.22 95.16 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.958 0 C-N-CA 124.378 1.071 . . . . 0.0 110.303 174.406 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 74.4 m -98.77 -17.72 18.35 Favored 'General case' 0 N--CA 1.471 0.611 0 N-CA-C 115.094 1.516 . . . . 0.0 115.094 -169.838 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 65.14 -138.79 39.42 Favored Glycine 0 CA--C 1.53 1.016 0 C-N-CA 124.81 1.195 . . . . 0.0 113.019 176.79 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -63.07 -19.66 64.61 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 125.524 1.53 . . . . 0.0 113.553 -176.392 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 50.8 mtm180 -61.47 -36.69 81.16 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 124.042 0.937 . . . . 0.0 113.151 -178.584 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 72.57 -176.45 42.24 Favored Glycine 0 CA--C 1.533 1.212 0 C-N-CA 123.992 0.806 . . . . 0.0 113.565 -178.17 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 37.9 p90 -156.89 169.98 23.54 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 125.332 1.453 . . . . 0.0 113.121 -168.362 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 89.1 t80 -126.99 133.19 50.61 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 125.124 1.37 . . . . 0.0 109.051 161.577 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -152.28 141.01 20.93 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 123.512 0.725 . . . . 0.0 112.261 -171.53 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 31.1 p -142.41 155.47 64.21 Favored Pre-proline 0 N--CA 1.475 0.776 0 C-N-CA 125.88 1.672 . . . . 0.0 110.792 -174.952 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 88.9 Cg_endo -75.88 -21.67 14.05 Favored 'Trans proline' 0 C--N 1.35 0.644 0 C-N-CA 123.026 2.484 . . . . 0.0 113.09 176.578 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 40.4 ttmt -153.87 143.74 21.9 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 125.597 1.559 . . . . 0.0 110.948 -175.952 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 9.2 t . . . . . 0 C--O 1.253 1.259 0 C-N-CA 126.637 1.975 . . . . 0.0 111.413 -176.33 . . . . . . . . 0 0 . 1 . 037 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.797 0 N-CA-C 111.343 -0.703 . . . . 0.0 111.343 . . . . . . . . . 0 0 . 1 . 037 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 13.3 tt -60.42 -29.67 44.87 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.255 0 N-CA-C 114.555 1.317 . . . . 0.0 114.555 -169.069 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 55.4 t -68.61 -25.62 31.25 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.056 0 CA-C-N 119.026 0.83 . . . . 0.0 111.917 179.62 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 78.5 mt-10 -86.66 -48.06 8.62 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-N 118.946 0.794 . . . . 0.0 111.047 168.72 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 61.8 tp60 -60.46 -44.32 95.99 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 123.144 0.578 . . . . 0.0 112.176 -175.162 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -79.59 -19.61 48.91 Favored 'General case' 0 CA--C 1.536 0.408 0 N-CA-C 113.641 0.978 . . . . 0.0 113.641 -177.128 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 48.3 t -100.54 -55.46 2.59 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 124.212 1.005 . . . . 0.0 113.002 -174.706 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 50.7 m -76.17 -42.99 44.78 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 125.45 1.5 . . . . 0.0 110.217 -177.244 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 16.4 t -99.98 -150.92 0.39 Allowed 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 123.725 0.81 . . . . 0.0 109.266 158.468 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 34.9 pt -120.99 158.24 23.66 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.675 0 C-N-CA 125.402 1.481 . . . . 0.0 112.078 179.056 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -148.78 165.8 30.35 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-O 121.974 0.892 . . . . 0.0 113.035 166.411 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 16.6 t -109.81 166.97 10.5 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 123.986 0.914 . . . . 0.0 112.182 -175.717 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 49.1 mt -57.26 -31.85 66.0 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 124.575 1.15 . . . . 0.0 111.705 174.817 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 27.7 m-85 -59.66 -33.54 71.68 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.215 1.006 . . . . 0.0 113.576 171.334 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 20.7 mm100 -82.05 -32.64 30.31 Favored 'General case' 0 N--CA 1.468 0.428 0 C-N-CA 124.483 1.113 . . . . 0.0 111.069 177.472 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 73.4 mt -60.66 -43.13 97.98 Favored 'General case' 0 CA--C 1.542 0.636 0 CA-C-N 118.418 0.554 . . . . 0.0 110.603 167.78 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -65.33 -35.93 82.48 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 123.85 0.86 . . . . 0.0 112.309 174.058 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 21.6 t-20 -63.77 -29.34 70.56 Favored 'General case' 0 CA--C 1.548 0.884 0 O-C-N 120.801 -1.187 . . . . 0.0 113.065 176.964 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 4.9 m-85 -83.01 -0.84 50.74 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 125.074 1.35 . . . . 0.0 113.891 172.349 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 8.1 t -82.07 164.9 21.06 Favored 'General case' 0 CA--C 1.54 0.589 0 O-C-N 120.873 -1.142 . . . . 0.0 113.479 175.422 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 38.3 m-80 . . . . . 0 C--O 1.25 1.088 0 C-N-CA 124.81 1.244 . . . . 0.0 111.206 167.426 . . . . . . . . 0 0 . 1 . 037 nuclear nobuild full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 80.2 m-85 . . . . . 0 N--CA 1.487 1.419 0 CA-C-O 119.359 -0.353 . . . . 0.0 110.388 . . . . . . . . . 0 0 . 1 . 037 nuclear nobuild full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 12.9 m -147.19 144.28 19.8 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.205 0 C-N-CA 124.984 1.313 . . . . 0.0 111.994 -176.873 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 60.9 t-20 -100.76 131.7 46.52 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 126.178 1.791 . . . . 0.0 109.653 170.503 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 26.7 mm-40 -150.83 161.37 42.8 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 124.475 1.11 . . . . 0.0 113.207 -160.897 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 85.5 m-70 -80.47 123.79 28.36 Favored 'General case' 0 CA--C 1.542 0.636 0 N-CA-C 108.786 -0.82 . . . . 0.0 108.786 156.944 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 91.1 mt -138.67 127.46 23.6 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 126.133 1.773 . . . . 0.0 108.878 178.368 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 73.5 m -132.41 143.87 50.11 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 124.961 1.304 . . . . 0.0 111.066 -173.566 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 52.78 -123.77 24.85 Favored Glycine 0 N--CA 1.471 0.997 0 C-N-CA 124.907 1.242 . . . . 0.0 113.776 166.302 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 20.3 m -61.25 -33.01 72.81 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 123.958 0.903 . . . . 0.0 112.702 -179.063 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 99.5 m-70 -73.52 -35.46 65.58 Favored 'General case' 0 CA--C 1.54 0.568 0 O-C-N 121.196 -0.94 . . . . 0.0 111.81 176.65 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 56.5 tp -64.5 -46.97 80.7 Favored 'General case' 0 N--CA 1.466 0.326 0 C-N-CA 123.332 0.653 . . . . 0.0 110.706 170.509 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 76.5 t -60.77 -41.15 87.36 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 C-N-CA 123.296 0.638 . . . . 0.0 111.515 176.063 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 42.9 tt0 -63.34 -48.34 78.39 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 123.575 0.75 . . . . 0.0 111.434 177.253 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.12 -45.75 92.1 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 123.069 0.548 . . . . 0.0 111.887 177.923 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 37.2 tp -60.43 -43.68 96.53 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 125.056 1.343 . . . . 0.0 111.436 178.454 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 68.8 t80 -64.76 -34.05 77.42 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 124.079 0.952 . . . . 0.0 113.328 172.381 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 65.8 mt -74.13 -31.93 62.96 Favored 'General case' 0 N--CA 1.472 0.626 0 O-C-N 121.044 -1.035 . . . . 0.0 113.142 176.317 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 79.4 t -72.96 -44.03 58.12 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.039 0 CA-C-N 118.367 0.531 . . . . 0.0 111.135 172.6 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -148.27 11.05 0.9 Allowed 'General case' 0 N--CA 1.473 0.705 0 N-CA-C 117.065 2.246 . . . . 0.0 117.065 -161.744 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . -63.76 -23.83 67.62 Favored Glycine 0 N--CA 1.476 1.317 0 O-C-N 120.803 -1.186 . . . . 0.0 115.46 -171.86 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -73.96 -22.51 59.62 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-N 118.255 1.028 . . . . 0.0 113.755 173.436 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 29.4 mtp180 -94.09 -37.08 11.8 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 125.486 1.514 . . . . 0.0 111.835 172.99 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 94.13 142.15 11.98 Favored Glycine 0 CA--C 1.527 0.844 0 C-N-CA 126.051 1.786 . . . . 0.0 112.851 176.707 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 25.9 p90 -127.13 159.76 33.26 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 125.115 1.366 . . . . 0.0 114.221 -166.909 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 40.3 t80 -90.04 159.07 17.03 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 126.024 1.73 . . . . 0.0 110.555 164.523 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 64.9 t80 -161.7 126.54 3.44 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 125.221 1.408 . . . . 0.0 111.056 -171.174 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 14.4 t -170.01 148.1 3.01 Favored Pre-proline 0 N--CA 1.482 1.142 0 C-N-CA 125.109 1.363 . . . . 0.0 112.601 -176.879 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_endo -78.3 -26.42 6.22 Favored 'Trans proline' 0 C--N 1.35 0.632 0 C-N-CA 123.254 2.636 . . . . 0.0 112.852 163.881 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -119.48 125.79 49.73 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.415 1.086 . . . . 0.0 112.148 -163.777 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 10.3 m . . . . . 0 C--O 1.254 1.292 0 C-N-CA 125.581 1.553 . . . . 0.0 112.407 -173.865 . . . . . . . . 0 0 . 1 . 038 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.824 0 N-CA-C 110.939 -0.864 . . . . 0.0 110.939 . . . . . . . . . 0 0 . 1 . 038 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 36.7 pt -65.53 -20.36 27.29 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.272 0 N-CA-C 115.353 1.612 . . . . 0.0 115.353 -161.847 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 20.4 t -54.71 -36.7 37.33 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.262 0 C-N-CA 123.932 0.893 . . . . 0.0 110.746 169.494 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -71.6 -13.96 61.93 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 123.653 0.781 . . . . 0.0 112.796 -178.476 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 53.6 tp60 -85.63 -77.69 0.29 Allowed 'General case' 0 C--O 1.226 -0.176 0 N-CA-C 108.082 -1.081 . . . . 0.0 108.082 156.193 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 64.3 m -55.3 -27.1 44.55 Favored 'General case' 0 N--CA 1.472 0.66 0 N-CA-C 115.794 1.776 . . . . 0.0 115.794 -159.844 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 11.0 t -90.78 -23.34 20.67 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 123.929 0.891 . . . . 0.0 112.565 -176.84 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 32.3 m -107.11 -28.15 10.16 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 126.702 2.001 . . . . 0.0 112.224 -175.029 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 16.1 t -147.89 168.46 22.17 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 126.094 1.758 . . . . 0.0 110.36 172.222 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 34.6 pt -68.65 150.16 10.9 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.708 0 O-C-N 120.379 -1.451 . . . . 0.0 113.569 -170.582 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 14.8 p -147.31 163.06 37.61 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 124.783 1.233 . . . . 0.0 112.334 174.384 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 48.7 m -120.08 155.05 33.76 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 124.082 0.953 . . . . 0.0 113.089 -171.366 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 46.8 mt -60.99 -33.52 73.37 Favored 'General case' 0 N--CA 1.471 0.594 0 O-C-N 121.256 -0.903 . . . . 0.0 112.137 177.361 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 83.7 t80 -62.44 -27.0 68.81 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 124.09 0.956 . . . . 0.0 113.519 172.643 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 91.6 mt-30 -81.12 -40.61 23.78 Favored 'General case' 0 N--CA 1.467 0.396 0 C-N-CA 124.132 0.973 . . . . 0.0 110.395 172.517 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 41.8 mt -57.72 -33.32 68.3 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-N 118.921 0.782 . . . . 0.0 112.499 174.19 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 8.4 tm-20 -56.3 -34.7 66.74 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 125.086 1.354 . . . . 0.0 113.003 176.332 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 25.1 t30 -63.34 -34.27 77.33 Favored 'General case' 0 CA--C 1.543 0.711 0 O-C-N 121.203 -0.936 . . . . 0.0 112.256 175.443 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 74.5 m-85 -88.57 2.13 53.63 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 125.849 1.659 . . . . 0.0 113.762 -178.129 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 82.5 m -76.55 56.09 1.09 Allowed 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 126.146 1.778 . . . . 0.0 113.051 168.227 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 13.8 p30 . . . . . 0 C--O 1.253 1.253 0 C-N-CA 126.798 2.039 . . . . 0.0 113.037 -179.586 . . . . . . . . 0 0 . 1 . 038 nuclear nobuild full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 84.8 m-85 . . . . . 0 N--CA 1.489 1.49 0 CA-C-O 119.979 -0.058 . . . . 0.0 110.939 . . . . . . . . . 0 0 . 1 . 038 nuclear nobuild full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 73.8 t -78.39 135.85 25.2 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.884 0 C-N-CA 124.031 0.932 . . . . 0.0 109.547 175.982 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 24.8 t-20 -128.25 136.7 51.4 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 126.399 1.88 . . . . 0.0 110.74 179.302 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 48.5 mm-40 -156.32 167.41 30.53 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 124.771 1.228 . . . . 0.0 112.15 -167.554 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 16.8 m170 -84.78 138.43 32.6 Favored 'General case' 0 CA--C 1.542 0.636 0 N-CA-C 109.329 -0.619 . . . . 0.0 109.329 150.226 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 72.1 mt -146.41 136.44 23.5 Favored 'General case' 0 N--CA 1.465 0.314 0 C-N-CA 125.067 1.347 . . . . 0.0 109.455 -175.476 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 3.0 t -154.64 153.44 31.36 Favored 'General case' 0 N--CA 1.466 0.327 0 C-N-CA 123.502 0.721 . . . . 