data_6txt_residue ############################ # Computer software used # ############################ save_MolProbity _Software.Sf_category software _Software.Sf_framecode MolProbity _Software.Entry_ID ? _Software.ID 1 _Software.Name MolProbity _Software.Version 4.0 _Software.Details . save_ save_CYRANGE _Software.Sf_category software _Software.Sf_framecode CYRANGE _Software.Entry_ID ? _Software.ID 2 _Software.Name CYRANGE _Software.Version 2.0 _Software.Details . save_ save_Structure_validation_residue _Structure_validation_residue.Sf_category structure_validation _Structure_validation_residue.Sf_framecode Structure_validation_residue _Structure_validation_residue.Entry_ID ? _Structure_validation_residue.List_ID 1 _Structure_validation_residue.PDB_accession_code 6txt _Structure_validation_residue.Date_analyzed 2020-04-10 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 ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.457 0 N-CA-C 109.19 -0.67 . . . . 0.0 109.19 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -63.03 -37.64 88.01 Favored 'General case' 0 CA--C 1.506 -0.719 0 CA-C-N 114.856 -1.065 . . . . 0.0 109.71 178.934 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 54.6 t -60.03 -42.95 91.49 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.834 0 CA-C-N 115.162 -0.926 . . . . 0.0 109.969 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 67.9 t -65.45 -44.3 94.34 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.104 0 CA-C-N 115.268 -0.878 . . . . 0.0 110.257 -179.444 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 60.7 tptt -64.78 -42.93 94.7 Favored 'General case' 0 CA--C 1.538 0.502 0 N-CA-C 113.638 0.977 . . . . 0.0 113.638 -179.798 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 28.3 m -74.09 -51.53 23.54 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.296 0 N-CA-C 113.822 1.045 . . . . 0.0 113.822 -176.962 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 75.4 t -62.97 -45.22 99.44 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 C-N-CA 120.341 -0.544 . . . . 0.0 111.057 -178.079 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -63.3 -37.85 88.87 Favored 'General case' 0 C--N 1.323 -0.587 0 N-CA-C 113.294 0.85 . . . . 0.0 113.294 -178.829 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 48.0 t -65.35 -49.83 67.9 Favored 'General case' 0 N--CA 1.463 0.212 0 C-N-CA 119.776 -0.77 . . . . 0.0 110.702 179.082 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 99.7 mm-40 -67.45 -38.49 84.58 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.485 179.53 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -59.56 -42.45 92.45 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.282 -0.872 . . . . 0.0 109.909 -178.019 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 88.8 tt0 -64.69 -41.51 95.99 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.268 -0.878 . . . . 0.0 110.27 179.278 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 55.9 tp -68.38 -38.0 80.93 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.56 -0.746 . . . . 0.0 112.156 -179.786 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 49.2 t80 -67.83 -37.13 81.53 Favored 'General case' 0 CA--C 1.504 -0.812 0 N-CA-C 106.969 -1.493 . . . . 0.0 106.969 179.182 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 91.0 mt-10 -63.51 -37.03 85.75 Favored 'General case' 0 N--CA 1.442 -0.839 0 CA-C-N 115.249 -0.887 . . . . 0.0 108.868 176.525 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 66.5 tp -62.64 -47.81 82.11 Favored 'General case' 0 N--CA 1.438 -1.05 0 N-CA-C 107.06 -1.459 . . . . 0.0 107.06 177.488 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 29.6 tptp -50.48 -50.09 53.54 Favored 'General case' 0 CA--C 1.521 -0.16 0 CA-C-N 115.18 -0.918 . . . . 0.0 109.383 177.66 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 81.7 m-20 -129.26 86.75 2.46 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 114.744 -1.116 . . . . 0.0 110.325 179.571 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 96.3 m -66.36 -39.75 89.34 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 112.323 0.49 . . . . 0.0 112.323 -178.827 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 65.7 t30 -58.35 -39.49 79.68 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.577 -0.283 . . . . 0.0 111.494 -177.862 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -108.63 141.08 41.1 Favored 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 120.598 -0.441 . . . . 0.0 110.073 179.919 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 2.5 mptp? -89.94 121.98 32.54 Favored 'General case' 0 N--CA 1.438 -1.049 0 C-N-CA 119.861 -0.736 . . . . 0.0 109.415 178.839 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -52.46 -173.36 0.0 OUTLIER 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.614 -179.827 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 80.2 p -160.63 168.55 24.69 Favored 'General case' 0 C--N 1.317 -0.838 0 N-CA-C 109.257 -0.646 . . . . 0.0 109.257 178.343 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 54.1 mt -59.99 -40.19 88.31 Favored 'General case' 0 C--N 1.311 -1.07 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 179.15 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 74.8 m -62.82 -40.33 97.07 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 116.059 -0.518 . . . . 0.0 110.549 178.302 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -72.48 -48.85 37.51 Favored 'General case' 0 N--CA 1.464 0.256 0 N-CA-C 113.382 0.882 . . . . 0.0 113.382 -178.842 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 95.3 mt -62.46 -35.53 79.59 Favored 'General case' 0 CA--C 1.484 -1.56 0 N-CA-C 108.948 -0.76 . . . . 0.0 108.948 -175.601 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -78.78 -34.04 16.99 Favored 'Isoleucine or valine' 0 N--CA 1.409 -2.484 0 CA-C-N 114.385 -1.279 . . . . 0.0 111.217 -176.101 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' SER . . . . . 0.55 ' C ' ' H ' ' A' ' 46' ' ' GLY . 47.9 t -62.84 -49.89 73.11 Favored 'General case' 0 N--CA 1.425 -1.717 0 N-CA-C 104.201 -2.518 . . . . 0.0 104.201 176.363 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' SER . . . . . 0.484 ' O ' ' N ' ' A' ' 47' ' ' ASN . 70.5 m -51.62 9.69 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.044 0 CA-C-N 112.253 -2.249 . . . . 0.0 114.053 172.125 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . 0.55 ' H ' ' C ' ' A' ' 44' ' ' SER . . . 29.4 25.28 0.0 OUTLIER Glycine 0 CA--C 1.539 1.588 0 C-N-CA 125.679 1.609 . . . . 0.0 115.711 -172.288 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . 0.484 ' N ' ' O ' ' A' ' 45' ' ' SER . 21.6 m120 -63.04 -41.92 99.61 Favored 'General case' 0 CA--C 1.51 -0.573 0 N-CA-C 106.529 -1.656 . . . . 0.0 106.529 174.306 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 17.4 pt -131.16 160.98 41.88 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.157 0 CA-C-N 111.71 -2.496 . . . . 0.0 109.5 178.952 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' SER . . . . . 0.479 ' C ' ' H ' ' A' ' 51' ' ' LYS . 69.7 m -108.38 157.1 18.7 Favored 'General case' 0 C--N 1.313 -1.019 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.549 -179.02 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 24.1 tp60 -47.18 -6.06 0.01 OUTLIER 'General case' 0 CA--C 1.555 1.161 0 N-CA-C 114.758 1.392 . . . . 0.0 114.758 -178.554 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . 0.479 ' H ' ' C ' ' A' ' 49' ' ' SER . 21.0 ptmt -84.28 -47.17 11.05 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 105.852 -1.907 . . . . 0.0 105.852 175.564 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 85.3 mt-30 -71.1 -35.22 71.72 Favored 'General case' 0 N--CA 1.439 -0.981 0 CA-C-N 112.659 -2.064 . . . . 0.0 110.167 174.228 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -72.62 -51.61 18.87 Favored 'General case' 0 C--O 1.221 -0.436 0 CA-C-N 115.14 -0.936 . . . . 0.0 112.654 -177.805 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 96.4 m-20 -77.71 -17.89 57.15 Favored 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 114.356 1.243 . . . . 0.0 114.356 -178.978 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 70.9 m -79.67 -39.4 31.45 Favored 'General case' 0 C--N 1.299 -1.61 0 C-N-CA 119.273 -0.971 . . . . 0.0 110.402 179.125 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 19.5 t80 -70.64 -35.55 72.97 Favored 'General case' 0 CA--C 1.502 -0.9 0 N-CA-C 107.517 -1.29 . . . . 0.0 107.517 178.253 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 64.2 tttm -57.14 -41.58 79.37 Favored 'General case' 0 CA--C 1.488 -1.415 0 CA-C-N 113.19 -1.823 . . . . 0.0 110.416 -178.308 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -80.27 -5.25 55.94 Favored 'General case' 0 N--CA 1.425 -1.683 0 O-C-N 120.662 -1.274 . . . . 0.0 110.175 179.528 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 65.7 t80 . . . . . 0 N--CA 1.45 -0.461 0 C-N-CA 119.899 -0.721 . . . . 0.0 109.182 175.402 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 7.2 p . . . . . 0 N--CA 1.443 -0.8 0 N-CA-C 107.897 -1.149 . . . . 0.0 107.897 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.469 0.481 0 N-CA-C 112.775 0.657 . . . . 0.0 112.775 -176.348 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.514 -0.426 0 CA-C-O 121.537 0.684 . . . . 0.0 110.226 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -62.26 -37.34 85.1 Favored 'General case' 0 CA--C 1.503 -0.833 0 CA-C-N 114.728 -1.124 . . . . 0.0 109.607 179.926 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 46.7 t -56.4 -46.03 81.87 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.044 0 CA-C-N 114.932 -1.031 . . . . 0.0 109.942 -178.945 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 67.7 t -63.26 -49.32 83.56 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.036 0 CA-C-N 114.315 -1.311 . . . . 0.0 112.222 -177.687 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 64.3 tttm -64.64 -42.87 95.16 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 116.755 2.131 . . . . 0.0 116.755 -176.928 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 35.1 m -78.44 -53.78 13.28 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.17 0 C-N-CA 118.391 -1.324 . . . . 0.0 113.708 -176.135 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 53.1 t -61.64 -43.18 96.65 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.72 0 C-N-CA 118.189 -1.404 . . . . 0.0 111.411 -178.181 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -64.94 -26.39 68.29 Favored 'General case' 0 C--N 1.321 -0.647 0 C-N-CA 119.972 -0.691 . . . . 0.0 112.189 179.954 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 82.3 p -75.96 -52.09 11.02 Favored 'General case' 0 N--CA 1.463 0.202 0 C-N-CA 119.642 -0.823 . . . . 0.0 111.405 179.16 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 22.0 mp0 -70.34 -38.49 74.86 Favored 'General case' 0 C--O 1.223 -0.319 0 C-N-CA 120.838 -0.345 . . . . 0.0 111.876 178.627 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -59.74 -41.4 90.87 Favored 'General case' 0 CA--C 1.511 -0.542 0 N-CA-C 109.762 -0.458 . . . . 0.0 109.762 -177.923 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 88.9 tt0 -61.09 -46.23 91.47 Favored 'General case' 0 C--N 1.319 -0.733 0 N-CA-C 108.281 -1.007 . . . . 0.0 108.281 178.925 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 57.8 tp -65.55 -38.57 89.99 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.632 -0.713 . . . . 0.0 112.531 -179.061 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 65.8 t80 -64.9 -40.2 94.71 Favored 'General case' 0 CA--C 1.506 -0.74 0 N-CA-C 106.594 -1.632 . . . . 0.0 106.594 179.112 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 92.1 mt-10 -62.66 -37.02 84.75 Favored 'General case' 0 N--CA 1.443 -0.799 0 CA-C-N 114.65 -1.159 . . . . 