0.0 111.451 -176.117 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 47.76 -124.79 10.59 Favored Glycine 0 CA--C 1.529 0.928 0 C-N-CA 125.19 1.376 . . . . 0.0 113.772 176.82 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 24.3 p -60.35 -33.93 73.13 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 125.028 1.331 . . . . 0.0 113.197 179.301 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 98.2 m-70 -70.12 -39.27 75.56 Favored 'General case' 0 CA--C 1.542 0.646 0 O-C-N 121.204 -0.935 . . . . 0.0 111.583 177.025 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 63.5 tp -65.96 -45.14 82.83 Favored 'General case' 0 N--CA 1.471 0.604 0 O-C-N 121.616 -0.678 . . . . 0.0 110.869 172.735 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 24.7 t -59.59 -39.68 80.1 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.936 0 C-N-CA 124.187 0.995 . . . . 0.0 111.806 176.238 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -67.84 -46.61 71.31 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 123.879 0.872 . . . . 0.0 111.601 175.074 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.87 -46.2 90.04 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.158 0.583 . . . . 0.0 111.602 178.2 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 30.6 mt -54.74 -59.2 5.04 Favored 'General case' 0 N--CA 1.466 0.357 0 C-N-CA 124.099 0.96 . . . . 0.0 110.255 171.472 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 69.6 t80 -51.85 -38.71 57.01 Favored 'General case' 0 CA--C 1.543 0.707 0 CA-C-N 119.443 1.02 . . . . 0.0 113.234 -179.495 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 86.7 mt -72.71 -32.2 65.57 Favored 'General case' 0 N--CA 1.471 0.593 0 N-CA-C 113.914 1.079 . . . . 0.0 113.914 177.732 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 68.0 t -78.07 -38.06 23.61 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.01 0 C-N-CA 123.922 0.889 . . . . 0.0 111.316 174.384 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 44.1 m -89.48 -33.43 16.79 Favored 'General case' 0 N--CA 1.466 0.348 0 N-CA-C 114.28 1.215 . . . . 0.0 114.28 -170.633 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 60.79 -131.93 49.15 Favored Glycine 0 CA--C 1.533 1.192 0 N-CA-C 111.391 -0.684 . . . . 0.0 111.391 -172.18 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -72.46 -7.75 51.48 Favored 'General case' 0 CA--C 1.546 0.826 0 N-CA-C 114.364 1.246 . . . . 0.0 114.364 -179.311 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 68.8 mtp180 -62.95 -26.85 69.02 Favored 'General case' 0 N--CA 1.476 0.875 0 CA-C-N 119.336 0.971 . . . . 0.0 113.414 177.938 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 75.38 173.62 33.67 Favored Glycine 0 CA--C 1.531 1.075 0 C-N-CA 124.419 1.009 . . . . 0.0 112.192 -168.629 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 35.6 p90 -150.12 157.73 43.42 Favored 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 114.789 1.403 . . . . 0.0 114.789 -171.619 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 89.5 t80 -111.92 107.66 16.75 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 126.321 1.848 . . . . 0.0 109.617 171.306 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 27.9 p90 -106.37 -12.88 15.53 Favored 'General case' 0 CA--C 1.542 0.659 0 N-CA-C 115.709 1.744 . . . . 0.0 115.709 -171.219 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 41.2 p -69.59 154.3 94.93 Favored Pre-proline 0 N--CA 1.479 1.013 0 N-CA-C 114.439 1.274 . . . . 0.0 114.439 -152.838 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -76.94 -34.17 2.42 Favored 'Trans proline' 0 C--N 1.35 0.631 0 C-N-CA 123.214 2.609 . . . . 0.0 113.006 177.959 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 6.1 tttp -172.05 167.46 6.06 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 125.189 1.396 . . . . 0.0 112.714 -174.452 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 18.8 m . . . . . 0 C--O 1.251 1.164 0 C-N-CA 125.947 1.699 . . . . 0.0 112.604 179.493 . . . . . . . . 0 0 . 1 . 039 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.736 0 N-CA-C 111.218 -0.753 . . . . 0.0 111.218 . . . . . . . . . 0 0 . 1 . 039 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 10.2 tp -64.01 -33.77 64.32 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.0 0 N-CA-C 114.472 1.286 . . . . 0.0 114.472 -167.739 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 38.2 t -66.98 -37.01 78.54 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.113 0 CA-C-N 119.71 1.141 . . . . 0.0 111.535 176.878 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -71.45 -47.39 56.05 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-N 119.169 0.895 . . . . 0.0 110.491 173.906 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 65.3 tp60 -56.84 -46.24 81.84 Favored 'General case' 0 N--CA 1.467 0.393 0 C-N-CA 123.698 0.799 . . . . 0.0 111.963 179.347 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -82.85 -17.11 45.05 Favored 'General case' 0 N--CA 1.469 0.487 0 N-CA-C 114.477 1.288 . . . . 0.0 114.477 -175.056 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 29.3 t -102.89 -43.92 5.4 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 123.986 0.915 . . . . 0.0 112.807 -175.983 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 61.7 m -85.63 -37.17 19.79 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 125.476 1.511 . . . . 0.0 111.118 178.89 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 18.1 t -110.69 -149.55 0.45 Allowed 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 124.15 0.98 . . . . 0.0 109.366 160.944 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 11.9 tt -116.86 157.45 17.81 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.932 0 C-N-CA 126.099 1.759 . . . . 0.0 111.258 177.828 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 1.6 p -143.72 -171.75 3.59 Favored 'General case' 0 N--CA 1.476 0.865 0 O-C-N 121.237 -0.914 . . . . 0.0 111.719 167.663 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 59.5 p -131.72 168.93 16.93 Favored 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 124.478 1.111 . . . . 0.0 112.573 177.534 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 32.9 mt -61.41 -31.65 71.58 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 123.374 0.669 . . . . 0.0 112.103 174.164 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 87.0 t80 -65.1 -33.01 75.01 Favored 'General case' 0 CA--C 1.54 0.569 0 N-CA-C 112.946 0.721 . . . . 0.0 112.946 171.827 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 19.7 mm100 -75.83 -28.02 58.1 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-O 118.699 -0.667 . . . . 0.0 112.274 172.571 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 53.3 mt -68.9 -40.26 79.28 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-N 119.412 1.005 . . . . 0.0 111.639 168.579 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -58.49 -24.72 61.16 Favored 'General case' 0 CA--C 1.547 0.84 0 N-CA-C 113.428 0.899 . . . . 0.0 113.428 -177.414 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 25.0 t30 -54.83 -26.0 32.2 Favored 'General case' 0 CA--C 1.551 0.989 0 C-N-CA 124.567 1.147 . . . . 0.0 113.844 171.727 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 98.6 m-85 -101.83 4.31 40.2 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 126.051 1.74 . . . . 0.0 114.021 -175.468 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 61.2 m -63.56 150.89 42.95 Favored 'General case' 0 CA--C 1.543 0.674 0 O-C-N 121.352 -0.843 . . . . 0.0 111.59 166.384 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 22.5 t-20 . . . . . 0 C--O 1.253 1.267 0 C-N-CA 124.544 1.138 . . . . 0.0 113.008 -177.602 . . . . . . . . 0 0 . 1 . 039 nuclear nobuild full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 53.3 t80 . . . . . 0 N--CA 1.484 1.263 0 CA-C-O 119.591 -0.242 . . . . 0.0 110.676 . . . . . . . . . 0 0 . 1 . 039 nuclear nobuild full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 13.8 m -79.56 63.0 0.24 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.14 0 C-N-CA 125.8 1.64 . . . . 0.0 112.657 -176.108 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 11.5 m120 -93.54 138.23 32.03 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 126.156 1.782 . . . . 0.0 111.229 174.344 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 38.2 mt-30 -152.43 154.11 34.91 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 124.948 1.299 . . . . 0.0 110.332 -173.066 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 95.1 m-70 -87.89 123.37 32.57 Favored 'General case' 0 CA--C 1.54 0.57 0 N-CA-C 108.372 -0.973 . . . . 0.0 108.372 162.572 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 72.1 mt -140.75 142.57 34.75 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 125.541 1.536 . . . . 0.0 108.397 -171.621 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -149.15 150.91 33.45 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 123.486 0.715 . . . . 0.0 112.25 -173.609 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 43.95 -125.06 5.41 Favored Glycine 0 N--CA 1.473 1.129 0 C-N-CA 125.754 1.645 . . . . 0.0 114.316 172.427 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 20.1 m -62.13 -31.13 71.56 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 124.653 1.181 . . . . 0.0 112.803 -178.06 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 97.7 m-70 -72.38 -37.1 68.83 Favored 'General case' 0 CA--C 1.539 0.546 0 O-C-N 121.037 -1.039 . . . . 0.0 111.463 177.308 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 8.8 tt -66.27 -44.72 82.83 Favored 'General case' 0 C--N 1.344 0.346 0 O-C-N 121.719 -0.613 . . . . 0.0 110.974 169.941 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 53.9 t -61.75 -36.72 75.33 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.986 0 C-N-CA 123.212 0.605 . . . . 0.0 111.782 177.836 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -65.8 -48.47 71.62 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 123.905 0.882 . . . . 0.0 111.739 172.107 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.8 -44.07 94.15 Favored 'General case' 0 CA--C 1.543 0.678 0 O-C-N 121.633 -0.667 . . . . 0.0 111.704 176.77 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 52.3 tp -58.28 -50.94 71.83 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 125.885 1.674 . . . . 0.0 111.005 176.122 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 52.8 t80 -54.76 -42.21 71.4 Favored 'General case' 0 CA--C 1.541 0.634 0 N-CA-C 113.009 0.744 . . . . 0.0 113.009 173.434 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 89.5 mt -74.04 -33.36 63.7 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 123.925 0.89 . . . . 0.0 113.348 179.957 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 24.4 t -65.11 -47.18 88.74 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.819 0 C-N-CA 124.864 1.266 . . . . 0.0 110.361 171.457 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 84.7 m -75.74 -36.27 59.95 Favored 'General case' 0 N--CA 1.469 0.482 0 N-CA-C 112.753 0.649 . . . . 0.0 112.753 -176.436 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 62.81 -134.35 43.92 Favored Glycine 0 CA--C 1.529 0.927 0 C-N-CA 124.384 0.992 . . . . 0.0 111.412 -178.195 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -61.13 -18.4 57.86 Favored 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 114.681 1.363 . . . . 0.0 114.681 178.714 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 86.0 mtm180 -65.2 -30.45 71.35 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 124.117 0.967 . . . . 0.0 113.212 179.815 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 77.73 177.82 47.56 Favored Glycine 0 CA--C 1.533 1.212 0 C-N-CA 124.507 1.051 . . . . 0.0 112.888 -173.221 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 33.3 p90 -158.55 168.26 27.39 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 124.641 1.176 . . . . 0.0 112.64 -172.134 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 92.0 t80 -156.69 132.36 9.47 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 124.389 1.076 . . . . 0.0 111.83 164.085 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 84.4 t80 -161.53 147.84 14.15 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 126.378 1.871 . . . . 0.0 111.325 165.804 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 13.4 p -134.33 132.83 21.2 Favored Pre-proline 0 N--CA 1.474 0.739 0 C-N-CA 126.32 1.848 . . . . 0.0 109.778 173.692 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -72.63 121.34 7.32 Favored 'Trans proline' 0 C--N 1.352 0.725 0 C-N-CA 123.35 2.7 . . . . 0.0 111.565 -171.424 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 2.8 tppp? 70.6 -32.49 0.24 Allowed 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 128.23 2.612 . . . . 0.0 115.432 170.462 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 28.8 p . . . . . 0 C--O 1.254 1.303 0 C-N-CA 126.475 1.91 . . . . 0.0 113.931 -176.875 . . . . . . . . 0 0 . 1 . 040 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.612 0 N-CA-C 111.946 -0.462 . . . . 0.0 111.946 . . . . . . . . . 0 0 . 1 . 040 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 17.8 tt -98.24 -28.31 3.62 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.239 0 C-N-CA 124.298 1.039 . . . . 0.0 113.752 178.692 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 83.7 t -64.61 -34.67 71.31 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.211 0 CA-C-N 119.758 1.163 . . . . 0.0 110.412 -176.368 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 14.9 pt-20 -61.98 -36.29 81.04 Favored 'General case' 0 CA--C 1.543 0.695 0 CA-C-N 118.722 0.692 . . . . 0.0 112.296 172.566 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 28.5 tt0 -74.0 -43.92 56.37 Favored 'General case' 0 C--O 1.225 -0.223 0 C-N-CA 123.534 0.734 . . . . 0.0 110.365 -179.704 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 92.6 m -72.27 -36.3 68.97 Favored 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 113.746 1.017 . . . . 0.0 113.746 179.098 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 15.8 t -93.46 -45.61 7.69 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 123.601 0.76 . . . . 0.0 112.826 -168.447 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 25.1 m -91.47 -38.33 12.62 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 124.747 1.219 . . . . 0.0 111.488 -177.298 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.7 t -105.09 -152.32 0.46 Allowed 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 124.493 1.117 . . . . 0.0 111.393 171.221 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 24.1 mt -109.87 140.38 29.04 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.791 0 C-N-CA 126.002 1.721 . . . . 0.0 110.092 168.817 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 9.7 p -124.39 -172.9 2.65 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.74 1.216 . . . . 0.0 111.129 167.366 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 8.4 t -148.8 166.66 27.8 Favored 'General case' 0 N--CA 1.469 0.503 0 O-C-N 120.655 -1.278 . . . . 0.0 111.898 179.264 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 34.0 mt -59.86 -33.49 71.88 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 124.628 1.171 . . . . 0.0 112.143 -178.234 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 86.6 t80 -61.42 -29.91 70.23 Favored 'General case' 0 CA--C 1.546 0.792 0 N-CA-C 113.565 0.95 . . . . 0.0 113.565 171.908 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 54.0 mm-40 -80.16 -36.47 35.08 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 123.343 0.657 . . . . 0.0 110.522 174.503 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 32.5 mt -62.27 -37.86 87.09 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-N 118.523 0.601 . . . . 0.0 111.52 172.193 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -61.31 -32.1 71.96 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 124.878 1.271 . . . . 0.0 112.903 179.004 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 24.1 t30 -62.5 -24.24 67.37 Favored 'General case' 0 CA--C 1.548 0.901 0 O-C-N 121.405 -0.809 . . . . 0.0 112.794 176.424 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 38.8 m-85 -95.51 1.59 54.01 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 125.584 1.553 . . . . 0.0 114.475 179.785 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 70.2 m -69.27 153.99 42.75 Favored 'General case' 0 CA--C 1.544 0.74 0 O-C-N 121.002 -1.061 . . . . 0.0 113.234 173.294 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.253 1.241 0 C-N-CA 126.166 1.786 . . . . 0.0 111.302 178.626 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 17.2 p90 . . . . . 0 N--CA 1.486 1.332 0 N-CA-C 111.311 0.115 . . . . 0.0 111.311 . . . . . . . . . 0 0 . 1 . 040 nuclear nobuild full ' B' B ' 2' ' ' VAL . . . . . 0.42 HG22 ' H ' ' B' ' 3' ' ' ASN . 14.4 p -166.27 -177.65 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.483 1.195 0 C-N-CA 127.108 2.163 . . . . 0.0 109.092 -174.958 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' B' B ' 3' ' ' ASN . . . . . 0.42 ' H ' HG22 ' B' ' 2' ' ' VAL . 10.0 p30 -61.04 127.78 33.2 Favored 'General case' 0 CA--C 1.543 0.681 0 O-C-N 120.542 -1.349 . . . . 0.0 110.498 167.441 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 30.5 mt-30 -148.3 165.82 29.87 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 124.043 0.937 . . . . 0.0 112.374 -158.888 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 93.8 m-70 -82.37 134.36 35.25 Favored 'General case' 0 CA--C 1.545 0.752 0 N-CA-C 108.968 -0.753 . . . . 0.0 108.968 157.592 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 76.4 mt -147.54 133.92 19.63 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 125.735 1.614 . . . . 0.0 108.619 -177.649 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 3.7 t -158.42 153.17 24.84 Favored 'General case' 0 N--CA 1.469 0.492 0 O-C-N 121.428 -0.795 . . . . 0.0 112.225 -177.38 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 61.01 -134.4 49.11 Favored Glycine 0 CA--C 1.53 0.992 0 C-N-CA 124.719 1.152 . . . . 0.0 113.139 179.171 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 20.3 m -60.9 -30.92 70.46 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 124.467 1.107 . . . . 0.0 112.029 -178.43 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 13.5 m80 -66.52 -41.82 88.19 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 124.543 1.137 . . . . 0.0 111.541 178.046 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 48.8 tp -69.46 -42.7 74.54 Favored 'General case' 0 N--CA 1.466 0.336 0 C-N-CA 124.284 1.033 . . . . 0.0 111.359 174.585 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 48.1 t -60.32 -41.07 85.82 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.038 0 C-N-CA 123.635 0.774 . . . . 0.0 111.349 175.458 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -66.61 -45.17 80.01 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 124.065 0.946 . . . . 0.0 111.829 174.399 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.99 -45.68 91.92 Favored 'General case' 0 CA--C 1.54 0.582 0 O-C-N 121.656 -0.652 . . . . 0.0 112.129 178.096 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 17.6 mt -54.74 -54.19 45.22 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 124.493 1.117 . . . . 0.0 110.974 172.795 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 77.8 t80 -55.45 -41.66 73.19 Favored 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 113.196 0.813 . . . . 0.0 113.196 177.177 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 85.4 mt -73.22 -35.76 66.35 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 123.9 0.88 . . . . 0.0 113.127 179.839 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 43.6 t -67.89 -42.47 85.76 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.845 0 C-N-CA 123.525 0.73 . . . . 0.0 110.903 173.842 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 82.7 m -80.75 -27.28 36.85 Favored 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 113.483 0.92 . . . . 0.0 113.483 -175.658 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 65.65 -111.96 4.59 Favored Glycine 0 CA--C 1.53 0.996 0 C-N-CA 124.298 0.951 . . . . 0.0 111.908 173.565 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -75.47 -18.91 59.72 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 124.395 1.078 . . . . 0.0 113.074 176.131 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 95.6 mtt-85 -76.9 158.16 30.9 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 124.059 0.943 . . . . 0.0 111.678 173.16 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . -74.46 179.37 43.43 Favored Glycine 0 CA--C 1.531 1.058 0 C-N-CA 123.839 0.733 . . . . 0.0 111.668 168.768 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 42.1 p90 -153.73 169.54 23.07 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.542 1.137 . . . . 0.0 112.473 -178.247 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 63.6 t80 -153.85 149.49 27.41 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 124.828 1.251 . . . . 0.0 111.983 179.406 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 42.5 p90 -134.96 149.02 50.16 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 126.762 2.025 . . . . 0.0 111.288 175.854 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 7.3 t -159.0 138.25 8.27 Favored Pre-proline 0 N--CA 1.476 0.862 0 C-N-CA 124.785 1.234 . . . . 0.0 111.745 -178.033 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 16.9 Cg_endo -90.24 -160.23 0.09 OUTLIER 'Trans proline' 0 CA--C 1.541 0.866 0 C-N-CA 125.212 3.941 . . . . 0.0 112.067 -179.137 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 22.6 ptmt -78.69 -20.85 49.18 Favored 'General case' 0 CA--C 1.547 0.861 0 N-CA-C 114.77 1.396 . . . . 0.0 114.77 177.346 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 21.6 p . . . . . 0 N--CA 1.483 1.198 0 C-N-CA 125.684 1.593 . . . . 0.0 113.745 -175.304 . . . . . . . . 0 0 . 1 . 041 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.858 0 N-CA-C 111.987 -0.445 . . . . 0.0 111.987 . . . . . . . . . 0 0 . 1 . 041 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 38.8 pt -104.0 -22.19 4.93 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.378 0 C-N-CA 127.776 2.43 . . . . 0.0 113.827 -4.805 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 85.5 t -56.84 -48.12 81.79 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.048 0 CA-C-N 119.014 0.824 . . . . 0.0 112.048 -173.124 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -59.75 -35.45 74.61 Favored 'General case' 0 N--CA 1.474 0.755 0 CA-C-N 118.958 0.799 . . . . 0.0 112.573 -178.546 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 28.7 tp60 -71.44 -32.8 68.76 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-O 118.663 -0.684 . . . . 0.0 112.02 -178.536 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -95.23 -22.0 18.1 Favored 'General case' 0 CA--C 1.539 0.557 0 N-CA-C 114.161 1.171 . . . . 0.0 114.161 177.172 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 51.1 t -100.52 -56.08 2.43 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 124.764 1.226 . . . . 0.0 112.983 -172.976 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 26.8 m -81.06 -47.35 13.68 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 124.635 1.174 . . . . 0.0 109.894 -178.245 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 13.7 t -84.83 -158.35 0.35 Allowed 'General case' 0 CA--C 1.552 1.035 0 C-N-CA 123.045 0.538 . . . . 0.0 110.283 155.791 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 29.8 pt -128.82 150.4 34.44 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.552 0 C-N-CA 125.181 1.392 . . . . 0.0 111.974 178.842 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -145.12 166.56 25.04 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 123.962 0.905 . . . . 0.0 112.099 170.546 . . . . . . . . 2 2 . 1 . 041 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 3.4 t -118.52 167.11 11.92 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 124.064 0.946 . . . . 0.0 112.703 -173.943 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 47.7 mt -58.02 -35.65 71.58 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 124.713 1.205 . . . . 0.0 111.946 179.959 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 75.2 m-85 -62.06 -30.78 71.22 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 124.463 1.105 . . . . 0.0 113.543 173.287 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 17.6 mm100 -82.96 -33.68 26.63 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 124.328 1.051 . . . . 0.0 110.951 174.57 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 48.4 mt -62.51 -36.33 82.22 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 119.238 0.927 . . . . 0.0 111.418 170.988 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 25.5 tt0 -63.17 -27.75 69.58 Favored 'General case' 0 CA--C 1.544 0.726 0 N-CA-C 113.331 0.863 . . . . 0.0 113.331 178.894 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 30.8 t30 -59.59 -25.65 64.78 Favored 'General case' 0 CA--C 1.547 0.856 0 O-C-N 121.264 -0.897 . . . . 0.0 113.181 174.423 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 59.3 m-85 -94.55 -0.31 54.66 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 125.282 1.433 . . . . 0.0 114.117 -178.728 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 81.2 m -67.18 154.04 42.21 Favored 'General case' 0 CA--C 1.544 0.747 0 CA-C-N 119.076 0.853 . . . . 0.0 113.183 175.338 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.252 1.214 0 C-N-CA 126.619 1.967 . . . . 0.0 110.977 179.804 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 67.7 m-85 . . . . . 0 N--CA 1.488 1.426 0 N-CA-C 111.221 0.082 . . . . 0.0 111.221 . . . . . . . . . 0 0 . 1 . 041 nuclear nobuild full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 9.3 m -141.7 151.39 19.11 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.091 0 C-N-CA 125.4 1.48 . . . . 0.0 110.916 177.424 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 40.8 m-80 77.25 135.59 0.06 Allowed 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 129.269 3.028 . . . . 0.0 113.638 -178.427 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 53.8 mm-40 -140.55 166.55 24.43 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 125.804 1.642 . . . . 0.0 110.442 -179.096 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 92.2 m-70 -84.96 116.7 23.52 Favored 'General case' 0 CA--C 1.541 0.628 0 N-CA-C 108.655 -0.869 . . . . 0.0 108.655 164.219 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 91.8 mt -132.35 126.33 33.0 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 125.743 1.617 . . . . 0.0 108.507 179.169 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 77.7 m -132.2 144.21 50.49 Favored 'General case' 0 N--CA 1.465 0.29 0 C-N-CA 124.839 1.255 . . . . 0.0 111.76 -168.01 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 53.04 -124.7 28.71 Favored Glycine 0 CA--C 1.531 1.081 0 C-N-CA 125.307 1.432 . . . . 0.0 114.271 164.647 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 22.2 p -56.85 -41.39 77.84 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 124.726 1.21 . . . . 0.0 112.238 176.968 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 19.3 m-70 -69.57 -29.89 67.54 Favored 'General case' 0 CA--C 1.541 0.628 0 O-C-N 120.613 -1.305 . . . . 0.0 112.712 177.946 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 48.0 tp -69.06 -43.06 75.4 Favored 'General case' 0 N--CA 1.47 0.564 0 O-C-N 121.544 -0.723 . . . . 0.0 111.275 169.559 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 52.1 t -60.57 -41.33 87.5 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.99 0 C-N-CA 123.927 0.891 . . . . 0.0 111.67 173.535 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -63.7 -46.5 85.17 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 124.372 1.069 . . . . 0.0 111.527 173.58 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.12 -45.06 96.22 Favored 'General case' 0 CA--C 1.544 0.734 0 CA-C-N 118.761 0.71 . . . . 0.0 111.923 178.872 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 22.2 mt -55.33 -54.36 44.54 Favored 'General case' 0 N--CA 1.467 0.416 0 C-N-CA 124.186 0.995 . . . . 0.0 111.056 173.018 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 71.1 t80 -55.61 -42.28 74.66 Favored 'General case' 0 N--CA 1.47 0.544 0 N-CA-C 113.007 0.743 . . . . 0.0 113.007 177.48 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 84.9 mt -74.88 -33.38 62.06 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 124.127 0.971 . . . . 0.0 113.341 -178.6 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 37.7 t -69.26 -44.02 80.86 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.849 0 C-N-CA 123.974 0.909 . . . . 0.0 110.684 172.498 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 72.9 m -76.79 -33.51 58.03 Favored 'General case' 0 CA--C 1.538 0.508 0 N-CA-C 113.074 0.768 . . . . 0.0 113.074 -175.936 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 68.89 -111.68 4.1 Favored Glycine 0 CA--C 1.529 0.91 0 C-N-CA 124.662 1.125 . . . . 0.0 112.044 172.166 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -69.12 -27.14 65.3 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 124.171 0.988 . . . . 0.0 112.131 173.975 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 82.8 mtm180 -72.91 153.99 40.76 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 124.803 1.241 . . . . 0.0 110.758 175.988 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . -76.22 -174.83 38.54 Favored Glycine 0 N--CA 1.474 1.175 0 C-N-CA 123.915 0.769 . . . . 0.0 111.581 168.423 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 52.5 p90 -152.46 148.09 27.01 Favored 'General case' 0 CA--C 1.536 0.442 0 N-CA-C 113.287 0.847 . . . . 0.0 113.287 179.234 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 90.7 t80 -89.89 146.32 24.5 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 125.787 1.635 . . . . 0.0 110.671 169.664 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 85.2 t80 -158.94 140.68 13.48 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 125.59 1.556 . . . . 0.0 111.527 179.69 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 11.8 t -167.78 139.33 2.45 Favored Pre-proline 0 N--CA 1.477 0.889 0 C-N-CA 125.375 1.47 . . . . 0.0 111.646 176.131 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 69.6 Cg_endo -80.67 172.44 13.34 Favored 'Trans proline' 0 C--N 1.352 0.716 0 C-N-CA 123.879 3.053 . . . . 0.0 111.531 172.411 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 22.4 ptmt -61.61 150.0 37.6 Favored 'General case' 0 CA--C 1.549 0.936 0 N-CA-C 113.146 0.795 . . . . 0.0 113.146 173.7 . . . . . . . . 1 1 . 1 . 041 nuclear nobuild full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 12.8 t . . . . . 0 C--O 1.253 1.278 0 C-N-CA 126.652 1.981 . . . . 0.0 111.783 -175.79 . . . . . . . . 0 0 . 1 . 042 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.503 0 N-CA-C 111.184 -0.766 . . . . 0.0 111.184 . . . . . . . . . 0 0 . 1 . 042 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 46.2 pt -76.9 -23.26 14.96 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.916 0 N-CA-C 114.68 1.363 . . . . 0.0 114.68 -167.208 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 53.0 t -59.32 -37.85 71.49 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.121 0 CA-C-N 119.816 1.189 . . . . 0.0 111.6 178.699 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 44.2 mm-40 -79.14 -56.73 4.15 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-O 118.969 -0.539 . . . . 0.0 110.518 168.609 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 23.8 tt0 -61.58 -40.91 96.44 Favored 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 113.865 1.061 . . . . 0.0 113.865 -166.692 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 25.7 m -69.49 -21.69 63.67 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 119.204 0.911 . . . . 