0.0 108.976 177.221 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 66.9 tp -61.99 -47.54 84.35 Favored 'General case' 0 N--CA 1.438 -1.069 0 C-N-CA 117.871 -1.532 . . . . 0.0 107.012 177.656 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 64.7 tttp -50.49 -49.73 54.65 Favored 'General case' 0 CA--C 1.52 -0.184 0 CA-C-N 115.338 -0.847 . . . . 0.0 109.422 177.433 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 98.8 m-20 -129.14 86.82 2.48 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 114.785 -1.098 . . . . 0.0 110.093 179.509 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 96.1 m -66.21 -40.35 90.27 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 112.901 0.704 . . . . 0.0 112.901 -178.209 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 65.5 t30 -58.51 -40.15 82.08 Favored 'General case' 0 C--N 1.325 -0.465 0 C-N-CA 120.823 -0.351 . . . . 0.0 111.254 -177.901 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 96.2 mt-10 -106.45 137.4 44.51 Favored 'General case' 0 C--N 1.325 -0.494 0 C-N-CA 120.53 -0.468 . . . . 0.0 110.008 -179.897 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -88.12 129.57 35.27 Favored 'General case' 0 N--CA 1.433 -1.301 0 C-N-CA 118.614 -1.234 . . . . 0.0 109.943 179.333 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -48.72 -178.72 0.0 OUTLIER 'General case' 0 C--N 1.315 -0.911 0 CA-C-N 114.005 -1.452 . . . . 0.0 111.025 -179.377 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 81.3 p -153.57 170.31 21.1 Favored 'General case' 0 C--N 1.314 -0.974 0 N-CA-C 108.427 -0.953 . . . . 0.0 108.427 177.917 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 97.5 mt -60.89 -41.78 96.72 Favored 'General case' 0 C--N 1.311 -1.093 0 N-CA-C 108.154 -1.054 . . . . 0.0 108.154 -179.601 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 75.0 m -63.86 -40.11 95.78 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.502 -0.772 . . . . 0.0 111.949 179.198 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -64.13 -46.74 82.79 Favored 'General case' 0 N--CA 1.464 0.231 0 N-CA-C 113.011 0.745 . . . . 0.0 113.011 -178.34 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 77.2 mt -63.29 -34.91 78.71 Favored 'General case' 0 CA--C 1.491 -1.292 0 N-CA-C 108.578 -0.897 . . . . 0.0 108.578 -178.026 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -81.53 -28.37 10.27 Favored 'Isoleucine or valine' 0 N--CA 1.416 -2.146 0 CA-C-N 114.666 -1.152 . . . . 0.0 111.718 -176.676 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' SER . . . . . 0.52 ' C ' ' H ' ' A' ' 46' ' ' GLY . 75.8 m -61.88 -50.54 71.81 Favored 'General case' 0 N--CA 1.417 -2.075 0 N-CA-C 104.797 -2.298 . . . . 0.0 104.797 177.617 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' SER . . . . . 0.438 ' O ' ' N ' ' A' ' 47' ' ' ASN . 2.4 p -52.8 1.6 0.01 OUTLIER 'General case' 0 CA--C 1.551 0.985 0 CA-C-N 113.249 -1.796 . . . . 0.0 112.933 170.739 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . 0.52 ' H ' ' C ' ' A' ' 44' ' ' SER . . . 28.27 32.33 0.01 OUTLIER Glycine 0 C--N 1.346 1.116 0 C-N-CA 125.757 1.646 . . . . 0.0 114.679 -173.466 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . 0.438 ' N ' ' O ' ' A' ' 45' ' ' SER . 54.7 t-20 -63.79 -42.28 97.75 Favored 'General case' 0 CA--C 1.518 -0.272 0 N-CA-C 106.588 -1.634 . . . . 0.0 106.588 175.699 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 2.4 pp -121.94 166.44 16.57 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.703 0 CA-C-N 112.221 -2.263 . . . . 0.0 109.941 -179.284 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 98.7 p -81.17 166.97 20.16 Favored 'General case' 0 N--CA 1.444 -0.764 0 C-N-CA 120.544 -0.462 . . . . 0.0 110.251 -179.636 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.442 ' O ' ' N ' ' A' ' 53' ' ' ALA . 11.9 tm0? -57.93 -48.86 78.66 Favored 'General case' 0 CA--C 1.493 -1.224 0 CA-C-O 118.531 -0.747 . . . . 0.0 109.212 179.942 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . 0.475 ' O ' ' N ' ' A' ' 55' ' ' SER . 64.3 pttt -60.0 -24.88 64.83 Favored 'General case' 0 CA--C 1.482 -1.672 0 CA-C-N 120.166 1.348 . . . . 0.0 110.953 -177.533 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . 0.419 ' O ' ' HB2' ' A' ' 55' ' ' SER . 3.6 tm0? -67.84 -37.5 81.96 Favored 'General case' 0 N--CA 1.434 -1.25 0 N-CA-C 104.978 -2.231 . . . . 0.0 104.978 175.035 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . 0.442 ' N ' ' O ' ' A' ' 50' ' ' GLN . . . -63.68 -49.11 74.45 Favored 'General case' 0 C--O 1.218 -0.557 0 C-N-CA 118.608 -1.237 . . . . 0.0 107.935 175.927 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 99.9 m-20 -70.56 -11.29 60.84 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 119.226 -0.99 . . . . 0.0 112.125 177.855 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' SER . . . . . 0.475 ' N ' ' O ' ' A' ' 51' ' ' LYS . 62.5 m -64.65 -41.29 96.23 Favored 'General case' 0 CA--C 1.503 -0.836 0 N-CA-C 109.028 -0.73 . . . . 0.0 109.028 -179.734 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -79.55 -30.49 41.75 Favored 'General case' 0 C--N 1.321 -0.669 0 C-N-CA 118.548 -1.261 . . . . 0.0 109.469 179.565 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -60.54 -27.5 67.69 Favored 'General case' 0 CA--C 1.54 0.558 0 N-CA-C 106.797 -1.557 . . . . 0.0 106.797 174.425 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -68.57 -39.38 81.02 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 112.105 -2.316 . . . . 0.0 109.881 176.255 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 66.5 t80 . . . . . 0 C--N 1.344 0.341 0 N-CA-C 108.668 -0.864 . . . . 0.0 108.668 176.687 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 3.8 p . . . . . 0 N--CA 1.44 -0.966 0 N-CA-C 105.593 -2.003 . . . . 0.0 105.593 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.334 0 C-N-CA 119.303 -0.959 . . . . 0.0 113.015 -174.547 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.515 -0.366 0 CA-C-O 122.007 0.908 . . . . 0.0 109.978 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -61.85 -38.26 87.57 Favored 'General case' 0 N--CA 1.444 -0.728 0 CA-C-N 114.456 -1.247 . . . . 0.0 110.038 -179.807 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . 0.421 ' O ' HG22 ' A' ' 20' ' ' VAL . 3.4 p -67.79 -25.65 33.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 C-N-CA 119.39 -0.924 . . . . 0.0 110.888 -178.78 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 60.8 t -63.33 -45.2 98.8 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.709 0 C-N-CA 119.75 -0.78 . . . . 0.0 109.152 179.893 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 15.0 tmtt? -64.56 -39.59 94.03 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 114.57 -1.196 . . . . 0.0 114.057 -178.925 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . 0.428 ' HB ' ' NE2' ' A' ' 52' ' ' GLN . 34.6 m -69.94 -45.17 77.62 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.126 0 N-CA-C 113.221 0.823 . . . . 0.0 113.221 -176.729 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 54.2 t -59.86 -42.36 88.86 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.842 0 C-N-CA 120.223 -0.591 . . . . 0.0 110.342 -179.403 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 98.7 mt-10 -62.35 -38.25 88.82 Favored 'General case' 0 C--N 1.321 -0.656 0 C-N-CA 120.837 -0.345 . . . . 0.0 111.561 179.74 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 73.1 m -64.89 -49.06 71.97 Favored 'General case' 0 N--CA 1.467 0.386 0 C-N-CA 120.379 -0.529 . . . . 0.0 111.431 179.636 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 18.3 mp0 -67.64 -37.42 82.42 Favored 'General case' 0 C--O 1.222 -0.389 0 CA-C-O 121.077 0.465 . . . . 0.0 109.955 178.059 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.48 -39.58 88.16 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.309 -0.859 . . . . 0.0 110.265 -179.338 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 54.5 tp10 -68.74 -41.27 79.19 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 123.869 0.73 . . . . 0.0 110.25 178.781 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 58.5 tp -71.04 -38.46 72.56 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.302 -0.863 . . . . 0.0 113.063 -179.525 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 85.9 t80 -65.11 -46.6 80.4 Favored 'General case' 0 CA--C 1.493 -1.225 0 N-CA-C 107.969 -1.123 . . . . 0.0 107.969 179.906 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . 0.566 ' O ' ' N ' ' A' ' 33' ' ' THR . 2.6 pp20? -71.88 -23.23 61.47 Favored 'General case' 0 N--CA 1.43 -1.43 0 C-N-CA 118.563 -1.255 . . . . 0.0 108.809 176.636 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 67.5 tp -62.91 -48.54 78.49 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 105.979 -1.86 . . . . 0.0 105.979 177.894 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -50.69 -48.27 58.7 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 113.691 -1.595 . . . . 0.0 110.606 176.805 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 28.2 m120 -89.17 -66.71 0.89 Allowed 'General case' 0 N--CA 1.479 0.996 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.935 -178.225 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' THR . . . . . 0.566 ' N ' ' O ' ' A' ' 29' ' ' GLU . 4.0 m 81.31 -36.0 0.11 Allowed 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.182 0.926 . . . . 0.0 112.228 178.415 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 99.1 m-20 -61.38 -41.09 96.53 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 119.819 -0.752 . . . . 0.0 109.664 -179.971 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 94.6 mt-10 -115.16 -162.36 0.82 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.07 -0.513 . . . . 0.0 109.708 -179.469 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 1.1 mptp? -129.38 133.56 47.44 Favored 'General case' 0 N--CA 1.437 -1.078 0 N-CA-C 107.241 -1.392 . . . . 0.0 107.241 176.43 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . 0.406 ' O ' ' CG2' ' A' ' 70' ' ' VAL . . . -52.54 178.21 0.02 OUTLIER 'General case' 0 C--N 1.318 -0.772 0 CA-C-O 120.989 0.423 . . . . 0.0 110.086 -179.67 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' SER . . . . . 0.441 ' CB ' ' O ' ' A' ' 71' ' ' ALA . 82.6 p -158.61 157.6 32.23 Favored 'General case' 0 CA--C 1.508 -0.644 0 N-CA-C 109.083 -0.71 . . . . 0.0 109.083 178.352 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.402 ' O ' ' HB ' ' A' ' 43' ' ' VAL . 75.6 mt -58.48 -41.65 85.73 Favored 'General case' 0 C--N 1.317 -0.841 0 C-N-CA 117.9 -1.52 . . . . 0.0 109.122 -179.216 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 93.0 p -63.35 -33.97 76.69 Favored 'General case' 0 C--N 1.313 -1.016 0 C-N-CA 119.191 -1.004 . . . . 0.0 109.817 177.805 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 57.7 mtpt -76.14 -54.83 6.24 Favored 'General case' 0 CA--C 1.52 -0.175 0 N-CA-C 114.874 1.435 . . . . 0.0 114.874 -178.211 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 82.6 mt -60.54 -41.16 93.92 Favored 'General case' 0 CA--C 1.49 -1.344 0 CA-C-O 123.023 1.392 . . . . 0.0 107.63 -176.568 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . 0.432 HG22 ' HA ' ' A' ' 50' ' ' GLN . 0.3 OUTLIER -69.58 -46.15 76.23 Favored 'Isoleucine or valine' 0 N--CA 1.398 -3.054 0 CA-C-N 111.523 -2.58 . . . . 0.0 110.873 -172.788 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' SER . . . . . 0.542 ' C ' ' H ' ' A' ' 46' ' ' GLY . 48.2 t -61.08 -46.7 89.56 Favored 'General case' 0 N--CA 1.42 -1.951 0 C-N-CA 116.359 -2.136 . . . . 0.0 105.508 178.208 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' SER . . . . . 0.4 ' O ' ' N ' ' A' ' 47' ' ' ASN . 59.1 m -50.58 2.53 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.89 0 CA-C-N 113.303 -1.772 . . . . 0.0 113.555 172.483 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . 0.542 ' H ' ' C ' ' A' ' 44' ' ' SER . . . 28.46 37.5 0.01 OUTLIER Glycine 0 C--N 1.347 1.187 0 C-N-CA 125.043 1.306 . . . . 0.0 113.42 -173.45 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . 0.4 ' N ' ' O ' ' A' ' 45' ' ' SER . 55.6 t-20 -68.01 -39.85 83.11 Favored 'General case' 0 N--CA 1.449 -0.489 0 N-CA-C 106.256 -1.757 . . . . 0.0 106.256 173.126 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 24.1 pt -129.08 161.14 39.04 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.638 0 CA-C-N 112.187 -2.278 . . . . 0.0 108.701 179.645 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' SER . . . . . 0.415 ' O ' ' N ' ' A' ' 52' ' ' GLN . 72.3 m -91.27 136.26 33.22 Favored 'General case' 0 C--O 1.216 -0.704 0 C-N-CA 119.993 -0.683 . . . . 0.0 111.597 -179.315 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.432 ' HA ' HG22 ' A' ' 43' ' ' VAL . 65.8 tp60 -48.7 -17.57 0.19 Allowed 'General case' 0 C--O 1.214 -0.79 0 CA-C-N 114.986 -1.007 . . . . 0.0 112.842 -177.392 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 63.5 pttt -71.94 -39.4 69.44 Favored 'General case' 0 C--N 1.31 -1.141 0 N-CA-C 106.35 -1.722 . . . . 0.0 106.35 177.806 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . 0.428 ' NE2' ' HB ' ' A' ' 20' ' ' VAL . 5.8 tt0 -69.69 -52.36 26.38 Favored 'General case' 0 N--CA 1.428 -1.531 0 CA-C-N 112.323 -2.217 . . . . 0.0 106.224 176.791 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -60.36 -38.51 84.08 Favored 'General case' 0 C--N 1.344 0.347 0 CA-C-N 115.375 -0.829 . . . . 0.0 111.881 -176.086 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 98.8 m-20 -62.03 -39.61 92.9 Favored 'General case' 0 C--N 1.314 -0.949 0 C-N-CA 120.197 -0.601 . . . . 0.0 112.614 179.638 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 75.4 m -62.87 -41.38 99.36 Favored 'General case' 0 C--N 1.314 -0.97 0 C-N-CA 119.213 -0.995 . . . . 0.0 110.473 -179.318 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -69.6 -39.0 77.51 Favored 'General case' 0 N--CA 1.464 0.269 0 C-N-CA 118.015 -1.474 . . . . 0.0 108.81 179.942 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -55.76 -33.34 64.22 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.173 -0.922 . . . . 0.0 108.753 178.524 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -60.5 -37.46 81.19 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-N 115.226 -0.897 . . . . 0.0 109.623 178.519 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 62.4 m-85 . . . . . 0 N--CA 1.465 0.317 0 C-N-CA 120.065 -0.654 . . . . 0.0 109.981 178.768 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . 0.406 ' CG2' ' O ' ' A' ' 37' ' ' ALA . 2.9 p . . . . . 0 N--CA 1.449 -0.516 0 N-CA-C 108.285 -1.006 . . . . 0.0 108.285 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . 0.441 ' O ' ' CB ' ' A' ' 38' ' ' SER . . . . . . . . 0 C--O 1.21 -1.012 0 C-N-CA 119.342 -0.943 . . . . 0.0 110.667 -177.371 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.235 0.297 0 CA-C-O 122.292 1.044 . . . . 0.0 110.795 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -59.72 -36.44 76.56 Favored 'General case' 0 N--CA 1.446 -0.671 0 CA-C-N 113.761 -1.563 . . . . 0.0 111.246 -177.46 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 9.8 p -51.79 -36.75 19.52 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 C-N-CA 119.155 -1.018 . . . . 0.0 111.027 -178.199 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 77.3 t -70.44 -45.67 73.87 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 C-N-CA 119.832 -0.747 . . . . 0.0 110.042 179.531 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 64.8 tttp -62.64 -43.85 97.77 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-N 115.302 -0.863 . . . . 0.0 113.263 -178.962 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 30.1 m -70.44 -50.65 44.17 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.18 0 N-CA-C 113.723 1.009 . . . . 0.0 113.723 -177.303 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 65.3 t -65.48 -44.89 94.07 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 C-N-CA 120.249 -0.58 . . . . 0.0 112.073 -178.495 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 98.7 mt-10 -65.0 -42.66 94.3 Favored 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 112.763 0.653 . . . . 0.0 112.763 -179.129 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 74.1 m -66.51 -45.08 80.74 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-O 121.518 0.675 . . . . 0.0 110.501 -179.909 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 99.5 mm-40 -66.0 -37.93 87.18 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 114.859 -1.064 . . . . 0.0 109.114 179.065 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -59.3 -40.36 85.93 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 114.725 -1.125 . . . . 0.0 109.516 -179.125 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 88.8 tt0 -66.15 -39.87 90.15 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.304 178.441 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 56.8 tp -64.31 -38.47 91.15 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.563 -179.591 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 87.5 t80 -66.26 -36.74 83.77 Favored 'General case' 0 CA--C 1.503 -0.856 0 N-CA-C 107.695 -1.224 . . . . 0.0 107.695 177.762 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 95.1 mt-10 -64.94 -35.6 81.7 Favored 'General case' 0 N--CA 1.445 -0.682 0 N-CA-C 108.905 -0.776 . . . . 0.0 108.905 176.638 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 66.7 tp -62.36 -47.92 82.04 Favored 'General case' 0 N--CA 1.436 -1.141 0 N-CA-C 106.619 -1.623 . . . . 0.0 106.619 177.894 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 60.9 tptt -50.82 -50.57 56.14 Favored 'General case' 0 CA--C 1.523 -0.09 0 CA-C-N 115.115 -0.948 . . . . 0.0 109.279 177.371 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 27.5 m120 -129.55 102.17 6.26 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 114.63 -1.168 . . . . 0.0 109.891 179.172 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 11.3 t -87.08 -15.75 37.61 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 112.309 0.485 . . . . 0.0 112.309 -178.241 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 48.3 t30 -59.92 -43.53 94.85 Favored 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 120.519 -0.472 . . . . 0.0 110.81 -179.079 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 70.9 mm-40 -109.79 -161.03 0.74 Allowed 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 179.791 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 75.8 mmtt -128.69 140.49 51.72 Favored 'General case' 0 N--CA 1.43 -1.466 0 N-CA-C 106.34 -1.726 . . . . 0.0 106.34 175.406 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -51.03 163.81 0.19 Allowed 'General case' 0 C--N 1.315 -0.921 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 -179.535 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' SER . . . . . 0.51 ' HA ' HG22 ' A' ' 70' ' ' VAL . 19.7 m -135.47 144.69 46.55 Favored 'General case' 0 N--CA 1.433 -1.307 0 N-CA-C 107.226 -1.398 . . . . 0.0 107.226 177.97 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.404 HD12 ' O ' ' A' ' 53' ' ' ALA . 8.5 tt -53.93 -40.64 66.92 Favored 'General case' 0 C--N 1.315 -0.901 0 N-CA-C 108.697 -0.853 . . . . 0.0 108.697 -178.365 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 92.8 p -65.3 -34.61 78.74 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.452 -0.794 . . . . 0.0 110.171 177.807 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -73.17 -49.18 29.54 Favored 'General case' 0 CA--C 1.513 -0.475 0 N-CA-C 114.122 1.156 . . . . 0.0 114.122 -178.883 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 96.3 mt -60.62 -40.58 92.4 Favored 'General case' 0 CA--C 1.49 -1.352 0 N-CA-C 107.243 -1.391 . . . . 0.0 107.243 -176.116 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -70.04 -46.88 71.4 Favored 'Isoleucine or valine' 0 N--CA 1.397 -3.081 0 CA-C-N 111.815 -2.448 . . . . 0.0 111.251 -172.906 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' SER . . . . . 0.536 ' C ' ' H ' ' A' ' 46' ' ' GLY . 74.2 m -61.37 -45.77 93.0 Favored 'General case' 0 N--CA 1.407 -2.604 0 C-N-CA 116.242 -2.183 . . . . 0.0 105.997 178.511 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' SER . . . . . 0.424 ' O ' ' N ' ' A' ' 47' ' ' ASN . 26.4 t -50.6 6.23 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.967 0 CA-C-N 113.724 -1.58 . . . . 0.0 114.082 172.536 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . 0.536 ' H ' ' C ' ' A' ' 44' ' ' SER . . . 29.17 36.11 0.01 OUTLIER Glycine 0 C--N 1.351 1.374 0 C-N-CA 124.586 1.088 . . . . 0.0 113.25 -173.013 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . 0.424 ' N ' ' O ' ' A' ' 45' ' ' SER . 95.5 m-20 -67.98 -39.55 83.27 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-O 122.779 1.275 . . . . 0.0 107.696 172.989 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 11.6 pt -131.7 159.43 43.08 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.858 0 CA-C-N 112.382 -2.19 . . . . 0.0 109.205 179.87 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' SER . . . . . 0.444 ' O ' ' N ' ' A' ' 52' ' ' GLN . 45.3 t -83.08 134.19 35.03 Favored 'General case' 0 C--O 1.211 -0.944 0 C-N-CA 120.494 -0.482 . . . . 0.0 111.14 -179.625 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 66.4 tp60 -50.44 -18.48 0.65 Allowed 'General case' 0 C--O 1.212 -0.908 0 CA-C-N 116.279 -0.418 . . . . 0.0 111.61 -179.22 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . 0.407 ' CG ' ' N ' ' A' ' 52' ' ' GLN . 63.3 pttt -72.86 -40.6 65.53 Favored 'General case' 0 C--N 1.317 -0.831 0 N-CA-C 106.018 -1.845 . . . . 0.0 106.018 178.092 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . 0.444 ' N ' ' O ' ' A' ' 49' ' ' SER . 0.5 OUTLIER -67.63 -53.01 31.51 Favored 'General case' 0 N--CA 1.424 -1.759 0 CA-C-N 112.082 -2.326 . . . . 0.0 106.549 176.483 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . 0.404 ' O ' HD12 ' A' ' 39' ' ' LEU . . . -61.63 -38.9 89.36 Favored 'General case' 0 C--O 1.22 -0.46 0 C-N-CA 119.885 -0.726 . . . . 0.0 112.161 -177.579 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 98.0 m-20 -60.62 -39.83 89.66 Favored 'General case' 0 C--N 1.311 -1.092 0 C-N-CA 119.374 -0.93 . . . . 0.0 111.579 -179.718 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 67.3 m -64.62 -40.68 95.91 Favored 'General case' 0 C--N 1.31 -1.135 0 C-N-CA 119.751 -0.78 . . . . 0.0 111.147 179.147 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 10.7 t80 -70.44 -39.98 74.02 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-O 122.069 0.938 . . . . 0.0 109.737 -178.66 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 64.4 tttm -58.48 -33.24 69.56 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 113.886 -1.506 . . . . 0.0 108.879 179.148 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -61.4 -37.87 85.0 Favored 'General case' 0 N--CA 1.443 -0.803 0 CA-C-N 114.886 -1.052 . . . . 0.0 110.143 178.14 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 73.2 m-85 . . . . . 0 C--N 1.342 0.281 0 C-N-CA 119.966 -0.694 . . . . 0.0 109.894 178.666 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . 0.51 HG22 ' HA ' ' A' ' 38' ' ' SER . 4.0 p . . . . . 0 CA--C 1.54 0.57 0 N-CA-C 108.986 -0.746 . . . . 0.0 108.986 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.348 0.528 0 N-CA-C 113.79 1.033 . . . . 0.0 113.79 -174.901 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.365 0 CA-C-O 121.302 0.573 . . . . 0.0 110.815 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -62.03 -39.47 92.43 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.366 -0.834 . . . . 0.0 111.062 -178.837 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 12.9 p -67.65 -28.19 40.92 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 C-N-CA 119.296 -0.962 . . . . 