0.0 112.766 175.948 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 13.2 t -88.12 -41.52 12.98 Favored 'General case' 0 CA--C 1.538 0.513 0 O-C-N 121.393 -0.817 . . . . 0.0 111.617 179.814 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 72.7 p -82.29 -18.17 43.27 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 125.243 1.417 . . . . 0.0 114.034 179.668 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 71.3 p -148.36 172.42 14.44 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 124.919 1.288 . . . . 0.0 111.905 -179.485 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 64.9 mt -73.9 129.03 36.59 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.679 0 O-C-N 121.238 -0.914 . . . . 0.0 109.774 174.549 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 17.3 p -123.49 159.77 28.36 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 124.866 1.267 . . . . 0.0 111.727 169.629 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 18.8 m -108.97 153.52 23.46 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 124.3 1.04 . . . . 0.0 111.276 -171.667 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 36.6 mt -60.69 -31.15 70.41 Favored 'General case' 0 N--CA 1.472 0.629 0 O-C-N 120.907 -1.121 . . . . 0.0 112.357 179.678 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 86.9 m-85 -64.59 -25.89 68.17 Favored 'General case' 0 CA--C 1.543 0.711 0 N-CA-C 114.096 1.147 . . . . 0.0 114.096 171.684 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 57.5 mm-40 -88.41 -25.93 22.42 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 124.752 1.221 . . . . 0.0 111.38 175.136 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 9.2 mp -62.42 -49.27 76.15 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 119.467 1.03 . . . . 0.0 110.588 162.993 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 37.5 tt0 -59.55 -28.45 67.12 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 124.679 1.191 . . . . 0.0 113.411 -179.874 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 26.2 t30 -54.33 -30.99 53.22 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 124.582 1.153 . . . . 0.0 113.889 179.321 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 99.4 m-85 -95.95 0.44 51.85 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 124.989 1.316 . . . . 0.0 113.865 -177.88 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 83.0 m -86.36 162.09 18.36 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 124.594 1.158 . . . . 0.0 113.655 174.959 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.251 1.155 0 C-N-CA 126.2 1.8 . . . . 0.0 112.308 -179.055 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 86.6 t80 . . . . . 0 N--CA 1.487 1.382 0 CA-C-O 119.465 -0.302 . . . . 0.0 110.667 . . . . . . . . . 0 0 . 1 . 042 nuclear nobuild full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 75.7 t -144.47 136.92 22.38 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.024 0 C-N-CA 125.626 1.57 . . . . 0.0 109.461 -179.367 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 51.7 p-10 -148.65 143.31 26.43 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 125.79 1.636 . . . . 0.0 111.328 171.434 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 42.5 mt-30 -152.3 164.93 36.44 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 124.46 1.104 . . . . 0.0 111.937 -162.946 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 21.9 m-70 -84.79 135.25 34.19 Favored 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 108.758 -0.831 . . . . 0.0 108.758 153.607 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 81.5 mt -145.09 125.16 13.61 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 126.302 1.841 . . . . 0.0 109.465 -177.671 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 58.1 m -124.74 138.1 54.3 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 125.097 1.359 . . . . 0.0 110.489 -178.141 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 51.05 -117.25 5.27 Favored Glycine 0 N--CA 1.474 1.173 0 C-N-CA 125.091 1.329 . . . . 0.0 113.947 167.352 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 19.9 m -59.84 -32.94 71.14 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 124.495 1.118 . . . . 0.0 112.786 -178.066 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 96.2 m-70 -71.25 -38.66 71.9 Favored 'General case' 0 CA--C 1.539 0.535 0 O-C-N 121.253 -0.904 . . . . 0.0 111.42 176.418 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 56.5 tp -66.68 -42.95 85.7 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 123.508 0.723 . . . . 0.0 111.241 172.913 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 42.5 t -60.61 -43.26 94.32 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.916 0 C-N-CA 124.018 0.927 . . . . 0.0 111.699 175.061 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -64.28 -45.39 88.23 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 123.74 0.816 . . . . 0.0 111.425 175.5 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.46 -46.18 91.15 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 123.068 0.547 . . . . 0.0 112.034 177.309 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 28.7 mt -56.66 -48.38 77.7 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 124.091 0.956 . . . . 0.0 111.444 175.559 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 61.9 t80 -56.84 -41.13 77.33 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 123.773 0.829 . . . . 0.0 113.095 174.774 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 90.8 mt -78.02 -35.03 50.32 Favored 'General case' 0 N--CA 1.47 0.554 0 N-CA-C 113.426 0.898 . . . . 0.0 113.426 -179.455 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 40.8 t -67.23 -44.89 87.31 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 C-N-CA 124.645 1.178 . . . . 0.0 110.415 175.94 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 74.3 m -95.34 -25.84 16.14 Favored 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 113.628 0.973 . . . . 0.0 113.628 -170.758 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 63.08 -109.37 2.67 Favored Glycine 0 CA--C 1.531 1.052 0 C-N-CA 124.361 0.982 . . . . 0.0 112.72 168.509 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 39.1 mm-40 -69.8 -24.93 63.56 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 124.418 1.087 . . . . 0.0 112.86 175.818 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 96.0 mtt-85 -77.48 141.31 39.75 Favored 'General case' 0 N--CA 1.467 0.382 0 C-N-CA 124.046 0.938 . . . . 0.0 110.617 172.768 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . -74.0 152.48 45.58 Favored Glycine 0 N--CA 1.469 0.843 0 C-N-CA 124.652 1.12 . . . . 0.0 111.6 175.192 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 45.3 p90 -131.02 166.2 21.53 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 124.867 1.267 . . . . 0.0 112.508 -173.967 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 50.3 t80 -151.55 142.03 22.56 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 124.215 1.006 . . . . 0.0 111.557 170.441 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 8.5 p90 -104.31 98.12 7.97 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 126.869 2.068 . . . . 0.0 109.966 179.443 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 30.6 p -68.47 137.8 91.13 Favored Pre-proline 0 N--CA 1.478 0.932 0 CA-C-O 118.23 -0.89 . . . . 0.0 111.166 -176.976 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_endo -78.62 -152.76 0.04 OUTLIER 'Trans proline' 0 CA--C 1.544 0.979 0 C-N-CA 124.749 3.632 . . . . 0.0 111.878 -169.422 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -56.04 -38.56 70.73 Favored 'General case' 0 CA--C 1.547 0.843 0 O-C-N 120.548 -1.345 . . . . 0.0 112.036 173.586 . . . . . . . . 1 1 . 1 . 042 nuclear nobuild full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 23.7 m . . . . . 0 C--O 1.251 1.142 0 C-N-CA 125.738 1.615 . . . . 0.0 111.357 171.09 . . . . . . . . 0 0 . 1 . 043 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.497 0 N-CA-C 110.854 -0.899 . . . . 0.0 110.854 . . . . . . . . . 0 0 . 1 . 043 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 20.7 pt -59.5 -31.59 47.04 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.277 0 N-CA-C 115.584 1.698 . . . . 0.0 115.584 -163.866 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 93.4 t -67.77 -28.68 42.48 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.217 0 CA-C-N 119.408 1.004 . . . . 0.0 111.996 -179.242 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 33.4 mm-40 -89.38 -54.74 3.95 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 123.149 0.579 . . . . 0.0 110.093 169.034 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 64.4 tt0 -62.75 -44.19 96.83 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 124.77 1.228 . . . . 0.0 112.865 -168.511 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 2.7 t -81.16 -12.43 59.21 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-N 118.847 0.749 . . . . 0.0 112.777 -179.658 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 13.6 t -89.12 -40.04 13.2 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 124.227 1.011 . . . . 0.0 111.684 178.034 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 2.4 t -89.98 -36.15 15.13 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 124.813 1.245 . . . . 0.0 112.804 178.001 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 14.3 t -120.56 -149.95 0.44 Allowed 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 126.034 1.733 . . . . 0.0 109.42 172.349 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 47.7 pt -113.09 159.84 12.89 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.704 0 C-N-CA 125.099 1.36 . . . . 0.0 112.338 179.924 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 17.0 p -142.03 163.02 34.02 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 124.758 1.223 . . . . 0.0 112.166 167.194 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 13.8 m -104.93 152.48 22.61 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 125.056 1.342 . . . . 0.0 111.363 -176.052 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 33.9 mt -60.21 -34.4 73.59 Favored 'General case' 0 N--CA 1.47 0.526 0 O-C-N 120.999 -1.063 . . . . 0.0 111.549 176.42 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 85.4 t80 -60.06 -32.55 71.04 Favored 'General case' 0 CA--C 1.547 0.834 0 N-CA-C 113.213 0.82 . . . . 0.0 113.213 172.658 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 84.4 mt-30 -77.17 -36.75 54.85 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 123.773 0.829 . . . . 0.0 110.767 175.762 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 57.3 mt -60.93 -40.74 94.39 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-N 118.538 0.608 . . . . 0.0 111.729 170.416 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -62.31 -39.15 92.07 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 124.534 1.134 . . . . 0.0 112.03 175.076 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 31.3 t30 -63.41 -26.22 68.64 Favored 'General case' 0 CA--C 1.549 0.918 0 N-CA-C 113.363 0.875 . . . . 0.0 113.363 178.091 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 7.7 m-85 -77.5 -12.39 59.96 Favored 'General case' 0 CA--C 1.545 0.775 0 N-CA-C 114.247 1.203 . . . . 0.0 114.247 173.629 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 74.0 m -90.67 158.93 16.66 Favored 'General case' 0 CA--C 1.544 0.746 0 N-CA-C 114.181 1.178 . . . . 0.0 114.181 -178.102 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 23.5 t-20 . . . . . 0 C--O 1.253 1.253 0 C-N-CA 126.795 2.038 . . . . 0.0 112.364 -174.924 . . . . . . . . 0 0 . 1 . 043 nuclear nobuild full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 69.9 t80 . . . . . 0 N--CA 1.483 1.182 0 CA-C-O 119.486 -0.292 . . . . 0.0 110.916 . . . . . . . . . 0 0 . 1 . 043 nuclear nobuild full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 10.0 p -165.68 151.22 2.01 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.118 0 C-N-CA 125.443 1.497 . . . . 0.0 111.178 178.706 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -133.01 145.04 50.49 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 125.934 1.694 . . . . 0.0 111.768 173.469 . . . . . . . . 2 2 . 1 . 043 nuclear nobuild full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 42.4 mt-30 -146.9 165.63 29.18 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 124.301 1.04 . . . . 0.0 111.668 -166.89 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 96.6 m-70 -84.2 134.09 34.57 Favored 'General case' 0 CA--C 1.541 0.61 0 N-CA-C 108.948 -0.76 . . . . 0.0 108.948 156.882 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 92.0 mt -150.31 136.69 18.84 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 125.39 1.476 . . . . 0.0 108.995 -175.715 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 3.7 t -155.53 151.86 28.16 Favored 'General case' 0 N--CA 1.467 0.377 0 C-N-CA 123.294 0.638 . . . . 0.0 112.05 -177.241 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 54.62 -127.95 41.33 Favored Glycine 0 CA--C 1.531 1.06 0 C-N-CA 124.868 1.223 . . . . 0.0 113.338 178.851 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 24.8 m -62.58 -29.67 70.76 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 124.434 1.093 . . . . 0.0 111.988 -178.247 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 16.7 m80 -70.53 -39.39 74.08 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 124.065 0.946 . . . . 0.0 111.247 179.485 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 59.6 tp -67.9 -43.47 79.22 Favored 'General case' 0 N--CA 1.467 0.393 0 C-N-CA 123.998 0.919 . . . . 0.0 111.153 172.866 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 44.8 t -62.4 -39.17 83.3 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.941 0 C-N-CA 123.59 0.756 . . . . 0.0 111.812 176.028 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -66.3 -45.99 78.51 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 124.185 0.994 . . . . 0.0 111.541 173.985 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.0 -48.87 80.04 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 122.917 0.487 . . . . 0.0 111.766 177.109 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 23.4 mt -51.39 -53.27 38.21 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 124.882 1.273 . . . . 0.0 111.627 173.058 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 69.6 t80 -58.12 -42.88 86.72 Favored 'General case' 0 CA--C 1.54 0.592 0 N-CA-C 113.359 0.874 . . . . 0.0 113.359 177.846 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 89.5 mt -75.58 -32.07 60.22 Favored 'General case' 0 N--CA 1.47 0.55 0 N-CA-C 113.119 0.785 . . . . 0.0 113.119 -178.276 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 25.3 t -69.25 -44.42 80.6 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.746 0 C-N-CA 124.526 1.13 . . . . 0.0 110.795 174.175 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 80.9 m -94.74 -24.62 17.03 Favored 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 114.333 1.234 . . . . 0.0 114.333 -169.409 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 61.5 -109.11 2.28 Favored Glycine 0 CA--C 1.53 0.995 0 C-N-CA 124.327 0.965 . . . . 0.0 112.433 174.971 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -73.59 -24.19 60.03 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 124.079 0.951 . . . . 0.0 113.099 177.892 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 38.5 mtp85 -73.05 139.33 46.48 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 123.703 0.801 . . . . 0.0 110.496 172.895 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . -84.23 128.53 8.67 Favored Glycine 0 N--CA 1.467 0.743 0 C-N-CA 124.908 1.242 . . . . 0.0 111.269 -174.393 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 53.1 p90 -90.97 166.05 13.23 Favored 'General case' 0 CA--C 1.536 0.416 0 N-CA-C 113.446 0.906 . . . . 0.0 113.446 -177.73 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 70.9 t80 -148.74 109.91 4.36 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 124.987 1.315 . . . . 