0.0 110.882 -178.994 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 58.3 t -61.13 -45.28 98.88 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.908 0 N-CA-C 108.491 -0.929 . . . . 0.0 108.491 179.402 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 40.2 ttpt -65.32 -39.94 93.08 Favored 'General case' 0 CA--C 1.541 0.606 0 N-CA-C 115.07 1.507 . . . . 0.0 115.07 -179.56 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 27.2 m -76.8 -51.09 19.78 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.298 0 N-CA-C 114.208 1.188 . . . . 0.0 114.208 -177.224 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . 0.422 ' HB ' ' CD1' ' A' ' 56' ' ' TYR . 79.6 t -64.22 -44.87 97.5 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.748 0 N-CA-C 112.057 0.391 . . . . 0.0 112.057 -177.887 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 97.3 mt-10 -64.6 -40.18 95.06 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 112.911 0.708 . . . . 0.0 112.911 -179.682 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 47.8 t -65.84 -47.76 73.9 Favored 'General case' 0 N--CA 1.463 0.205 0 C-N-CA 120.209 -0.596 . . . . 0.0 110.212 178.878 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -65.28 -37.51 87.4 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.206 -0.906 . . . . 0.0 110.068 178.598 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -58.1 -43.89 87.34 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 -177.845 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 88.9 tt0 -61.63 -43.91 97.98 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 114.657 -1.156 . . . . 0.0 109.596 179.74 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 53.8 tp -65.88 -37.92 87.42 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.676 -0.693 . . . . 0.0 112.389 -179.646 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 83.7 t80 -67.52 -39.46 85.1 Favored 'General case' 0 CA--C 1.509 -0.609 0 N-CA-C 106.942 -1.503 . . . . 0.0 106.942 178.896 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . 0.422 ' O ' ' N ' ' A' ' 33' ' ' THR . 94.4 mt-10 -61.94 -37.92 86.54 Favored 'General case' 0 N--CA 1.443 -0.803 0 N-CA-C 108.272 -1.01 . . . . 0.0 108.272 176.966 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 65.6 tp -63.49 -46.39 86.36 Favored 'General case' 0 N--CA 1.442 -0.872 0 N-CA-C 107.137 -1.431 . . . . 0.0 107.137 177.303 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 24.7 ttmm -50.46 -49.35 55.37 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-N 114.449 -1.25 . . . . 0.0 111.94 178.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 99.2 m-20 -108.52 -57.33 2.14 Favored 'General case' 0 N--CA 1.479 1.003 0 N-CA-C 113.515 0.931 . . . . 0.0 113.515 -177.824 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' THR . . . . . 0.422 ' N ' ' O ' ' A' ' 29' ' ' GLU . 0.4 OUTLIER 80.79 -41.41 0.18 Allowed 'General case' 0 N--CA 1.471 0.616 0 O-C-N 123.793 0.683 . . . . 0.0 111.999 179.859 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 65.2 t30 -60.75 -39.26 88.07 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.558 -0.457 . . . . 0.0 109.961 179.666 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 16.8 pm0 -117.51 162.32 18.17 Favored 'General case' 0 CA--C 1.513 -0.464 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.62 178.847 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -99.73 136.27 39.9 Favored 'General case' 0 N--CA 1.431 -1.397 0 N-CA-C 108.43 -0.952 . . . . 0.0 108.43 177.613 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -49.44 160.53 0.25 Allowed 'General case' 0 C--N 1.311 -1.107 0 CA-C-N 115.265 -0.879 . . . . 0.0 109.183 -179.687 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 84.7 p -146.84 169.14 19.73 Favored 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 108.735 -0.839 . . . . 0.0 108.735 179.678 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.428 ' O ' ' HB ' ' A' ' 43' ' ' VAL . 86.5 mt -60.53 -39.78 89.1 Favored 'General case' 0 C--N 1.314 -0.946 0 C-N-CA 118.508 -1.277 . . . . 0.0 108.414 179.672 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 75.4 m -64.6 -40.72 96.01 Favored 'General case' 0 C--N 1.319 -0.734 0 C-N-CA 120.459 -0.497 . . . . 0.0 111.948 178.621 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -74.86 -54.16 7.78 Favored 'General case' 0 N--CA 1.472 0.67 0 N-CA-C 114.232 1.197 . . . . 0.0 114.232 -177.389 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 87.6 mt -59.79 -34.83 73.54 Favored 'General case' 0 CA--C 1.485 -1.533 0 N-CA-C 108.549 -0.908 . . . . 0.0 108.549 -175.853 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . 0.428 ' HB ' ' O ' ' A' ' 39' ' ' LEU . 0.3 OUTLIER -80.99 -28.8 11.19 Favored 'Isoleucine or valine' 0 N--CA 1.405 -2.679 0 CA-C-N 114.051 -1.431 . . . . 0.0 112.136 -176.852 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' SER . . . . . 0.538 ' C ' ' H ' ' A' ' 46' ' ' GLY . 48.0 t -63.11 -49.93 72.5 Favored 'General case' 0 N--CA 1.428 -1.546 0 N-CA-C 103.922 -2.622 . . . . 0.0 103.922 176.337 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' SER . . . . . 0.455 ' O ' ' N ' ' A' ' 47' ' ' ASN . 63.0 m -51.49 -1.16 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.914 0 CA-C-N 112.278 -2.237 . . . . 0.0 112.744 171.362 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . 0.538 ' H ' ' C ' ' A' ' 44' ' ' SER . . . 29.27 28.36 0.01 OUTLIER Glycine 0 C--N 1.343 0.969 0 C-N-CA 126.082 1.801 . . . . 0.0 115.174 -172.834 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . 0.455 ' N ' ' O ' ' A' ' 45' ' ' SER . 39.7 t-20 -61.62 -42.52 98.99 Favored 'General case' 0 CA--C 1.512 -0.491 0 N-CA-C 104.225 -2.509 . . . . 0.0 104.225 175.571 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 16.3 pt -118.22 136.02 56.73 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.023 0 CA-C-N 111.695 -2.502 . . . . 0.0 107.791 176.443 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' SER . . . . . 0.413 ' C ' ' H ' ' A' ' 51' ' ' LYS . 84.6 p -79.94 159.87 26.17 Favored 'General case' 0 C--N 1.317 -0.829 0 C-N-CA 119.666 -0.814 . . . . 0.0 110.45 -179.337 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 60.7 tp60 -57.86 -8.16 0.9 Allowed 'General case' 0 CA--C 1.546 0.79 0 CA-C-N 115.95 -0.568 . . . . 0.0 112.023 -179.69 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . 0.413 ' H ' ' C ' ' A' ' 49' ' ' SER . 10.9 ptmt -78.83 -43.87 24.26 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 103.956 -2.609 . . . . 0.0 103.956 176.491 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 3.7 mt-30 -68.37 -47.6 66.98 Favored 'General case' 0 N--CA 1.429 -1.49 0 CA-C-N 112.724 -2.034 . . . . 0.0 108.411 176.315 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -63.78 -43.7 95.56 Favored 'General case' 0 C--N 1.343 0.284 0 C-N-CA 119.412 -0.915 . . . . 0.0 111.309 -178.384 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 98.0 m-20 -62.37 -29.31 70.38 Favored 'General case' 0 C--N 1.319 -0.756 0 C-N-CA 120.22 -0.592 . . . . 0.0 110.641 178.906 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 47.5 t -64.47 -39.22 93.4 Favored 'General case' 0 N--CA 1.44 -0.939 0 CA-C-N 115.452 -0.795 . . . . 0.0 110.659 178.211 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' TYR . . . . . 0.422 ' CD1' ' HB ' ' A' ' 21' ' ' VAL . 0.4 OUTLIER -72.62 -40.22 66.62 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 118.886 -1.126 . . . . 0.0 111.606 -178.515 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -57.68 -28.83 64.13 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 107.275 -1.38 . . . . 0.0 107.275 176.334 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -66.63 -39.67 88.4 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 112.606 -2.088 . . . . 0.0 109.694 175.937 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 89.9 t80 . . . . . 0 N--CA 1.47 0.575 0 CA-C-O 121.113 0.482 . . . . 0.0 110.754 177.211 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.468 0.426 0 N-CA-C 108.621 -0.881 . . . . 0.0 108.621 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.431 -1.382 0 C-N-CA 120.646 -0.422 . . . . 0.0 110.478 177.977 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.446 -0.643 0 CA-C-O 121.739 0.78 . . . . 0.0 109.641 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -62.14 -39.8 93.83 Favored 'General case' 0 N--CA 1.444 -0.73 0 CA-C-N 114.846 -1.07 . . . . 0.0 110.535 -179.274 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 11.8 p -62.66 -31.99 54.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 C-N-CA 117.873 -1.531 . . . . 0.0 110.646 -178.879 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 62.9 t -60.08 -46.4 94.39 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.743 0 N-CA-C 108.764 -0.828 . . . . 0.0 108.764 -179.084 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 40.2 ttpt -63.66 -38.38 90.91 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 115.043 1.497 . . . . 0.0 115.043 -179.612 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 27.0 m -78.25 -54.38 12.31 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.306 0 N-CA-C 113.835 1.05 . . . . 0.0 113.835 -177.214 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 62.3 t -62.13 -43.75 98.18 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.764 0 C-N-CA 119.705 -0.798 . . . . 0.0 111.163 -178.274 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -65.27 -32.25 73.82 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 112.821 0.674 . . . . 0.0 112.821 -179.417 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 87.5 p -75.88 -47.64 24.63 Favored 'General case' 0 C--O 1.231 0.107 0 C-N-CA 119.671 -0.811 . . . . 0.0 111.744 179.306 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 17.4 mp0 -72.07 -39.38 69.05 Favored 'General case' 0 C--O 1.22 -0.467 0 N-CA-C 112.183 0.438 . . . . 0.0 112.183 178.597 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -58.7 -41.46 86.36 Favored 'General case' 0 CA--C 1.512 -0.501 0 CA-C-O 121.422 0.629 . . . . 0.0 109.359 -177.321 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 54.0 tp10 -60.5 -46.66 89.29 Favored 'General case' 0 C--N 1.318 -0.775 0 N-CA-C 107.595 -1.261 . . . . 0.0 107.595 178.837 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 57.7 tp -64.23 -39.58 94.26 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.444 -0.798 . . . . 0.0 112.539 -179.086 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 73.2 t80 -62.44 -44.08 97.28 Favored 'General case' 0 CA--C 1.505 -0.77 0 N-CA-C 106.4 -1.704 . . . . 0.0 106.4 179.305 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 93.3 mt-10 -60.25 -37.74 81.31 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 114.818 -1.083 . . . . 0.0 108.939 178.627 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 66.5 tp -61.88 -47.98 82.56 Favored 'General case' 0 N--CA 1.435 -1.175 0 C-N-CA 117.975 -1.49 . . . . 0.0 107.153 177.908 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -50.54 -50.75 52.52 Favored 'General case' 0 CA--C 1.519 -0.229 0 CA-C-N 115.543 -0.753 . . . . 0.0 109.473 177.529 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 82.2 m-20 -129.41 109.08 10.78 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 114.621 -1.172 . . . . 0.0 110.116 179.256 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 10.2 t -94.16 -15.64 24.45 Favored 'General case' 0 C--N 1.324 -0.529 0 C-N-CA 120.645 -0.422 . . . . 0.0 111.864 -179.149 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 28.6 m120 -60.81 -39.67 89.81 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.116 0.484 . . . . 0.0 109.831 -179.598 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 95.0 mt-10 -124.22 150.66 45.02 Favored 'General case' 0 CA--C 1.507 -0.699 0 N-CA-C 108.581 -0.896 . . . . 0.0 108.581 179.189 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 49.4 mmtm -89.03 137.82 31.97 Favored 'General case' 0 N--CA 1.43 -1.457 0 C-N-CA 118.567 -1.253 . . . . 0.0 108.906 178.122 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -49.46 179.77 0.01 OUTLIER 'General case' 0 C--N 1.314 -0.964 0 CA-C-N 114.873 -1.058 . . . . 0.0 110.643 -179.949 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 76.4 p -153.04 170.66 19.91 Favored 'General case' 0 C--N 1.315 -0.929 0 N-CA-C 108.546 -0.909 . . . . 0.0 108.546 178.419 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 87.7 mt -60.84 -43.08 98.77 Favored 'General case' 0 C--N 1.312 -1.047 0 N-CA-C 107.748 -1.204 . . . . 0.0 107.748 179.689 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 74.7 m -63.08 -40.44 97.68 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.488 -0.778 . . . . 0.0 112.298 179.562 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -63.55 -48.72 76.34 Favored 'General case' 0 N--CA 1.47 0.567 0 N-CA-C 113.43 0.9 . . . . 0.0 113.43 -177.988 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 92.3 mt -60.98 -35.32 76.49 Favored 'General case' 0 CA--C 1.494 -1.186 0 N-CA-C 107.405 -1.331 . . . . 0.0 107.405 -177.757 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . 0.504 HG21 ' HA ' ' A' ' 50' ' ' GLN . 1.7 t -76.25 -31.73 21.47 Favored 'Isoleucine or valine' 0 N--CA 1.419 -2.017 0 CA-C-N 113.997 -1.456 . . . . 0.0 111.302 -178.952 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' SER . . . . . 0.501 ' C ' ' H ' ' A' ' 46' ' ' GLY . 75.0 m -62.34 -51.28 68.26 Favored 'General case' 0 N--CA 1.431 -1.402 0 N-CA-C 104.905 -2.258 . . . . 0.0 104.905 177.398 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' SER . . . . . 0.414 ' O ' ' N ' ' A' ' 47' ' ' ASN . 69.9 m -51.75 -4.36 0.02 OUTLIER 'General case' 0 CA--C 1.549 0.929 0 CA-C-N 113.23 -1.804 . . . . 0.0 112.151 170.644 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . 0.501 ' H ' ' C ' ' A' ' 44' ' ' SER . . . 28.75 34.64 0.01 OUTLIER Glycine 0 C--N 1.346 1.106 0 C-N-CA 126.034 1.778 . . . . 0.0 113.6 -172.68 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . 0.414 ' N ' ' O ' ' A' ' 45' ' ' SER . 57.0 t-20 -63.85 -44.7 92.38 Favored 'General case' 0 CA--C 1.513 -0.462 0 N-CA-C 106.113 -1.81 . . . . 0.0 106.113 176.152 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 1.2 pp -117.47 160.8 16.75 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.936 0 CA-C-N 111.329 -2.669 . . . . 0.0 108.649 179.829 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 88.6 p -77.73 170.99 15.64 Favored 'General case' 0 N--CA 1.446 -0.65 0 CA-C-O 121.583 0.706 . . . . 0.0 112.089 -178.401 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.504 ' HA ' HG21 ' A' ' 43' ' ' VAL . 3.9 tm0? -57.24 -50.1 73.94 Favored 'General case' 0 N--CA 1.437 -1.121 0 CA-C-N 115.084 -0.962 . . . . 0.0 110.347 -179.782 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . 0.438 ' O ' ' N ' ' A' ' 55' ' ' SER . 64.1 pttt -61.13 -25.9 67.31 Favored 'General case' 0 CA--C 1.479 -1.779 0 O-C-N 120.836 -1.165 . . . . 0.0 110.09 -178.218 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 3.2 tm0? -64.96 -38.14 89.98 Favored 'General case' 0 N--CA 1.423 -1.806 0 N-CA-C 105.146 -2.168 . . . . 0.0 105.146 176.186 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . 0.417 ' HB1' ' O ' ' A' ' 50' ' ' GLN . . . -66.07 -49.04 69.02 Favored 'General case' 0 C--N 1.349 0.559 0 C-N-CA 118.09 -1.444 . . . . 0.0 110.786 176.522 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 96.2 m-20 -76.0 -13.97 60.23 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 118.986 -1.085 . . . . 0.0 113.628 -178.782 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' SER . . . . . 0.438 ' N ' ' O ' ' A' ' 51' ' ' LYS . 48.8 m -68.27 -38.77 82.07 Favored 'General case' 0 C--N 1.31 -1.13 0 N-CA-C 109.736 -0.468 . . . . 0.0 109.736 179.162 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -73.63 -37.22 65.42 Favored 'General case' 0 N--CA 1.465 0.295 0 C-N-CA 117.654 -1.618 . . . . 0.0 108.372 179.603 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -57.96 -30.34 65.93 Favored 'General case' 0 C--O 1.221 -0.439 0 N-CA-C 107.021 -1.474 . . . . 0.0 107.021 175.894 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -65.48 -38.79 90.79 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 112.431 -2.168 . . . . 0.0 109.37 176.506 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 83.8 t80 . . . . . 0 C--N 1.344 0.33 0 CA-C-O 121.564 0.697 . . . . 0.0 109.325 176.699 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 2.5 p . . . . . 0 C--O 1.217 -0.608 0 N-CA-C 108.708 -0.849 . . . . 0.0 108.708 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.342 0 C-N-CA 119.455 -0.898 . . . . 0.0 113.42 -176.216 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.236 0.372 0 CA-C-O 122.57 1.176 . . . . 0.0 108.549 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -60.61 -36.09 77.73 Favored 'General case' 0 N--CA 1.443 -0.809 0 CA-C-N 113.48 -1.691 . . . . 0.0 109.838 179.515 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -53.24 -29.72 16.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 C-N-CA 119.827 -0.749 . . . . 0.0 110.195 -178.119 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 53.1 t -70.03 -44.0 78.73 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 N-CA-C 108.745 -0.835 . . . . 0.0 108.745 177.134 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 29.5 tptp -63.57 -44.38 94.24 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 114.58 -1.191 . . . . 0.0 113.551 -179.389 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 34.0 m -66.99 -43.02 89.38 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.181 0 N-CA-C 112.756 0.65 . . . . 0.0 112.756 -176.993 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 53.2 t -62.46 -47.2 94.14 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 C-N-CA 118.82 -1.152 . . . . 0.0 110.999 -179.293 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 79.7 mm-40 -66.02 -39.85 90.56 Favored 'General case' 0 C--N 1.332 -0.192 0 N-CA-C 112.091 0.404 . . . . 0.0 112.091 -179.935 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 48.4 t -63.93 -48.35 76.9 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-O 121.95 0.881 . . . . 0.0 108.887 178.553 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 72.0 tp60 -61.87 -39.28 91.35 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 113.962 -1.472 . . . . 0.0 109.78 179.653 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -57.78 -49.98 74.79 Favored 'General case' 0 N--CA 1.447 -0.61 0 N-CA-C 108.277 -1.009 . . . . 0.0 108.277 -178.133 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 88.8 tt0 -65.35 -39.25 92.12 Favored 'General case' 0 CA--C 1.51 -0.565 0 CA-C-N 115.903 -0.59 . . . . 0.0 111.359 179.687 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 61.8 tp -61.39 -42.19 98.32 Favored 'General case' 0 N--CA 1.447 -0.588 0 C-N-CA 119.332 -0.947 . . . . 0.0 108.778 -179.789 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 89.8 t80 -60.99 -43.7 98.47 Favored 'General case' 0 N--CA 1.44 -0.946 0 N-CA-C 107.043 -1.466 . . . . 0.0 107.043 178.47 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -61.18 -31.21 70.96 Favored 'General case' 0 N--CA 1.446 -0.649 0 N-CA-C 109.875 -0.417 . . . . 0.0 109.875 178.618 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 67.0 tp -64.63 -48.72 73.81 Favored 'General case' 0 N--CA 1.44 -0.963 0 N-CA-C 106.302 -1.74 . . . . 0.0 106.302 176.91 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 64.5 tttp -51.58 -50.77 59.5 Favored 'General case' 0 CA--C 1.52 -0.185 0 CA-C-N 115.046 -0.979 . . . . 0.0 109.263 177.396 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 98.6 m-20 -129.78 98.96 4.96 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 114.499 -1.228 . . . . 0.0 110.055 179.444 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 12.7 t -76.9 -14.74 59.84 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 112.258 0.466 . . . . 0.0 112.258 -178.926 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 98.9 m-20 -61.3 -43.09 99.46 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 120.559 -0.456 . . . . 0.0 111.836 -178.175 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 99.2 mt-10 -108.1 -173.59 2.32 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.685 0.279 . . . . 0.0 111.112 -178.574 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 14.4 mptt -121.03 120.82 36.5 Favored 'General case' 0 N--CA 1.444 -0.752 0 N-CA-C 107.575 -1.268 . . . . 0.0 107.575 177.332 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -54.9 149.8 11.0 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-O 121.073 0.464 . . . . 0.0 111.42 -177.729 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 89.1 p -137.03 159.18 42.64 Favored 'General case' 0 N--CA 1.444 -0.763 0 CA-C-N 115.079 -0.964 . . . . 0.0 109.766 -179.645 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.445 HD12 ' O ' ' A' ' 53' ' ' ALA . 2.0 tt -52.3 -48.32 65.43 Favored 'General case' 0 C--N 1.311 -1.082 0 CA-C-N 115.248 -0.887 . . . . 0.0 110.296 -178.38 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 47.9 t -62.54 -42.92 99.84 Favored 'General case' 0 C--N 1.313 -0.981 0 CA-C-N 115.243 -0.89 . . . . 0.0 110.61 179.456 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 29.1 mtpp -65.52 -49.91 67.21 Favored 'General case' 0 CA--C 1.513 -0.473 0 N-CA-C 114.052 1.13 . . . . 0.0 114.052 -177.777 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 98.0 mt -61.1 -40.03 92.2 Favored 'General case' 0 CA--C 1.485 -1.549 0 CA-C-O 122.499 1.142 . . . . 0.0 108.08 -176.298 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -72.27 -45.37 61.54 Favored 'Isoleucine or valine' 0 N--CA 1.402 -2.862 0 CA-C-N 112.302 -2.226 . . . . 0.0 111.038 -172.48 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' SER . . . . . 0.52 ' C ' ' H ' ' A' ' 46' ' ' GLY . 46.7 t -61.25 -47.83 84.22 Favored 'General case' 0 N--CA 1.419 -2.023 0 C-N-CA 116.101 -2.239 . . . . 0.0 105.993 177.574 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' SER . . . . . 0.416 ' O ' ' N ' ' A' ' 47' ' ' ASN . 33.4 t -49.91 6.75 0.0 OUTLIER 'General case' 0 N--CA 1.479 1.023 0 CA-C-N 113.844 -1.526 . . . . 0.0 114.47 173.148 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . 0.52 ' H ' ' C ' ' A' ' 44' ' ' SER . . . 28.83 37.4 0.01 OUTLIER Glycine 0 C--N 1.346 1.136 0 C-N-CA 124.479 1.037 . . . . 0.0 113.428 -173.437 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . 0.416 ' N ' ' O ' ' A' ' 45' ' ' SER . 21.6 m120 -66.72 -38.78 87.39 Favored 'General case' 0 CA--C 1.512 -0.493 0 N-CA-C 106.724 -1.584 . . . . 0.0 106.724 173.339 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 11.2 pt -137.09 -166.5 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.44 -0.967 0 CA-C-N 112.259 -2.246 . . . . 0.0 107.251 179.302 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' SER . . . . . 0.406 ' C ' ' H ' ' A' ' 51' ' ' LYS . 84.8 p -127.99 148.73 50.54 Favored 'General case' 0 C--N 1.321 -0.631 0 C-N-CA 119.986 -0.686 . . . . 0.0 110.639 178.938 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 9.3 mt-30 -54.11 0.47 0.02 OUTLIER 'General case' 0 C--O 1.214 -0.768 0 N-CA-C 114.577 1.325 . . . . 0.0 114.577 -177.133 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . 0.413 ' CG ' ' N ' ' A' ' 52' ' ' GLN . 62.8 pttt -77.06 -41.74 41.13 Favored 'General case' 0 C--N 1.313 -1.008 0 N-CA-C 103.679 -2.712 . . . . 0.0 103.679 175.934 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . 0.413 ' N ' ' CG ' ' A' ' 51' ' ' LYS . 11.3 mt-30 -71.2 -53.43 14.44 Favored 'General case' 0 N--CA 1.423 -1.823 0 CA-C-N 111.891 -2.413 . . . . 