0.0 110.219 174.59 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 54.9 p90 -86.03 146.31 26.7 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 124.501 1.12 . . . . 0.0 111.118 171.207 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 7.3 t -163.44 146.23 8.01 Favored Pre-proline 0 N--CA 1.474 0.761 0 C-N-CA 125.002 1.321 . . . . 0.0 111.69 -178.398 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 87.9 Cg_endo -78.14 -17.47 13.39 Favored 'Trans proline' 0 C--N 1.349 0.599 0 C-N-CA 123.513 2.809 . . . . 0.0 112.758 170.68 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 85.7 tttt -114.67 141.98 47.08 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 124.675 1.19 . . . . 0.0 112.488 -164.319 . . . . . . . . 1 1 . 1 . 043 nuclear nobuild full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 24.4 m . . . . . 0 C--O 1.251 1.174 0 C-N-CA 125.318 1.447 . . . . 0.0 111.647 -176.898 . . . . . . . . 0 0 . 1 . 044 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.72 0 N-CA-C 111.293 -0.723 . . . . 0.0 111.293 . . . . . . . . . 0 0 . 1 . 044 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -55.97 -48.3 78.85 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.334 0 C-N-CA 124.419 1.088 . . . . 0.0 113.537 -171.056 . . . . . . . . 2 2 . 1 . 044 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 93.1 t -64.05 -45.47 96.55 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.852 0 CA-C-N 118.643 0.656 . . . . 0.0 110.834 -175.853 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -64.36 -43.35 94.82 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-O 119.078 -0.487 . . . . 0.0 111.345 177.902 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 42.9 tt0 -61.35 -52.61 63.92 Favored 'General case' 0 CA--C 1.533 0.302 0 CA-C-N 118.633 0.651 . . . . 0.0 111.076 176.56 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 59.7 m -60.08 -32.76 71.26 Favored 'General case' 0 N--CA 1.467 0.38 0 N-CA-C 112.906 0.706 . . . . 0.0 112.906 -176.383 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 68.8 m -76.42 -57.39 3.89 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 123.78 0.832 . . . . 0.0 111.871 176.517 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 69.7 p -81.62 -20.61 39.36 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 124.641 1.176 . . . . 0.0 113.91 -169.168 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 10.5 t -140.86 -162.58 1.38 Allowed 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 126.73 2.012 . . . . 0.0 109.575 177.891 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 38.6 pt -93.88 147.06 5.82 Favored 'Isoleucine or valine' 0 C--O 1.236 0.362 0 O-C-N 120.932 -1.105 . . . . 0.0 112.034 176.492 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 17.2 p -137.87 165.11 27.3 Favored 'General case' 0 N--CA 1.466 0.355 0 C-N-CA 125.06 1.344 . . . . 0.0 110.231 166.747 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 13.5 t -115.96 161.67 18.5 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-O 121.604 0.716 . . . . 0.0 112.419 -179.076 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 53.0 mt -58.89 -33.39 70.45 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 125.009 1.324 . . . . 0.0 111.558 174.772 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 29.0 m-85 -58.79 -33.79 70.75 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 123.788 0.835 . . . . 0.0 113.223 171.304 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 63.4 mm-40 -83.18 -29.37 28.64 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 124.226 1.01 . . . . 0.0 111.327 177.869 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 41.1 mt -64.65 -39.96 94.6 Favored 'General case' 0 N--CA 1.471 0.608 0 CA-C-N 119.148 0.886 . . . . 0.0 111.046 168.593 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 26.9 tt0 -60.84 -27.16 67.87 Favored 'General case' 0 CA--C 1.545 0.751 0 N-CA-C 113.586 0.958 . . . . 0.0 113.586 -179.561 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 21.8 t30 -58.8 -26.29 63.95 Favored 'General case' 0 CA--C 1.548 0.882 0 O-C-N 121.062 -1.024 . . . . 0.0 113.1 173.656 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 89.7 m-85 -100.8 5.95 43.66 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 125.597 1.559 . . . . 0.0 113.967 -178.046 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 63.8 m -65.24 149.57 49.71 Favored 'General case' 0 CA--C 1.542 0.66 0 O-C-N 120.999 -1.063 . . . . 0.0 111.995 166.081 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 5.9 t30 . . . . . 0 C--O 1.252 1.192 0 C-N-CA 125.709 1.604 . . . . 0.0 112.287 176.551 . . . . . . . . 0 0 . 1 . 044 nuclear nobuild full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 67.0 m-85 . . . . . 0 N--CA 1.487 1.386 0 CA-C-O 119.327 -0.368 . . . . 0.0 110.32 . . . . . . . . . 0 0 . 1 . 044 nuclear nobuild full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 17.3 m -149.01 156.32 7.77 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.206 0 C-N-CA 125.143 1.377 . . . . 0.0 112.293 -173.528 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 8.7 m120 -88.2 143.82 26.82 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 125.245 1.418 . . . . 0.0 111.696 169.082 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 42.7 mt-30 -150.93 161.12 43.32 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 125.45 1.5 . . . . 0.0 111.031 -178.493 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 37.1 m-70 -80.51 136.54 36.31 Favored 'General case' 0 CA--C 1.544 0.74 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 152.122 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 90.1 mt -150.07 127.17 11.24 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 125.86 1.664 . . . . 0.0 107.727 -172.917 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 4.2 t -152.19 156.64 40.17 Favored 'General case' 0 CA--C 1.535 0.404 0 O-C-N 121.44 -0.787 . . . . 0.0 112.586 -172.375 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 61.47 -138.6 47.11 Favored Glycine 0 CA--C 1.528 0.888 0 C-N-CA 125.002 1.287 . . . . 0.0 112.941 177.386 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 23.8 p -57.01 -39.2 74.28 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 123.915 0.886 . . . . 0.0 112.516 174.996 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 17.2 m-70 -65.12 -29.17 70.01 Favored 'General case' 0 CA--C 1.545 0.763 0 O-C-N 121.131 -0.981 . . . . 0.0 113.364 -179.4 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 55.9 tp -69.49 -41.76 75.69 Favored 'General case' 0 N--CA 1.469 0.476 0 O-C-N 121.476 -0.765 . . . . 0.0 111.527 170.115 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 94.6 t -64.25 -38.7 83.19 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.901 0 C-N-CA 123.098 0.559 . . . . 0.0 110.942 175.976 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 49.7 mt-10 -64.02 -48.08 77.72 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 124.485 1.114 . . . . 0.0 111.421 173.02 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.29 -45.51 93.11 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-N 119.158 0.89 . . . . 0.0 111.752 178.233 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 53.2 tp -57.45 -51.87 67.68 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 124.403 1.081 . . . . 0.0 110.933 175.077 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 54.8 t80 -56.67 -40.59 75.81 Favored 'General case' 0 CA--C 1.539 0.548 0 N-CA-C 113.42 0.896 . . . . 0.0 113.42 175.283 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 76.7 mt -73.04 -32.2 64.92 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 124.088 0.955 . . . . 0.0 112.934 179.641 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 37.1 t -68.41 -45.88 81.51 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.752 0 C-N-CA 123.739 0.816 . . . . 0.0 110.739 171.039 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 85.0 m -75.94 -36.07 59.49 Favored 'General case' 0 CA--C 1.535 0.398 0 N-CA-C 113.389 0.885 . . . . 0.0 113.389 -175.575 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 63.64 -134.56 41.39 Favored Glycine 0 CA--C 1.531 1.069 0 C-N-CA 124.433 1.016 . . . . 0.0 111.632 -176.136 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -62.94 -17.59 62.09 Favored 'General case' 0 CA--C 1.543 0.703 0 N-CA-C 114.741 1.385 . . . . 0.0 114.741 179.06 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 84.0 mtm180 -62.96 -32.0 73.23 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 124.418 1.087 . . . . 0.0 113.344 -179.152 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 80.32 -178.9 53.68 Favored Glycine 0 CA--C 1.532 1.148 0 C-N-CA 124.707 1.146 . . . . 0.0 112.431 -171.358 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 51.7 p90 -156.04 164.77 38.02 Favored 'General case' 0 N--CA 1.469 0.493 0 N-CA-C 113.531 0.937 . . . . 0.0 113.531 -172.506 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 40.1 t80 -127.76 99.89 5.73 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 126.139 1.776 . . . . 0.0 109.502 174.5 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 84.6 t80 -82.02 129.39 34.78 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 124.986 1.314 . . . . 0.0 111.662 -178.737 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 38.9 p -127.93 80.98 71.23 Favored Pre-proline 0 N--CA 1.482 1.165 0 C-N-CA 124.737 1.215 . . . . 0.0 112.487 -170.538 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 63.0 Cg_endo -81.0 164.43 19.97 Favored 'Trans proline' 0 CA--C 1.539 0.727 0 C-N-CA 123.935 3.09 . . . . 0.0 111.013 171.585 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 89.1 mttt -75.53 151.13 38.0 Favored 'General case' 0 CA--C 1.547 0.846 0 N-CA-C 112.579 0.585 . . . . 0.0 112.579 168.341 . . . . . . . . 1 1 . 1 . 044 nuclear nobuild full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 24.9 m . . . . . 0 N--CA 1.488 1.431 0 C-N-CA 128.684 2.794 . . . . 0.0 112.043 175.246 . . . . . . . . 0 0 . 1 . 045 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.186 0 N-CA-C 112.288 -0.325 . . . . 0.0 112.288 . . . . . . . . . 0 0 . 1 . 045 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 35.0 pt -107.9 -39.38 4.36 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.139 0 C-N-CA 127.289 2.236 . . . . 0.0 113.478 -2.286 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 73.0 t -63.07 -36.94 77.96 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.126 0 CA-C-N 119.96 1.254 . . . . 0.0 112.036 -166.711 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -84.76 -6.05 59.34 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 125.286 1.434 . . . . 0.0 113.907 179.535 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 64.1 tt0 -106.38 -57.24 2.08 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 124.904 1.282 . . . . 0.0 110.099 -178.891 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 89.7 m -66.22 -28.23 68.59 Favored 'General case' 0 N--CA 1.465 0.322 0 C-N-CA 124.881 1.273 . . . . 0.0 113.931 -178.276 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 8.4 t -80.48 -42.91 21.72 Favored 'General case' 0 CA--C 1.541 0.622 0 O-C-N 121.636 -0.665 . . . . 0.0 110.733 178.526 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 20.1 m -77.02 -33.45 57.46 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 127.386 2.274 . . . . 0.0 112.924 -173.763 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.5 t -146.07 -173.62 4.21 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 124.879 1.272 . . . . 0.0 111.142 -179.305 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 65.0 mt -74.28 134.22 29.98 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.58 0 O-C-N 120.613 -1.304 . . . . 0.0 110.256 175.192 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 8.3 p -128.6 173.1 10.57 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 124.86 1.264 . . . . 0.0 111.142 166.103 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 5.7 m -123.58 149.24 45.54 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 123.728 0.811 . . . . 0.0 110.917 -169.938 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 39.8 mt -59.49 -33.07 70.88 Favored 'General case' 0 N--CA 1.471 0.617 0 O-C-N 120.89 -1.131 . . . . 0.0 111.856 173.345 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 79.9 t80 -60.11 -28.24 67.69 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 124.366 1.066 . . . . 0.0 113.612 171.729 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 58.4 mm-40 -84.32 -36.26 22.7 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 124.131 0.973 . . . . 0.0 110.644 174.402 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 49.7 mt -60.33 -30.93 69.83 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-N 119.723 1.147 . . . . 0.0 112.278 172.13 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -59.26 -27.39 65.76 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 124.376 1.07 . . . . 0.0 113.512 176.18 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 33.3 t30 -65.74 -24.24 66.92 Favored 'General case' 0 CA--C 1.55 0.945 0 O-C-N 121.1 -1.0 . . . . 0.0 113.057 174.129 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 87.6 m-85 -99.7 5.01 45.8 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 126.081 1.752 . . . . 0.0 113.368 -176.154 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 56.5 m -63.96 154.12 35.0 Favored 'General case' 0 CA--C 1.544 0.712 0 O-C-N 121.408 -0.807 . . . . 0.0 112.025 163.575 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 21.7 t30 . . . . . 0 C--O 1.252 1.193 0 C-N-CA 126.478 1.911 . . . . 0.0 112.151 176.076 . . . . . . . . 0 0 . 1 . 045 nuclear nobuild full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 95.4 m-85 . . . . . 0 N--CA 1.489 1.503 0 CA-C-O 119.654 -0.212 . . . . 0.0 110.759 . . . . . . . . . 0 0 . 1 . 045 nuclear nobuild full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 7.3 p -91.68 143.03 12.15 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.001 0 C-N-CA 124.612 1.165 . . . . 0.0 110.388 170.995 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 30.5 m-20 -120.67 133.55 55.35 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 124.806 1.243 . . . . 0.0 109.745 -179.439 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 44.3 mt-30 -151.51 165.08 35.31 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 124.593 1.157 . . . . 0.0 112.181 -168.564 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 17.5 m-70 -77.07 137.22 38.81 Favored 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 108.631 -0.877 . . . . 0.0 108.631 150.951 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 70.0 mt -146.02 129.26 16.69 Favored 'General case' 0 C--N 1.331 -0.2 0 C-N-CA 125.612 1.565 . . . . 0.0 108.295 -176.565 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 4.2 t -148.67 154.36 39.55 Favored 'General case' 0 N--CA 1.465 0.316 0 C-N-CA 123.238 0.615 . . . . 0.0 111.716 -175.863 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 52.06 -129.46 35.54 Favored Glycine 0 CA--C 1.529 0.923 0 C-N-CA 125.336 1.446 . . . . 0.0 113.056 176.975 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 19.9 m -57.86 -34.62 69.94 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 124.251 1.02 . . . . 0.0 112.737 -179.32 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 75.1 m-70 -75.11 -28.96 60.44 Favored 'General case' 0 CA--C 1.541 0.602 0 O-C-N 121.073 -1.017 . . . . 0.0 113.017 177.797 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 50.1 tp -70.68 -42.63 70.47 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 119.037 0.835 . . . . 0.0 111.058 169.008 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 82.1 t -59.48 -42.45 87.88 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.106 0 CA-C-N 118.477 0.58 . . . . 0.0 111.442 172.548 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -61.83 -48.85 78.72 Favored 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 125.439 1.496 . . . . 0.0 111.843 176.458 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -64.29 -45.26 88.76 Favored 'General case' 0 CA--C 1.54 0.572 0 O-C-N 121.681 -0.637 . . . . 0.0 111.733 179.818 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 45.8 tp -59.76 -46.32 89.52 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 123.868 0.867 . . . . 0.0 110.816 175.994 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 39.1 t80 -58.8 -39.81 82.24 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 123.875 0.87 . . . . 0.0 113.183 172.965 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 68.5 mt -69.59 -31.93 70.37 Favored 'General case' 0 N--CA 1.469 0.516 0 O-C-N 121.482 -0.761 . . . . 0.0 112.952 177.993 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 70.2 t -77.35 -40.04 28.69 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.887 0 C-N-CA 124.238 1.015 . . . . 0.0 111.564 174.693 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 85.4 m -108.34 4.92 25.02 Favored 'General case' 0 N--CA 1.47 0.556 0 N-CA-C 115.246 1.573 . . . . 0.0 115.246 -167.269 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . -60.45 -24.17 61.29 Favored Glycine 0 N--CA 1.478 1.446 0 N-CA-C 116.837 1.495 . . . . 0.0 116.837 -161.469 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -77.06 -27.08 54.22 Favored 'General case' 0 CA--C 1.549 0.94 0 CA-C-N 118.406 1.103 . . . . 0.0 112.834 173.714 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 66.1 mtp180 -100.37 -35.4 9.6 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 126.238 1.815 . . . . 0.0 113.497 -174.695 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 88.88 174.43 46.82 Favored Glycine 0 CA--C 1.533 1.192 0 C-N-CA 124.738 1.161 . . . . 0.0 111.44 -159.953 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 40.4 p90 -151.17 167.76 26.77 Favored 'General case' 0 N--CA 1.475 0.775 0 N-CA-C 114.466 1.284 . . . . 0.0 114.466 -172.37 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 45.1 t80 -122.33 97.43 5.46 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 126.005 1.722 . . . . 0.0 110.401 172.406 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 71.8 t80 -74.81 130.73 39.97 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 124.942 1.297 . . . . 0.0 110.506 172.614 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 8.8 t -163.76 142.33 6.12 Favored Pre-proline 0 N--CA 1.479 0.979 0 N-CA-C 114.947 1.462 . . . . 0.0 114.947 -167.906 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 88.9 Cg_endo -86.5 142.06 6.92 Favored 'Trans proline' 0 C--N 1.35 0.615 0 C-N-CA 124.24 3.293 . . . . 0.0 110.574 157.105 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 24.4 ttpp -63.43 -46.65 85.35 Favored 'General case' 0 CA--C 1.543 0.688 0 O-C-N 121.146 -0.971 . . . . 0.0 112.448 171.344 . . . . . . . . 1 1 . 1 . 045 nuclear nobuild full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 23.1 m . . . . . 0 C--O 1.252 1.197 0 C-N-CA 125.837 1.655 . . . . 0.0 112.245 -167.474 . . . . . . . . 0 0 . 1 . 046 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.389 0 N-CA-C 111.687 -0.565 . . . . 0.0 111.687 . . . . . . . . . 0 0 . 1 . 046 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -54.85 -35.92 35.51 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.202 0 C-N-CA 125.246 1.418 . . . . 0.0 113.994 -173.205 . . . . . . . . 2 2 . 1 . 046 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 75.8 t -62.41 -34.45 64.6 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.377 0 CA-C-N 119.296 0.953 . . . . 0.0 112.981 177.96 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 43.3 tt0 -76.98 -50.77 12.42 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-N 118.171 0.441 . . . . 0.0 110.131 169.621 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 61.2 tt0 -61.37 -40.48 94.49 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 113.483 0.92 . . . . 0.0 113.483 -169.587 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 7.5 m -64.99 -23.16 67.14 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 113.634 0.976 . . . . 0.0 113.634 174.388 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 26.6 t -94.03 -39.8 10.43 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 124.12 0.968 . . . . 0.0 112.811 -177.544 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 73.2 p -85.41 -40.7 16.15 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 124.856 1.262 . . . . 0.0 112.57 179.116 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 47.8 m -105.32 -170.23 1.72 Allowed 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 125.597 1.559 . . . . 0.0 110.152 170.515 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 11.7 tt -103.43 146.86 10.52 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.8 0 C-N-CA 124.979 1.312 . . . . 0.0 110.025 175.971 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 14.2 p -142.04 162.04 36.47 Favored 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 113.613 0.968 . . . . 0.0 113.613 -178.304 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 19.4 m -112.96 150.1 32.34 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 124.386 1.075 . . . . 0.0 111.994 -170.234 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 28.2 mt -61.1 -33.37 73.25 Favored 'General case' 0 N--CA 1.473 0.713 0 O-C-N 121.275 -0.891 . . . . 0.0 111.858 177.461 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 57.5 m-85 -62.03 -31.85 72.28 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 124.538 1.135 . . . . 0.0 113.082 173.121 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 22.6 mm100 -81.81 -31.18 31.89 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 124.407 1.083 . . . . 0.0 111.684 174.021 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 53.7 mt -62.07 -38.76 90.03 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-N 119.644 1.111 . . . . 0.0 111.397 168.472 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 28.7 tt0 -61.3 -26.02 67.51 Favored 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 113.45 0.907 . . . . 0.0 113.45 -179.396 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 16.1 t-20 -59.72 -22.96 62.76 Favored 'General case' 0 CA--C 1.551 1.015 0 O-C-N 121.156 -0.965 . . . . 0.0 113.547 173.004 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 96.2 m-85 -97.61 1.22 48.52 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 125.61 1.564 . . . . 0.0 114.033 179.574 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 59.6 m -66.88 153.58 43.13 Favored 'General case' 0 CA--C 1.543 0.706 0 O-C-N 121.144 -0.973 . . . . 0.0 111.962 168.402 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 25.6 t-20 . . . . . 0 C--O 1.255 1.389 0 C-N-CA 124.715 1.206 . . . . 0.0 112.667 178.142 . . . . . . . . 0 0 . 1 . 046 nuclear nobuild full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 68.1 t80 . . . . . 0 N--CA 1.487 1.397 0 CA-C-O 119.97 -0.062 . . . . 0.0 110.89 . . . . . . . . . 0 0 . 1 . 046 nuclear nobuild full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 28.6 m -74.37 155.62 6.5 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.957 0 C-N-CA 124.535 1.134 . . . . 0.0 113.454 -174.836 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 10.1 p30 -75.42 148.15 39.37 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 126.051 1.74 . . . . 0.0 111.712 170.022 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 34.3 mm-40 -150.89 162.12 41.39 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 124.282 1.033 . . . . 0.0 112.32 -162.28 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 98.1 m-70 -85.91 130.07 34.65 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 123.612 0.765 . . . . 0.0 109.046 164.185 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 90.3 mt -142.83 128.51 19.23 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 125.16 1.384 . . . . 0.0 109.445 -172.112 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 62.7 m -131.62 143.2 50.15 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 124.932 1.293 . . . . 0.0 111.046 -176.246 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 54.51 -127.44 39.83 Favored Glycine 0 N--CA 1.475 1.287 0 C-N-CA 124.846 1.212 . . . . 0.0 114.363 165.275 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 20.3 m -61.09 -33.67 73.72 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 124.152 0.981 . . . . 0.0 112.223 -177.749 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 27.2 m170 -70.93 -37.6 72.89 Favored 'General case' 0 CA--C 1.544 0.716 0 O-C-N 121.353 -0.842 . . . . 0.0 111.391 177.83 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 54.7 tp -66.38 -45.78 78.9 Favored 'General case' 0 N--CA 1.466 0.339 0 C-N-CA 123.697 0.799 . . . . 0.0 111.543 171.398 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 62.4 t -63.0 -36.44 75.8 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.785 0 C-N-CA 123.121 0.569 . . . . 0.0 111.465 177.421 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -66.14 -47.34 74.4 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 123.924 0.89 . . . . 0.0 112.046 172.278 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.47 -46.14 89.63 Favored 'General case' 0 CA--C 1.538 0.505 0 O-C-N 121.554 -0.716 . . . . 0.0 111.754 177.007 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 50.8 tp -58.5 -49.93 75.6 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 124.849 1.26 . . . . 0.0 110.997 174.828 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 52.1 t80 -56.17 -41.04 74.85 Favored 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 113.11 0.782 . . . . 0.0 113.11 174.329 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 80.1 mt -72.24 -35.51 68.85 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 123.91 0.884 . . . . 0.0 112.818 179.083 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 37.8 t -64.01 -46.14 94.73 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.912 0 C-N-CA 123.793 0.837 . . . . 0.0 110.827 171.333 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 81.5 m -78.18 -30.96 49.33 Favored 'General case' 0 N--CA 1.469 0.493 0 N-CA-C 113.437 0.902 . . . . 0.0 113.437 -175.743 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 63.92 -137.76 41.53 Favored Glycine 0 CA--C 1.531 1.057 0 C-N-CA 123.843 0.735 . . . . 0.0 111.417 -174.924 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 28.2 tt0 -67.71 -15.22 63.53 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 124.428 1.091 . . . . 0.0 113.907 -178.573 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 81.7 mtm180 -57.69 -41.11 80.96 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 124.126 0.971 . . . . 0.0 112.574 178.441 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 81.71 -178.29 53.75 Favored Glycine 0 CA--C 1.532 1.108 0 C-N-CA 124.133 0.873 . . . . 0.0 112.1 -168.591 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 52.5 p90 -159.71 167.68 27.76 Favored 'General case' 0 CA--C 1.539 0.548 0 N-CA-C 113.76 1.022 . . . . 0.0 113.76 -167.258 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 86.3 t80 -154.33 110.6 3.26 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 126.134 1.773 . . . . 0.0 109.76 166.672 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 20.8 p90 -82.42 161.37 22.49 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 125.219 1.408 . . . . 0.0 113.391 177.254 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 31.2 m -91.38 125.14 59.11 Favored Pre-proline 0 N--CA 1.477 0.894 0 C-N-CA 124.201 1.0 . . . . 0.0 108.529 164.258 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_endo -75.48 -164.14 0.22 Allowed 'Trans proline' 0 CA--C 1.543 0.933 0 C-N-CA 123.623 2.882 . . . . 0.0 112.158 -172.724 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 23.1 pttp -71.3 11.14 0.48 Allowed 'General case' 0 CA--C 1.555 1.137 0 N-CA-C 115.575 1.695 . . . . 0.0 115.575 -179.572 . . . . . . . . 1 1 . 1 . 046 nuclear nobuild full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 20.4 p . . . . . 0 C--O 1.254 1.32 0 C-N-CA 126.332 1.853 . . . . 0.0 113.661 175.2 . . . . . . . . 0 0 . 1 . 047 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.525 0 N-CA-C 111.589 -0.604 . . . . 0.0 111.589 . . . . . . . . . 0 0 . 1 . 047 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 10.9 tp -157.6 -43.47 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.476 0.856 0 O-C-N 118.476 -2.779 . . . . 0.0 113.407 3.38 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 44.2 t -63.46 -51.3 72.39 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.385 0 CA-C-N 120.873 1.67 . . . . 0.0 112.87 -169.853 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -84.17 -32.04 24.83 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 123.395 0.678 . . . . 0.0 111.465 177.969 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 63.9 tt0 -65.88 -40.21 91.39 Favored 'General case' 0 CA--C 1.537 0.446 0 O-C-N 121.516 -0.74 . . . . 0.0 112.091 179.666 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 13.2 t -77.03 -15.95 59.45 Favored 'General case' 0 CA--C 1.539 0.543 0 N-CA-C 113.405 0.891 . . . . 0.0 113.405 174.872 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 33.8 t -82.14 -40.1 22.33 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 124.715 1.206 . . . . 0.0 112.123 174.128 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 25.8 p -85.84 -49.37 7.95 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 125.991 1.716 . . . . 0.0 112.047 179.817 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 63.3 m -97.73 -139.05 0.29 Allowed 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 125.586 1.555 . . . . 0.0 109.673 166.308 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 32.8 pt -136.06 161.15 38.24 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.783 0 C-N-CA 125.558 1.543 . . . . 0.0 111.643 -177.705 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 14.9 p -154.71 159.18 40.54 Favored 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 124.758 1.223 . . . . 0.0 112.08 170.576 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 2.3 t -106.01 165.58 11.11 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 124.104 0.962 . . . . 0.0 111.938 177.193 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.541 HD22 ' H ' ' A' ' 13' ' ' LEU . 2.0 mm? -59.99 -32.44 70.86 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.958 1.303 . . . . 0.0 111.422 178.161 . . . . . . . . 2 2 . 1 . 047 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 80.3 t80 -63.79 -26.61 68.71 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 124.56 1.144 . . . . 0.0 113.425 172.838 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 72.9 mt-30 -87.82 -31.7 19.43 Favored 'General case' 0 N--CA 1.467 0.386 0 C-N-CA 124.511 1.124 . . . . 0.0 111.17 175.518 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 70.9 mt -59.6 -38.41 81.2 Favored 'General case' 0 N--CA 1.472 0.656 0 CA-C-N 119.322 0.964 . . . . 0.0 111.171 166.018 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 27.2 tt0 -58.1 -25.83 61.83 Favored 'General case' 0 CA--C 1.548 0.885 0 N-CA-C 113.85 1.055 . . . . 0.0 113.85 179.424 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 32.0 t30 -60.78 -26.27 67.13 Favored 'General case' 0 CA--C 1.547 0.86 0 O-C-N 121.024 -1.047 . . . . 0.0 113.205 174.081 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 92.8 m-85 -100.08 5.17 44.97 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 125.75 1.62 . . . . 0.0 114.285 -175.348 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 68.8 m -64.96 160.77 19.96 Favored 'General case' 0 N--CA 1.473 0.7 0 N-CA-C 113.583 0.957 . . . . 0.0 113.583 167.818 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.253 1.267 0 C-N-CA 127.784 2.434 . . . . 0.0 112.102 175.016 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 91.5 m-85 . . . . . 0 N--CA 1.486 1.351 0 N-CA-C 110.735 -0.098 . . . . 0.0 110.735 . . . . . . . . . 0 0 . 1 . 047 nuclear nobuild full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 9.6 p -130.07 148.58 33.17 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.059 0 C-N-CA 129.194 2.998 . . . . 