0.0 107.829 176.312 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . 0.445 ' O ' HD12 ' A' ' 39' ' ' LEU . . . -62.66 -40.73 97.99 Favored 'General case' 0 C--O 1.216 -0.678 0 N-CA-C 112.962 0.727 . . . . 0.0 112.962 -177.088 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -62.54 -39.53 93.92 Favored 'General case' 0 C--N 1.311 -1.106 0 C-N-CA 118.709 -1.197 . . . . 0.0 113.319 -178.651 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 75.8 m -65.44 -42.04 92.81 Favored 'General case' 0 C--N 1.316 -0.888 0 C-N-CA 118.987 -1.085 . . . . 0.0 110.555 179.575 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 3.1 t80 -72.65 -30.41 64.26 Favored 'General case' 0 C--N 1.334 -0.102 0 C-N-CA 118.988 -1.085 . . . . 0.0 109.405 -179.058 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -61.21 -37.24 82.3 Favored 'General case' 0 CA--C 1.501 -0.925 0 N-CA-C 108.186 -1.042 . . . . 0.0 108.186 177.59 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -65.86 -20.27 66.17 Favored 'General case' 0 N--CA 1.434 -1.24 0 CA-C-N 114.558 -1.201 . . . . 0.0 109.714 178.463 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 88.4 t80 . . . . . 0 CA--C 1.531 0.22 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 176.083 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 13.4 m . . . . . 0 N--CA 1.469 0.517 0 CA-C-O 119.914 -0.089 . . . . 0.0 111.212 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.437 -1.088 0 C-N-CA 119.108 -1.037 . . . . 0.0 112.444 -176.438 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.453 -0.28 0 CA-C-O 122.044 0.926 . . . . 0.0 108.744 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -60.32 -37.3 80.17 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-N 114.32 -1.309 . . . . 0.0 110.036 179.894 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -54.09 -31.75 21.99 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 C-N-CA 119.296 -0.962 . . . . 0.0 109.599 -178.275 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 66.1 t -64.11 -46.88 92.42 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 N-CA-C 107.699 -1.222 . . . . 0.0 107.699 177.641 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 41.0 ttmt -60.37 -44.39 95.64 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-N 114.064 -1.426 . . . . 0.0 113.482 -177.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 28.5 m -68.14 -49.7 65.16 Favored 'Isoleucine or valine' 0 N--CA 1.46 0.055 0 CA-C-N 118.833 0.742 . . . . 0.0 111.827 -178.59 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 54.0 t -61.23 -47.78 91.94 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.851 0 C-N-CA 119.846 -0.742 . . . . 0.0 111.529 -177.954 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -68.46 -29.83 68.56 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 112.605 0.595 . . . . 0.0 112.605 -179.247 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 70.9 m -73.45 -50.79 19.82 Favored 'General case' 0 N--CA 1.464 0.249 0 C-N-CA 119.771 -0.771 . . . . 0.0 109.351 177.732 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 99.8 mm-40 -65.04 -37.7 88.43 Favored 'General case' 0 C--O 1.217 -0.649 0 CA-C-N 114.648 -1.16 . . . . 0.0 109.595 179.953 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -55.37 -44.95 76.52 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 108.126 -1.064 . . . . 0.0 108.126 -177.872 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 88.9 tt0 -66.61 -38.45 87.0 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.451 -0.795 . . . . 0.0 110.803 178.364 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 66.5 tp -63.75 -45.82 88.14 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.17 -0.923 . . . . 0.0 109.937 179.392 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 38.8 t80 -65.94 -40.05 91.01 Favored 'General case' 0 N--CA 1.441 -0.917 0 N-CA-C 107.261 -1.385 . . . . 0.0 107.261 -178.919 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 95.6 mt-10 -72.91 -10.85 60.25 Favored 'General case' 0 N--CA 1.441 -0.884 0 CA-C-N 115.083 -0.962 . . . . 0.0 110.287 177.432 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 62.7 tp -69.15 -48.22 62.92 Favored 'General case' 0 N--CA 1.437 -1.103 0 N-CA-C 104.25 -2.5 . . . . 0.0 104.25 174.843 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 64.9 tttp -51.5 -48.44 62.91 Favored 'General case' 0 CA--C 1.509 -0.629 0 CA-C-N 113.519 -1.673 . . . . 0.0 108.164 176.174 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 98.7 m-20 -128.6 94.56 3.9 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-N 114.492 -1.231 . . . . 0.0 110.738 -179.969 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 68.8 p -83.51 -15.37 49.62 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 120.882 -0.327 . . . . 0.0 111.429 -179.308 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 98.5 m-20 -95.01 4.03 54.24 Favored 'General case' 0 C--N 1.33 -0.248 0 C-N-CA 120.83 -0.348 . . . . 0.0 110.746 179.499 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 94.1 mt-10 -134.33 157.89 45.21 Favored 'General case' 0 CA--C 1.509 -0.599 0 N-CA-C 109.329 -0.619 . . . . 0.0 109.329 179.925 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 14.7 mptt -100.09 137.82 38.0 Favored 'General case' 0 N--CA 1.437 -1.104 0 N-CA-C 106.859 -1.534 . . . . 0.0 106.859 176.129 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . 0.437 ' C ' ' CG2' ' A' ' 70' ' ' VAL . . . -85.98 -156.06 0.27 Allowed 'General case' 0 C--N 1.316 -0.85 0 N-CA-C 107.724 -1.213 . . . . 0.0 107.724 177.73 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 79.0 p -160.91 168.92 23.66 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 175.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.407 HD23 ' HB3' ' A' ' 56' ' ' TYR . 72.7 mt -59.88 -46.8 88.18 Favored 'General case' 0 C--N 1.316 -0.885 0 C-N-CA 119.374 -0.93 . . . . 0.0 109.541 179.727 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 91.9 p -60.38 -34.42 73.87 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 120.431 -0.507 . . . . 0.0 109.682 179.858 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -69.33 -36.77 77.26 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-O 121.078 0.465 . . . . 0.0 111.014 178.274 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 87.2 mt -69.25 -35.86 76.55 Favored 'General case' 0 CA--C 1.496 -1.102 0 CA-C-N 115.47 -0.787 . . . . 0.0 109.267 179.896 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -80.27 -34.96 15.18 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.713 0 C-N-CA 119.264 -0.974 . . . . 0.0 110.908 -176.641 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' SER . . . . . 0.546 ' C ' ' H ' ' A' ' 46' ' ' GLY . 47.9 t -59.24 -51.15 71.22 Favored 'General case' 0 N--CA 1.431 -1.39 0 N-CA-C 104.635 -2.357 . . . . 0.0 104.635 179.691 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' SER . . . . . 0.433 ' O ' ' N ' ' A' ' 47' ' ' ASN . 24.7 p -54.41 12.65 0.0 OUTLIER 'General case' 0 CA--C 1.558 1.264 0 CA-C-N 113.926 -1.488 . . . . 0.0 113.677 170.429 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . 0.546 ' H ' ' C ' ' A' ' 44' ' ' SER . . . 28.59 33.78 0.01 OUTLIER Glycine 0 C--N 1.347 1.171 0 C-N-CA 125.201 1.382 . . . . 0.0 114.486 -173.161 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . 0.433 ' N ' ' O ' ' A' ' 45' ' ' SER . 19.1 m120 -66.95 -40.82 87.62 Favored 'General case' 0 CA--C 1.52 -0.186 0 CA-C-O 122.329 1.062 . . . . 0.0 109.138 174.519 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 23.4 pt -137.37 164.76 28.63 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-N 113.098 -1.865 . . . . 0.0 111.716 -177.447 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 67.6 m -76.48 155.75 33.57 Favored 'General case' 0 N--CA 1.439 -0.983 0 N-CA-C 107.524 -1.287 . . . . 0.0 107.524 178.192 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 71.5 tp60 -56.88 -46.4 81.91 Favored 'General case' 0 C--O 1.202 -1.401 0 C-N-CA 119.697 -0.801 . . . . 0.0 109.801 -179.163 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 21.9 pttp -64.11 -30.93 71.96 Favored 'General case' 0 CA--C 1.501 -0.939 0 CA-C-N 119.089 0.858 . . . . 0.0 110.709 -179.248 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 33.5 tt0 -66.5 -38.14 86.59 Favored 'General case' 0 N--CA 1.421 -1.875 0 N-CA-C 103.639 -2.726 . . . . 0.0 103.639 177.437 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -65.96 -51.84 54.91 Favored 'General case' 0 N--CA 1.443 -0.777 0 CA-C-N 114.413 -1.267 . . . . 0.0 110.315 177.822 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 98.2 m-20 -58.11 -47.0 84.59 Favored 'General case' 0 CA--C 1.504 -0.805 0 C-N-CA 120.291 -0.563 . . . . 0.0 112.119 -177.172 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 74.2 m -53.8 -36.06 62.06 Favored 'General case' 0 N--CA 1.436 -1.172 0 C-N-CA 119.312 -0.955 . . . . 0.0 110.724 -177.282 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' TYR . . . . . 0.407 ' HB3' HD23 ' A' ' 39' ' ' LEU . 8.3 t80 -70.16 -41.51 73.73 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 116.996 -1.882 . . . . 0.0 109.052 176.984 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -47.92 -44.39 29.81 Favored 'General case' 0 CA--C 1.498 -1.042 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.22 -175.912 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -59.64 -51.28 70.5 Favored 'General case' 0 N--CA 1.434 -1.234 0 N-CA-C 106.959 -1.497 . . . . 0.0 106.959 179.432 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 91.9 t80 . . . . . 0 N--CA 1.466 0.356 0 N-CA-C 109.583 -0.525 . . . . 0.0 109.583 -177.236 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . 0.437 ' CG2' ' C ' ' A' ' 37' ' ' ALA . 7.4 p . . . . . 0 N--CA 1.446 -0.642 0 CA-C-O 121.404 0.621 . . . . 0.0 111.68 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.234 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.532 -178.446 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.235 0.337 0 CA-C-O 122.047 0.927 . . . . 0.0 110.97 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -59.93 -37.18 78.76 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 114.305 -1.316 . . . . 0.0 110.28 -178.419 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 2.6 p -53.28 -35.64 24.46 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 C-N-CA 119.34 -0.944 . . . . 0.0 109.919 -178.076 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 61.4 t -63.63 -48.48 86.57 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-O 121.635 0.731 . . . . 0.0 109.207 178.936 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -61.93 -43.77 98.16 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 114.637 -1.165 . . . . 0.0 113.587 -178.7 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 28.5 m -71.95 -54.11 17.87 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.186 0 C-N-CA 119.949 -0.7 . . . . 0.0 112.621 -178.321 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 53.2 t -61.1 -45.32 98.8 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.666 0 C-N-CA 119.398 -0.921 . . . . 0.0 111.975 -177.38 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -61.72 -51.64 67.57 Favored 'General case' 0 C--N 1.331 -0.207 0 C-N-CA 118.557 -1.257 . . . . 0.0 109.973 -179.892 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 48.4 t -58.54 -48.73 79.9 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 120.26 -0.576 . . . . 0.0 110.801 -176.771 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 28.3 mm100 -63.97 -40.38 96.26 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.647 0.737 . . . . 0.0 109.186 179.536 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -57.47 -42.76 83.24 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 114.608 -1.178 . . . . 0.0 110.484 -177.133 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 54.0 tp10 -65.24 -39.12 92.28 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.935 0.874 . . . . 0.0 109.18 178.394 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 53.6 tp -62.2 -44.22 97.08 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 114.316 -1.311 . . . . 0.0 109.622 -179.844 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 55.3 t80 -62.26 -38.85 90.87 Favored 'General case' 0 CA--C 1.504 -0.81 0 N-CA-C 107.475 -1.306 . . . . 0.0 107.475 -179.142 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . 0.44 ' O ' ' N ' ' A' ' 33' ' ' THR . 96.4 mt-10 -59.43 -43.79 93.01 Favored 'General case' 0 N--CA 1.44 -0.926 0 N-CA-C 106.72 -1.585 . . . . 0.0 106.72 178.694 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 64.3 tp -62.46 -43.58 98.47 Favored 'General case' 0 N--CA 1.443 -0.805 0 C-N-CA 118.513 -1.275 . . . . 0.0 108.743 178.387 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -49.03 -49.11 42.75 Favored 'General case' 0 CA--C 1.519 -0.224 0 CA-C-N 115.345 -0.843 . . . . 0.0 110.513 179.759 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 32.5 m120 -109.44 -66.11 1.09 Allowed 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 120.066 -0.654 . . . . 0.0 112.396 -179.356 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' THR . . . . . 0.44 ' N ' ' O ' ' A' ' 29' ' ' GLU . 0.2 OUTLIER 79.28 -34.75 0.15 Allowed 'General case' 0 N--CA 1.471 0.582 0 O-C-N 123.653 0.595 . . . . 0.0 112.53 179.067 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 99.2 m-20 -61.07 -39.28 89.3 Favored 'General case' 0 C--N 1.332 -0.162 0 N-CA-C 108.636 -0.876 . . . . 0.0 108.636 179.41 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 9.6 mm-40 -117.84 153.94 32.65 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 114.748 -1.115 . . . . 0.0 108.122 178.579 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -87.61 129.76 35.0 Favored 'General case' 0 N--CA 1.435 -1.215 0 C-N-CA 118.57 -1.252 . . . . 0.0 109.802 179.962 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -45.59 143.02 2.08 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 114.02 -1.446 . . . . 0.0 109.083 -178.522 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 14.2 m -122.92 147.91 46.06 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 107.198 -1.408 . . . . 0.0 107.198 179.818 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 7.7 tt -54.72 -50.24 68.82 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 108.448 -0.945 . . . . 0.0 108.448 -177.708 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 74.1 m -59.42 -38.66 81.2 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 179.586 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 61.7 mtpt -65.85 -38.24 88.33 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 120.781 0.324 . . . . 0.0 111.864 178.714 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 88.5 mt -64.51 -38.73 92.02 Favored 'General case' 0 CA--C 1.485 -1.542 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 -178.025 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -81.93 -35.29 13.27 Favored 'Isoleucine or valine' 0 N--CA 1.417 -2.105 0 C-N-CA 118.956 -1.098 . . . . 0.0 110.92 -176.762 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' SER . . . . . 0.583 ' C ' ' H ' ' A' ' 46' ' ' GLY . 47.9 t -60.85 -50.87 71.69 Favored 'General case' 0 N--CA 1.43 -1.442 0 N-CA-C 105.353 -2.091 . . . . 0.0 105.353 178.583 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' SER . . . . . 0.452 ' O ' ' N ' ' A' ' 47' ' ' ASN . 89.6 p -54.08 9.5 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.125 0 CA-C-N 113.727 -1.579 . . . . 0.0 113.055 171.579 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . 0.583 ' H ' ' C ' ' A' ' 44' ' ' SER . . . 29.04 30.45 0.01 OUTLIER Glycine 0 C--N 1.343 0.964 0 C-N-CA 125.531 1.539 . . . . 0.0 114.613 -172.702 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . 0.452 ' N ' ' O ' ' A' ' 45' ' ' SER . 56.1 t30 -66.16 -42.66 88.67 Favored 'General case' 0 CA--C 1.517 -0.29 0 N-CA-C 104.874 -2.269 . . . . 0.0 104.874 175.193 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 36.2 pt -129.14 166.83 25.75 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.766 0 CA-C-N 111.619 -2.537 . . . . 0.0 107.902 177.922 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' SER . . . . . 0.597 ' C ' ' H ' ' A' ' 51' ' ' LYS . 67.6 m -119.5 156.5 30.14 Favored 'General case' 0 C--N 1.32 -0.702 0 C-N-CA 120.534 -0.466 . . . . 0.0 110.815 -179.151 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 12.6 tp60 -50.84 6.14 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.348 0 N-CA-C 114.743 1.386 . . . . 0.0 114.743 -179.536 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . 0.597 ' H ' ' C ' ' A' ' 49' ' ' SER . 71.9 mmtt -83.43 -52.99 6.04 Favored 'General case' 0 C--N 1.309 -1.183 0 N-CA-C 104.757 -2.312 . . . . 0.0 104.757 176.147 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 4.1 mt-30 -85.28 -29.22 24.76 Favored 'General case' 0 N--CA 1.431 -1.425 0 CA-C-N 110.989 -2.823 . . . . 0.0 110.333 178.105 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -65.17 -49.99 67.66 Favored 'General case' 0 N--CA 1.443 -0.801 0 C-N-CA 118.304 -1.358 . . . . 0.0 109.606 179.8 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 99.2 m-20 -60.9 -51.84 67.58 Favored 'General case' 0 CA--C 1.498 -1.038 0 C-N-CA 117.932 -1.507 . . . . 0.0 112.13 -178.152 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 67.2 m -56.67 -38.27 71.99 Favored 'General case' 0 N--CA 1.434 -1.269 0 C-N-CA 118.534 -1.267 . . . . 0.0 112.122 -175.62 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 22.9 t80 -72.21 -39.5 68.51 Favored 'General case' 0 CA--C 1.516 -0.355 0 C-N-CA 117.488 -1.685 . . . . 0.0 109.627 178.806 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 64.8 tttp -50.71 -40.27 53.66 Favored 'General case' 0 CA--C 1.493 -1.221 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.453 -176.348 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -59.13 -50.86 72.43 Favored 'General case' 0 N--CA 1.431 -1.391 0 N-CA-C 106.459 -1.682 . . . . 0.0 106.459 178.783 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 90.1 t80 . . . . . 0 N--CA 1.473 0.703 0 C-N-CA 120.02 -0.672 . . . . 0.0 110.14 -176.345 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.542 0.662 0 N-CA-C 107.269 -1.382 . . . . 0.0 107.269 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.463 0 O-C-N 121.014 -1.053 . . . . 0.0 113.327 -175.777 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.513 -0.463 0 CA-C-O 121.369 0.604 . . . . 0.0 111.517 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -61.92 -39.42 91.97 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 115.481 -0.782 . . . . 0.0 110.826 -178.87 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 14.1 p -67.8 -28.96 43.42 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 C-N-CA 118.98 -1.088 . . . . 0.0 111.113 -179.046 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 55.8 t -60.55 -44.61 97.0 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.821 0 N-CA-C 108.955 -0.758 . . . . 0.0 108.955 -179.236 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.1 tmmt? -65.44 -36.01 82.64 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 114.99 -1.005 . . . . 0.0 113.631 -179.685 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 33.0 m -82.96 -49.9 16.3 Favored 'Isoleucine or valine' 0 C--N 1.342 0.263 0 O-C-N 121.449 -0.782 . . . . 0.0 113.086 -178.527 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 59.3 t -63.1 -44.75 99.65 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 C-N-CA 120.309 -0.556 . . . . 0.0 111.258 -178.861 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 96.3 mt-10 -60.72 -42.48 97.35 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 119.884 -0.727 . . . . 0.0 111.467 -178.988 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 74.6 m -64.9 -42.74 94.49 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 119.542 -0.863 . . . . 0.0 110.816 179.349 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 97.9 mm-40 -68.97 -40.19 79.0 Favored 'General case' 0 CA--C 1.53 0.177 0 C-N-CA 120.467 -0.493 . . . . 0.0 110.757 -178.948 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . 0.41 ' O ' ' HG3' ' A' ' 29' ' ' GLU . . . -58.04 -41.49 83.39 Favored 'General case' 0 CA--C 1.502 -0.889 0 N-CA-C 108.61 -0.885 . . . . 0.0 108.61 -177.9 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 89.0 tt0 -59.79 -43.48 94.38 Favored 'General case' 0 C--N 1.31 -1.144 0 CA-C-N 114.084 -1.416 . . . . 0.0 108.354 179.088 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 60.2 tp -68.41 -39.15 81.72 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 113.162 0.801 . . . . 0.0 113.162 -179.651 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 94.1 t80 -63.51 -49.36 73.84 Favored 'General case' 0 CA--C 1.494 -1.21 0 N-CA-C 108.465 -0.939 . . . . 0.0 108.465 -179.561 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . 0.41 ' HG3' ' O ' ' A' ' 25' ' ' ALA . 2.6 pp20? -69.18 -23.21 63.9 Favored 'General case' 0 N--CA 1.428 -1.558 0 C-N-CA 118.997 -1.081 . . . . 0.0 109.022 178.235 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 64.3 tp -63.9 -49.05 74.22 Favored 'General case' 0 N--CA 1.44 -0.948 0 N-CA-C 105.828 -1.916 . . . . 0.0 105.828 177.803 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -51.01 -49.21 60.89 Favored 'General case' 0 CA--C 1.519 -0.239 0 CA-C-N 114.275 -1.33 . . . . 0.0 108.805 176.159 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 98.7 m-20 -127.24 106.96 9.59 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-N 114.828 -1.078 . . . . 0.0 109.967 179.507 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 76.6 p -90.3 -2.44 58.01 Favored 'General case' 0 C--N 1.324 -0.524 0 C-N-CA 120.287 -0.565 . . . . 0.0 112.307 -177.948 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 66.5 t30 -60.26 -38.22 82.84 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 108.451 -0.944 . . . . 0.0 108.451 179.385 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 21.0 pt-20 -139.88 157.56 45.51 Favored 'General case' 0 CA--C 1.506 -0.742 0 CA-C-N 114.664 -1.153 . . . . 0.0 111.259 179.053 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 30.4 mtpp -89.36 145.37 25.39 Favored 'General case' 0 N--CA 1.425 -1.696 0 C-N-CA 119.625 -0.83 . . . . 0.0 108.86 177.459 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -57.41 -178.97 0.04 OUTLIER 'General case' 0 C--N 1.297 -1.682 0 CA-C-N 114.202 -1.363 . . . . 0.0 109.157 179.354 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' SER . . . . . 0.429 ' OG ' ' HG3' ' A' ' 41' ' ' LYS . 59.7 p -154.41 168.31 27.08 Favored 'General case' 0 C--N 1.315 -0.892 0 C-N-CA 120.048 -0.661 . . . . 0.0 109.464 178.018 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 6.3 tt -57.62 -44.62 85.66 Favored 'General case' 0 C--N 1.31 -1.136 0 N-CA-C 107.658 -1.238 . . . . 0.0 107.658 -179.361 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 94.0 p -70.81 -37.08 73.22 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 115.187 -0.915 . . . . 0.0 113.033 178.616 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . 0.429 ' HG3' ' OG ' ' A' ' 38' ' ' SER . 97.9 mttt -69.69 -50.92 39.21 Favored 'General case' 0 N--CA 1.471 0.582 0 N-CA-C 113.278 0.844 . . . . 0.0 113.278 -177.914 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.534 ' HB3' HG12 ' A' ' 48' ' ' ILE . 89.9 mt -61.73 -38.05 86.5 Favored 'General case' 0 CA--C 1.482 -1.635 0 CA-C-O 122.225 1.012 . . . . 0.0 108.665 -176.129 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -81.44 -26.55 10.19 Favored 'Isoleucine or valine' 0 N--CA 1.404 -2.757 0 CA-C-N 113.316 -1.765 . . . . 