0.0 110.536 3.561 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . 0.279 0.5 OUTLIER 34.96 95.95 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 128.804 2.842 . . . . 0.0 116.259 177.665 . . . . . . . . 3 3 . 1 . 047 nuclear nobuild full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 71.3 mm-40 -123.31 168.6 12.28 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 125.242 1.417 . . . . 0.0 111.394 -168.446 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 98.4 m-70 -82.9 125.76 31.73 Favored 'General case' 0 CA--C 1.537 0.462 0 O-C-N 121.296 -0.878 . . . . 0.0 108.667 165.804 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 93.7 mt -142.62 137.08 29.76 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 125.255 1.422 . . . . 0.0 108.118 -179.668 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 4.5 t -143.68 151.83 40.57 Favored 'General case' 0 N--CA 1.466 0.374 0 N-CA-C 112.836 0.68 . . . . 0.0 112.836 -171.797 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 46.14 -128.66 10.13 Favored Glycine 0 CA--C 1.529 0.915 0 C-N-CA 125.985 1.755 . . . . 0.0 114.377 170.378 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 20.0 m -59.48 -33.12 70.93 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 124.777 1.231 . . . . 0.0 112.549 -178.619 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 97.4 m-70 -71.48 -39.81 70.63 Favored 'General case' 0 CA--C 1.541 0.605 0 O-C-N 121.088 -1.008 . . . . 0.0 111.472 178.555 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 8.2 tt -65.57 -44.35 87.0 Favored 'General case' 0 N--CA 1.466 0.329 0 C-N-CA 123.171 0.588 . . . . 0.0 111.003 170.8 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 53.3 t -64.31 -34.34 68.54 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.964 0 CA-C-N 118.406 0.548 . . . . 0.0 111.758 179.012 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -67.53 -48.09 68.02 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 123.95 0.9 . . . . 0.0 111.562 171.864 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -58.99 -44.8 91.65 Favored 'General case' 0 CA--C 1.542 0.668 0 O-C-N 121.736 -0.602 . . . . 0.0 111.775 176.141 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 61.4 tp -56.41 -52.5 64.42 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 125.603 1.561 . . . . 0.0 110.753 173.825 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 48.7 t80 -56.14 -39.78 72.82 Favored 'General case' 0 CA--C 1.543 0.69 0 N-CA-C 113.334 0.864 . . . . 0.0 113.334 174.715 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 82.7 mt -72.75 -32.53 65.72 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 123.87 0.868 . . . . 0.0 113.071 178.613 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 34.2 t -67.76 -44.56 85.64 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.995 0 C-N-CA 124.651 1.18 . . . . 0.0 110.594 171.736 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 62.4 m -83.31 -30.23 27.7 Favored 'General case' 0 N--CA 1.471 0.576 0 N-CA-C 114.375 1.25 . . . . 0.0 114.375 -173.888 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 65.32 -151.29 51.68 Favored Glycine 0 CA--C 1.533 1.203 0 C-N-CA 124.464 1.03 . . . . 0.0 112.355 -173.004 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -61.48 -13.65 22.58 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 125.535 1.534 . . . . 0.0 114.246 -178.286 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 59.1 ttm-85 -63.2 -25.43 68.33 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 125.022 1.329 . . . . 0.0 113.013 175.135 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 78.32 -171.63 55.15 Favored Glycine 0 N--CA 1.471 0.992 0 C-N-CA 124.582 1.087 . . . . 0.0 113.036 -178.785 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 50.3 p90 -162.0 166.67 25.68 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 125.028 1.331 . . . . 0.0 113.143 -170.544 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 83.9 t80 -153.51 115.52 4.32 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 125.63 1.572 . . . . 0.0 109.766 167.81 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 11.7 p90 -94.99 171.61 8.66 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 125.48 1.512 . . . . 0.0 114.356 -175.129 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 21.0 p -132.22 158.12 76.43 Favored Pre-proline 0 N--CA 1.477 0.92 0 C-N-CA 127.227 2.211 . . . . 0.0 110.284 172.385 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -72.8 -55.42 0.1 Allowed 'Trans proline' 0 CA--C 1.537 0.654 0 C-N-CA 122.331 2.02 . . . . 0.0 112.038 -177.477 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 16.2 ptpt -161.01 20.63 0.13 Allowed 'General case' 0 CA--C 1.553 1.069 0 C-N-CA 125.415 1.486 . . . . 0.0 113.331 -171.005 . . . . . . . . 1 1 . 1 . 047 nuclear nobuild full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 25.8 m . . . . . 0 C--O 1.251 1.167 0 C-N-CA 127.829 2.451 . . . . 0.0 112.683 -175.395 . . . . . . . . 0 0 . 1 . 048 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.988 0 N-CA-C 111.74 -0.544 . . . . 0.0 111.74 . . . . . . . . . 0 0 . 1 . 048 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 24.7 pt -63.06 -27.47 43.23 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.427 0 O-C-N 121.1 -1.235 . . . . 0.0 114.192 -173.286 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 78.1 t -61.01 -31.04 48.84 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.293 0 C-N-CA 123.413 0.685 . . . . 0.0 111.86 173.743 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 -79.09 -56.89 4.04 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 123.267 0.627 . . . . 0.0 109.957 169.632 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 23.0 tt0 -67.28 -40.3 86.12 Favored 'General case' 0 N--CA 1.467 0.409 0 N-CA-C 112.823 0.675 . . . . 0.0 112.823 -164.483 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 64.5 m -66.81 -24.08 66.12 Favored 'General case' 0 CA--C 1.534 0.334 0 N-CA-C 113.666 0.987 . . . . 0.0 113.666 178.635 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 33.3 t -98.66 -37.5 9.48 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 124.015 0.926 . . . . 0.0 112.76 -175.376 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 76.8 p -88.63 -33.51 17.6 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 125.077 1.351 . . . . 0.0 113.108 178.978 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 49.0 m -117.39 -168.45 1.49 Allowed 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 125.883 1.673 . . . . 0.0 109.85 170.446 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 12.0 tt -96.66 148.07 5.73 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.659 0 O-C-N 120.834 -1.166 . . . . 0.0 109.821 171.034 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 11.0 p -138.83 166.79 23.51 Favored 'General case' 0 N--CA 1.475 0.785 0 O-C-N 121.251 -0.906 . . . . 0.0 112.828 177.714 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 22.7 t -108.99 157.89 18.23 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-O 121.786 0.803 . . . . 0.0 112.936 -177.927 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 44.4 mt -60.86 -31.12 70.59 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 123.572 0.749 . . . . 0.0 111.44 169.437 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 85.1 t80 -62.96 -28.99 70.46 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.31 1.044 . . . . 0.0 113.223 172.439 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 64.9 mt-30 -80.28 -38.18 31.31 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 123.494 0.718 . . . . 0.0 110.702 174.164 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 42.1 mt -60.49 -37.24 80.44 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-N 118.639 0.654 . . . . 0.0 112.016 170.75 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -61.31 -30.62 70.61 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 124.329 1.052 . . . . 0.0 112.923 178.881 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 14.5 t-20 -65.14 -20.75 66.61 Favored 'General case' 0 CA--C 1.55 0.963 0 O-C-N 121.461 -0.774 . . . . 0.0 112.931 177.134 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 45.4 m-85 -98.91 0.89 45.03 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 125.699 1.599 . . . . 0.0 113.74 179.964 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 60.3 m -65.13 155.51 34.66 Favored 'General case' 0 CA--C 1.544 0.747 0 O-C-N 120.942 -1.099 . . . . 0.0 112.872 172.829 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.247 0.964 0 C-N-CA 126.184 1.794 . . . . 0.0 110.476 167.819 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 84.8 m-85 . . . . . 0 N--CA 1.487 1.403 0 N-CA-C 111.285 0.106 . . . . 0.0 111.285 . . . . . . . . . 0 0 . 1 . 048 nuclear nobuild full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 95.8 t -137.36 135.32 47.02 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.044 0 C-N-CA 125.468 1.507 . . . . 0.0 108.329 176.567 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 8.5 p30 -132.52 142.25 49.11 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 124.63 1.172 . . . . 0.0 112.516 179.701 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 54.0 mm-40 -153.42 161.18 42.55 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 125.412 1.485 . . . . 0.0 111.228 -164.985 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 92.9 m-70 -87.93 129.56 35.2 Favored 'General case' 0 CA--C 1.539 0.55 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 159.871 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 87.3 mt -142.96 123.47 13.98 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 125.304 1.442 . . . . 0.0 109.895 -172.952 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 68.5 m -127.87 142.39 51.29 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 125.449 1.499 . . . . 0.0 110.177 178.164 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 51.78 -117.03 5.46 Favored Glycine 0 N--CA 1.472 1.041 0 C-N-CA 125.221 1.391 . . . . 0.0 113.941 167.031 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 20.2 t -60.05 -37.38 79.66 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 123.769 0.828 . . . . 0.0 112.266 -178.65 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 92.6 m-70 -68.0 -40.37 83.03 Favored 'General case' 0 CA--C 1.541 0.605 0 O-C-N 120.975 -1.078 . . . . 0.0 111.4 177.21 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 52.5 tp -64.4 -46.03 85.03 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 123.763 0.825 . . . . 0.0 110.949 174.09 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 33.1 t -61.05 -38.91 80.6 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.797 0 C-N-CA 124.453 1.101 . . . . 0.0 111.988 176.475 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -64.97 -48.04 75.46 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 123.45 0.7 . . . . 0.0 111.094 174.61 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.17 -43.38 98.96 Favored 'General case' 0 CA--C 1.542 0.646 0 O-C-N 121.638 -0.664 . . . . 0.0 112.116 178.246 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 19.1 mt -56.31 -48.76 76.02 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 124.162 0.985 . . . . 0.0 111.302 172.707 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 64.1 t80 -64.91 -30.71 71.72 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 119.207 0.912 . . . . 0.0 113.095 176.845 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 73.8 mt -72.52 -36.17 68.27 Favored 'General case' 0 N--CA 1.471 0.578 0 O-C-N 121.091 -1.006 . . . . 0.0 112.981 174.799 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 73.3 t -77.14 -39.12 28.52 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.004 0 C-N-CA 123.851 0.86 . . . . 0.0 111.715 176.351 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 66.6 m -111.27 -4.3 15.01 Favored 'General case' 0 N--CA 1.476 0.843 0 N-CA-C 114.993 1.479 . . . . 0.0 114.993 -167.459 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . -74.04 145.67 35.32 Favored Glycine 0 CA--C 1.535 1.325 0 O-C-N 120.776 -1.203 . . . . 0.0 112.258 -177.246 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -86.39 -0.13 55.28 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 128.041 2.537 . . . . 0.0 113.608 0.326 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 35.7 mtp180 -63.32 -34.84 78.56 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 125.044 1.338 . . . . 0.0 113.407 -173.641 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 93.74 -179.48 38.53 Favored Glycine 0 N--CA 1.472 1.094 0 C-N-CA 125.097 1.332 . . . . 0.0 113.437 178.895 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 39.8 p90 -150.97 161.82 42.01 Favored 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 114.012 1.116 . . . . 0.0 114.012 -169.311 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 47.0 m-85 -119.74 30.93 6.8 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 126.684 1.994 . . . . 0.0 113.123 -172.346 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -52.73 150.73 4.96 Favored 'General case' 0 CA--C 1.547 0.834 0 N-CA-C 114.829 1.418 . . . . 0.0 114.829 -178.139 . . . . . . . . 2 2 . 1 . 048 nuclear nobuild full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 5.0 t -171.71 151.22 2.79 Favored Pre-proline 0 N--CA 1.475 0.784 0 C-N-CA 124.819 1.248 . . . . 0.0 111.728 -171.216 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 93.6 Cg_endo -79.25 -17.39 11.7 Favored 'Trans proline' 0 C--N 1.353 0.794 0 C-N-CA 123.611 2.874 . . . . 0.0 112.58 165.847 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 49.5 mtpt 67.69 3.97 3.68 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 127.581 2.352 . . . . 0.0 114.575 -177.369 . . . . . . . . 1 1 . 1 . 048 nuclear nobuild full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 22.4 p . . . . . 0 N--CA 1.483 1.199 0 C-N-CA 126.53 1.932 . . . . 0.0 113.298 177.002 . . . . . . . . 0 0 . 1 . 049 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.925 0 N-CA-C 111.519 -0.632 . . . . 0.0 111.519 . . . . . . . . . 0 0 . 1 . 049 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 29.0 pt -57.65 -31.83 40.68 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.409 0 N-CA-C 115.726 1.75 . . . . 0.0 115.726 -163.393 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 41.8 t -64.46 -36.34 77.01 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.132 0 CA-C-N 119.139 0.881 . . . . 0.0 112.443 -174.762 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -89.71 -49.14 6.82 Favored 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 123.263 0.625 . . . . 0.0 110.376 169.408 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 65.3 tt0 -66.45 -40.49 89.44 Favored 'General case' 0 N--CA 1.464 0.234 0 C-N-CA 124.6 1.16 . . . . 0.0 113.013 -168.013 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 4.3 t -82.08 -15.29 53.99 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 119.096 0.862 . . . . 0.0 112.688 -178.526 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 49.1 t -92.16 -40.71 10.86 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 124.6 1.16 . . . . 0.0 112.363 178.423 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 63.0 p -84.01 -44.67 13.91 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 124.996 1.318 . . . . 0.0 112.007 177.6 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 50.5 m -106.85 -141.73 0.37 Allowed 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 125.473 1.509 . . . . 0.0 109.529 167.028 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 45.0 pt -127.02 165.64 25.24 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.667 0 C-N-CA 125.078 1.351 . . . . 0.0 111.396 179.77 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 16.1 p -147.09 160.61 42.2 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 123.886 0.874 . . . . 0.0 112.543 168.286 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 25.4 t -95.97 160.05 14.66 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 124.826 1.25 . . . . 0.0 112.451 176.802 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 52.7 mt -60.6 -34.57 74.41 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 124.07 0.948 . . . . 0.0 111.101 171.089 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 82.6 t80 -62.63 -26.72 68.77 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 124.596 1.158 . . . . 0.0 113.091 173.197 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 83.0 mt-30 -86.46 -38.01 17.73 Favored 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 123.887 0.875 . . . . 0.0 110.856 175.524 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 79.6 mt -56.64 -36.66 69.76 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-N 119.315 0.961 . . . . 0.0 111.893 170.821 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 30.1 tt0 -57.11 -25.76 59.35 Favored 'General case' 0 CA--C 1.547 0.84 0 N-CA-C 113.618 0.97 . . . . 0.0 113.618 177.908 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 14.5 t-20 -65.65 -24.29 66.99 Favored 'General case' 0 CA--C 1.548 0.895 0 O-C-N 120.947 -1.095 . . . . 0.0 113.319 176.018 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 89.7 m-85 -95.91 -0.32 51.02 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 126.001 1.72 . . . . 0.0 113.369 -177.268 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 60.1 m -69.0 156.61 38.32 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 124.147 0.979 . . . . 0.0 113.127 170.073 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.253 1.273 0 C-N-CA 124.965 1.306 . . . . 0.0 111.866 175.186 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 9.6 p90 . . . . . 0 N--CA 1.486 1.327 0 N-CA-C 112.182 0.438 . . . . 0.0 112.182 . . . . . . . . . 0 0 . 1 . 049 nuclear nobuild full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 98.3 t -83.3 131.95 32.56 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.948 0 C-N-CA 128.161 2.584 . . . . 0.0 109.178 -8.109 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 1.7 p-10 -139.41 139.59 37.16 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 125.018 1.327 . . . . 0.0 111.697 -177.504 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 38.6 mt-30 -148.96 163.19 38.22 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 123.858 0.863 . . . . 0.0 111.987 -161.69 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 97.9 m-70 -82.7 131.6 35.2 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 108.914 -0.772 . . . . 0.0 108.914 156.282 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 86.7 mt -145.41 129.02 17.11 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 125.263 1.425 . . . . 0.0 110.042 -178.647 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 68.8 m -130.61 142.3 50.45 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 125.614 1.565 . . . . 0.0 110.099 179.744 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 52.33 -121.05 12.8 Favored Glycine 0 N--CA 1.47 0.929 0 C-N-CA 124.704 1.145 . . . . 0.0 114.087 166.588 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 21.5 m -59.53 -33.49 71.45 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 124.222 1.009 . . . . 0.0 112.558 -178.214 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 94.7 m-70 -71.06 -39.13 72.41 Favored 'General case' 0 CA--C 1.538 0.494 0 O-C-N 121.421 -0.799 . . . . 0.0 111.441 176.768 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 48.1 tp -66.16 -42.53 88.87 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 123.653 0.781 . . . . 0.0 111.235 173.569 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 54.7 t -60.31 -45.0 97.01 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.888 0 C-N-CA 123.784 0.833 . . . . 0.0 111.471 173.714 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -62.67 -46.92 85.95 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 123.869 0.867 . . . . 0.0 111.313 178.074 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.66 -46.66 87.16 Favored 'General case' 0 CA--C 1.54 0.56 0 O-C-N 121.674 -0.641 . . . . 0.0 111.778 178.733 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 49.6 tp -59.6 -49.29 78.33 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 123.94 0.896 . . . . 0.0 111.091 177.526 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 53.9 t80 -52.46 -44.91 65.85 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 123.813 0.845 . . . . 0.0 112.902 173.403 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 82.3 mt -70.57 -32.49 69.91 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 123.813 0.845 . . . . 0.0 113.05 179.896 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 42.2 t -69.51 -43.12 80.87 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.814 0 C-N-CA 124.264 1.026 . . . . 0.0 111.238 172.5 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 64.7 m -83.23 -26.38 30.83 Favored 'General case' 0 N--CA 1.469 0.51 0 N-CA-C 114.392 1.256 . . . . 0.0 114.392 -173.987 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 63.29 -134.73 42.47 Favored Glycine 0 CA--C 1.532 1.108 0 C-N-CA 124.283 0.944 . . . . 0.0 112.252 -177.912 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 32.4 mm-40 -66.92 -15.21 63.52 Favored 'General case' 0 CA--C 1.545 0.762 0 N-CA-C 114.06 1.133 . . . . 0.0 114.06 -176.913 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 86.3 mtt-85 -61.25 -41.73 97.41 Favored 'General case' 0 N--CA 1.473 0.712 0 N-CA-C 113.571 0.952 . . . . 0.0 113.571 -178.768 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 79.0 -175.48 55.09 Favored Glycine 0 CA--C 1.534 1.28 0 C-N-CA 123.248 0.452 . . . . 0.0 111.997 -160.697 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 33.9 p90 -160.46 165.79 30.35 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 124.662 1.185 . . . . 0.0 113.18 -166.452 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 50.2 m-85 -99.68 -32.49 11.04 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 125.403 1.481 . . . . 0.0 113.336 -177.108 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 91.7 t80 67.34 -39.68 0.38 Allowed 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 129.031 2.932 . . . . 0.0 116.394 174.259 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 38.2 p -57.58 148.16 57.33 Favored Pre-proline 0 N--CA 1.476 0.851 0 C-N-CA 125.723 1.609 . . . . 0.0 112.855 -171.062 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 92.1 Cg_endo -74.69 -21.91 16.11 Favored 'Trans proline' 0 C--N 1.353 0.767 0 C-N-CA 123.104 2.536 . . . . 0.0 113.175 -177.416 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 22.5 ptmt -171.26 -25.61 0.01 OUTLIER 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 126.712 2.005 . . . . 0.0 113.574 -179.121 . . . . . . . . 1 1 . 1 . 049 nuclear nobuild full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 4.0 m . . . . . 0 C--O 1.251 1.136 0 C-N-CA 127.094 2.158 . . . . 0.0 113.103 -179.528 . . . . . . . . 0 0 . 1 . 050 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.676 0 N-CA-C 110.993 -0.843 . . . . 0.0 110.993 . . . . . . . . . 0 0 . 1 . 050 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 11.4 tp -60.09 -39.56 80.78 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.01 0 N-CA-C 113.86 1.059 . . . . 0.0 113.86 -165.506 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 85.3 t -68.7 -34.27 64.0 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.009 0 CA-C-N 119.047 0.839 . . . . 0.0 111.693 -176.595 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 21.0 mm-40 -74.61 -46.24 39.79 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-N 118.315 0.507 . . . . 0.0 111.015 173.117 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 73.4 tp60 -59.48 -44.8 92.97 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 123.662 0.785 . . . . 0.0 111.653 -178.673 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 62.5 m -70.44 -25.92 63.42 Favored 'General case' 0 N--CA 1.466 0.366 0 N-CA-C 114.758 1.392 . . . . 0.0 114.758 179.715 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 17.3 t -106.74 -36.61 6.65 Favored 'General case' 0 CA--C 1.541 0.611 0 N-CA-C 113.701 1.001 . . . . 0.0 113.701 -168.937 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 46.7 p -85.43 -33.02 22.02 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 124.637 1.175 . . . . 0.0 112.055 175.51 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 65.6 m -121.42 -161.62 0.92 Allowed 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 126.68 1.992 . . . . 0.0 109.63 171.303 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 48.4 pt -97.06 157.9 3.26 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.518 0 O-C-N 121.203 -0.935 . . . . 0.0 111.243 168.038 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 21.4 p -137.55 163.83 30.23 Favored 'General case' 0 N--CA 1.466 0.359 0 C-N-CA 124.235 1.014 . . . . 0.0 111.498 170.431 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 32.2 m -104.86 149.18 25.89 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 123.932 0.893 . . . . 0.0 111.215 -177.353 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 56.3 mt -58.71 -32.12 68.89 Favored 'General case' 0 N--CA 1.471 0.611 0 O-C-N 121.358 -0.839 . . . . 0.0 111.686 174.876 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 72.7 t80 -62.22 -27.98 69.37 Favored 'General case' 0 CA--C 1.542 0.646 0 N-CA-C 113.817 1.043 . . . . 0.0 113.817 171.649 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 20.9 mm100 -83.5 -34.2 25.39 Favored 'General case' 0 N--CA 1.465 0.301 0 C-N-CA 124.124 0.97 . . . . 0.0 111.088 175.911 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 10.9 mp -56.1 -49.14 74.68 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-N 118.692 0.678 . . . . 0.0 110.385 165.961 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 4.0 tm-20 -61.99 -39.65 92.93 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 124.898 1.279 . . . . 0.0 112.39 178.694 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 21.6 t30 -64.93 -35.12 80.15 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 123.989 0.916 . . . . 0.0 113.239 175.605 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -74.37 -20.86 59.92 Favored 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 114.116 1.154 . . . . 0.0 114.116 178.969 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 77.2 m -66.52 159.07 28.09 Favored 'General case' 0 CA--C 1.54 0.596 0 N-CA-C 114.407 1.262 . . . . 0.0 114.407 178.13 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.251 1.141 0 C-N-CA 125.604 1.561 . . . . 0.0 114.147 -166.718 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 60.1 m-85 . . . . . 0 N--CA 1.487 1.415 0 CA-C-O 119.845 -0.121 . . . . 0.0 111.268 . . . . . . . . . 0 0 . 1 . 050 nuclear nobuild full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 83.5 t -78.55 135.63 25.58 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.971 0 C-N-CA 123.792 0.837 . . . . 0.0 108.886 170.448 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -133.05 141.14 48.07 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 124.512 1.125 . . . . 0.0 112.345 177.905 . . . . . . . . 2 2 . 1 . 050 nuclear nobuild full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 27.7 mm-40 -148.88 164.22 35.14 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 124.968 1.307 . . . . 0.0 111.19 -165.438 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 94.7 m-70 -85.59 132.17 34.22 Favored 'General case' 0 CA--C 1.538 0.516 0 N-CA-C 108.991 -0.744 . . . . 0.0 108.991 155.407 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 97.3 mt -144.55 130.6 19.44 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 125.706 1.603 . . . . 0.0 109.154 -178.216 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 86.0 m -137.67 147.51 44.94 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 125.06 1.344 . . . . 0.0 110.389 -176.436 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 55.66 -131.53 49.43 Favored Glycine 0 N--CA 1.472 1.052 0 C-N-CA 124.278 0.942 . . . . 0.0 113.658 166.178 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 21.1 m -61.28 -31.07 70.89 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 124.603 1.161 . . . . 0.0 112.524 -178.415 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 94.2 m-70 -70.09 -39.33 75.62 Favored 'General case' 0 CA--C 1.539 0.547 0 O-C-N 121.365 -0.835 . . . . 0.0 111.359 176.854 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 51.4 tp -65.94 -44.4 85.19 Favored 'General case' 0 C--N 1.343 0.317 0 CA-C-O 118.594 -0.717 . . . . 0.0 111.043 170.964 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild full ' B' B ' 12' ' ' VAL . . . . . . . . . . . . . 71.3 t -57.96 -44.94 87.8 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.102 0 CA-C-N 118.884 0.766 . . . . 0.0 111.624 176.171 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -63.55 -47.58 80.98 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 123.702 0.801 . . . . 0.0 111.248 177.664 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.71 -48.44 81.78 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 123.3 0.64 . . . . 0.0 111.409 178.524 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 50.1 tp -58.49 -47.41 84.17 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 125.683 1.593 . . . . 0.0 111.622 179.24 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 82.0 t80 -59.16 -42.18 90.15 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 123.948 0.899 . . . . 0.0 113.2 174.032 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 89.4 mt -75.89 -33.04 59.93 Favored 'General case' 0 N--CA 1.471 0.614 0 N-CA-C 113.191 0.812 . . . . 0.0 113.191 -179.743 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 23.7 t -65.38 -45.54 92.86 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.734 0 C-N-CA 124.619 1.168 . . . . 0.0 110.598 173.792 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 71.5 m -90.72 -27.36 19.01 Favored 'General case' 0 N--CA 1.47 0.542 0 N-CA-C 114.349 1.241 . . . . 0.0 114.349 -172.467 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . -53.31 133.68 42.14 Favored Glycine 0 CA--C 1.536 1.379 0 C-N-CA 124.193 0.902 . . . . 0.0 112.851 -171.977 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -77.71 -11.48 59.88 Favored 'General case' 0 CA--C 1.551 0.996 0 C-N-CA 128.501 2.72 . . . . 0.0 115.006 10.843 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 55.0 ttp85 -65.67 140.9 58.52 Favored 'General case' 0 N--CA 1.473 0.708 0 O-C-N 120.826 -1.171 . . . . 0.0 111.87 178.669 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . -80.94 151.01 31.38 Favored Glycine 0 N--CA 1.47 0.931 0 C-N-CA 125.342 1.449 . . . . 0.0 112.648 -173.877 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 45.3 p90 -105.83 166.92 10.13 Favored 'General case' 0 CA--C 1.536 0.439 0 N-CA-C 114.57 1.322 . . . . 0.0 114.57 -173.393 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 45.1 t80 -137.0 136.81 38.8 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 126.35 1.86 . . . . 0.0 109.206 171.553 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 66.5 t80 -135.6 125.6 25.93 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 125.613 1.565 . . . . 0.0 110.627 -164.847 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 8.8 t -162.45 143.77 7.97 Favored Pre-proline 0 N--CA 1.477 0.925 0 C-N-CA 123.96 0.904 . . . . 0.0 113.07 -171.295 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 93.0 Cg_endo -77.1 -17.05 15.41 Favored 'Trans proline' 0 C--N 1.352 0.741 0 C-N-CA 123.44 2.76 . . . . 0.0 113.229 168.355 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 18.1 ttpp -114.91 139.42 49.81 Favored 'General case' 0 CA--C 1.543 0.673 0 C-N-CA 124.102 0.961 . . . . 0.0 112.588 -164.699 . . . . . . . . 1 1 . 1 . 050 nuclear nobuild full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 20.6 m . . . . . 0 C--O 1.254 1.295 0 C-N-CA 125.023 1.329 . . . . 0.0 111.273 173.752 . . . . . . . . 0 0 . 1 stop_ save_