0.0 112.285 -177.056 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' SER . . . . . 0.542 ' C ' ' H ' ' A' ' 46' ' ' GLY . 48.0 t -65.81 -50.42 64.71 Favored 'General case' 0 N--CA 1.422 -1.874 0 N-CA-C 102.963 -2.977 . . . . 0.0 102.963 175.294 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' SER . . . . . 0.496 ' O ' ' N ' ' A' ' 47' ' ' ASN . 60.3 m -51.97 2.53 0.01 OUTLIER 'General case' 0 CA--C 1.547 0.846 0 CA-C-N 111.443 -2.617 . . . . 0.0 113.214 170.902 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . 0.542 ' H ' ' C ' ' A' ' 44' ' ' SER . . . 28.89 21.21 0.0 OUTLIER Glycine 0 CA--C 1.536 1.346 0 C-N-CA 126.478 1.989 . . . . 0.0 116.389 -172.771 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . 0.496 ' N ' ' O ' ' A' ' 45' ' ' SER . 50.5 t30 -59.8 -55.25 36.52 Favored 'General case' 0 CA--C 1.507 -0.693 0 N-CA-C 104.602 -2.37 . . . . 0.0 104.602 177.74 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . 0.534 HG12 ' HB3' ' A' ' 42' ' ' LEU . 29.5 pt -92.95 146.72 6.04 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.242 0 N-CA-C 104.1 -2.555 . . . . 0.0 104.1 174.47 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' SER . . . . . 0.407 ' O ' ' N ' ' A' ' 52' ' ' GLN . 68.2 m -98.82 163.22 12.71 Favored 'General case' 0 C--N 1.311 -1.091 0 C-N-CA 119.309 -0.956 . . . . 0.0 110.903 -178.177 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 63.3 tp60 -50.22 -15.24 0.21 Allowed 'General case' 0 C--N 1.308 -1.21 0 CA-C-N 114.569 -1.196 . . . . 0.0 112.041 -177.479 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 26.0 pttm -81.62 -36.17 29.21 Favored 'General case' 0 CA--C 1.516 -0.351 0 N-CA-C 107.201 -1.407 . . . . 0.0 107.201 177.618 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . 0.407 ' N ' ' O ' ' A' ' 49' ' ' SER . 16.2 mt-30 -79.14 -23.34 44.06 Favored 'General case' 0 N--CA 1.439 -0.979 0 CA-C-N 113.047 -1.888 . . . . 0.0 109.603 176.559 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -84.7 -44.67 13.17 Favored 'General case' 0 C--O 1.219 -0.529 0 C-N-CA 118.785 -1.166 . . . . 0.0 108.279 175.151 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 99.8 m-20 -63.68 -38.99 93.19 Favored 'General case' 0 CA--C 1.506 -0.714 0 CA-C-N 114.966 -1.016 . . . . 0.0 111.265 179.015 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 67.6 m -65.7 -40.99 92.86 Favored 'General case' 0 N--CA 1.437 -1.085 0 C-N-CA 119.563 -0.855 . . . . 0.0 110.109 178.866 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 3.5 t80 -71.48 -40.61 70.12 Favored 'General case' 0 C--N 1.342 0.263 0 C-N-CA 118.333 -1.347 . . . . 0.0 109.916 -179.109 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -58.23 -24.1 58.11 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.112 -0.949 . . . . 0.0 108.495 177.806 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -66.34 -40.21 89.71 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-N 113.595 -1.639 . . . . 0.0 109.233 175.99 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 91.5 t80 . . . . . 0 N--CA 1.471 0.615 0 CA-C-O 121.304 0.573 . . . . 0.0 111.022 177.178 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 2.9 p . . . . . 0 N--CA 1.465 0.294 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.224 -0.261 0 N-CA-C 114.569 1.322 . . . . 0.0 114.569 -174.892 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 13.9 m120 . . . . . 0 N--CA 1.49 1.548 0 N-CA-C 109.386 -0.598 . . . . 0.0 109.386 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 86.6 mt 57.88 31.57 20.73 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.464 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 12.7 t -148.86 152.99 37.42 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.441 179.884 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -128.37 147.43 50.64 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.703 -179.834 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 64.6 tt0 55.83 99.09 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.922 179.592 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 64.9 pttt -150.58 157.53 43.1 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.379 179.57 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 68.4 t0 -123.79 106.65 10.66 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.31 -179.866 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -149.13 149.85 31.71 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.613 179.769 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 91.3 t -123.73 127.69 74.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.563 179.923 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 96.4 p -154.65 161.45 41.57 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.692 179.856 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 53.7 p-10 -84.36 -178.25 6.87 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.018 179.857 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 12.4 t -148.51 151.76 35.7 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.57 179.867 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -115.97 -130.91 4.73 Favored Glycine 0 CA--C 1.51 -0.221 0 N-CA-C 111.354 -0.699 . . . . 0.0 111.354 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 2.7 m 74.32 -64.45 0.39 Allowed 'General case' 0 CA--C 1.516 -0.354 0 N-CA-C 108.458 -0.942 . . . . 0.0 108.458 -178.31 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -66.15 -41.6 90.18 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 109.19 -0.67 . . . . 0.0 109.19 177.726 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -63.03 -37.64 88.01 Favored 'General case' 0 CA--C 1.506 -0.719 0 CA-C-N 114.856 -1.065 . . . . 0.0 109.71 178.934 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 54.6 t -60.03 -42.95 91.49 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.834 0 CA-C-N 115.162 -0.926 . . . . 0.0 109.969 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 67.9 t -65.45 -44.3 94.34 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.104 0 CA-C-N 115.268 -0.878 . . . . 0.0 110.257 -179.444 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 60.7 tptt -64.78 -42.93 94.7 Favored 'General case' 0 CA--C 1.538 0.502 0 N-CA-C 113.638 0.977 . . . . 0.0 113.638 -179.798 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 28.3 m -74.09 -51.53 23.54 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.296 0 N-CA-C 113.822 1.045 . . . . 0.0 113.822 -176.962 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 75.4 t -62.97 -45.22 99.44 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 C-N-CA 120.341 -0.544 . . . . 0.0 111.057 -178.079 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -63.3 -37.85 88.87 Favored 'General case' 0 C--N 1.323 -0.587 0 N-CA-C 113.294 0.85 . . . . 0.0 113.294 -178.829 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 48.0 t -65.35 -49.83 67.9 Favored 'General case' 0 N--CA 1.463 0.212 0 C-N-CA 119.776 -0.77 . . . . 0.0 110.702 179.082 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 99.7 mm-40 -67.45 -38.49 84.58 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.485 179.53 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -59.56 -42.45 92.45 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.282 -0.872 . . . . 0.0 109.909 -178.019 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 88.8 tt0 -64.69 -41.51 95.99 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.268 -0.878 . . . . 0.0 110.27 179.278 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 55.9 tp -68.38 -38.0 80.93 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.56 -0.746 . . . . 0.0 112.156 -179.786 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 49.2 t80 -67.83 -37.13 81.53 Favored 'General case' 0 CA--C 1.504 -0.812 0 N-CA-C 106.969 -1.493 . . . . 0.0 106.969 179.182 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 91.0 mt-10 -63.51 -37.03 85.75 Favored 'General case' 0 N--CA 1.442 -0.839 0 CA-C-N 115.249 -0.887 . . . . 0.0 108.868 176.525 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 66.5 tp -62.64 -47.81 82.11 Favored 'General case' 0 N--CA 1.438 -1.05 0 N-CA-C 107.06 -1.459 . . . . 0.0 107.06 177.488 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 29.6 tptp -50.48 -50.09 53.54 Favored 'General case' 0 CA--C 1.521 -0.16 0 CA-C-N 115.18 -0.918 . . . . 0.0 109.383 177.66 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 81.7 m-20 -129.26 86.75 2.46 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 114.744 -1.116 . . . . 0.0 110.325 179.571 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 96.3 m -66.36 -39.75 89.34 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 112.323 0.49 . . . . 0.0 112.323 -178.827 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 65.7 t30 -58.35 -39.49 79.68 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.577 -0.283 . . . . 0.0 111.494 -177.862 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -108.63 141.08 41.1 Favored 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 120.598 -0.441 . . . . 0.0 110.073 179.919 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 2.5 mptp? -89.94 121.98 32.54 Favored 'General case' 0 N--CA 1.438 -1.049 0 C-N-CA 119.861 -0.736 . . . . 0.0 109.415 178.839 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -52.46 -173.36 0.0 OUTLIER 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.614 -179.827 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 80.2 p -160.63 168.55 24.69 Favored 'General case' 0 C--N 1.317 -0.838 0 N-CA-C 109.257 -0.646 . . . . 0.0 109.257 178.343 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 54.1 mt -59.99 -40.19 88.31 Favored 'General case' 0 C--N 1.311 -1.07 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 179.15 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 74.8 m -62.82 -40.33 97.07 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 116.059 -0.518 . . . . 0.0 110.549 178.302 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -72.48 -48.85 37.51 Favored 'General case' 0 N--CA 1.464 0.256 0 N-CA-C 113.382 0.882 . . . . 0.0 113.382 -178.842 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 95.3 mt -62.46 -35.53 79.59 Favored 'General case' 0 CA--C 1.484 -1.56 0 N-CA-C 108.948 -0.76 . . . . 0.0 108.948 -175.601 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -78.78 -34.04 16.99 Favored 'Isoleucine or valine' 0 N--CA 1.409 -2.484 0 CA-C-N 114.385 -1.279 . . . . 0.0 111.217 -176.101 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' SER . . . . . 0.55 ' C ' ' H ' ' A' ' 46' ' ' GLY . 47.9 t -62.84 -49.89 73.11 Favored 'General case' 0 N--CA 1.425 -1.717 0 N-CA-C 104.201 -2.518 . . . . 0.0 104.201 176.363 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' SER . . . . . 0.484 ' O ' ' N ' ' A' ' 47' ' ' ASN . 70.5 m -51.62 9.69 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.044 0 CA-C-N 112.253 -2.249 . . . . 0.0 114.053 172.125 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . 0.55 ' H ' ' C ' ' A' ' 44' ' ' SER . . . 29.4 25.28 0.0 OUTLIER Glycine 0 CA--C 1.539 1.588 0 C-N-CA 125.679 1.609 . . . . 0.0 115.711 -172.288 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . 0.484 ' N ' ' O ' ' A' ' 45' ' ' SER . 21.6 m120 -63.04 -41.92 99.61 Favored 'General case' 0 CA--C 1.51 -0.573 0 N-CA-C 106.529 -1.656 . . . . 0.0 106.529 174.306 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 17.4 pt -131.16 160.98 41.88 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.157 0 CA-C-N 111.71 -2.496 . . . . 0.0 109.5 178.952 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' SER . . . . . 0.479 ' C ' ' H ' ' A' ' 51' ' ' LYS . 69.7 m -108.38 157.1 18.7 Favored 'General case' 0 C--N 1.313 -1.019 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.549 -179.02 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 24.1 tp60 -47.18 -6.06 0.01 OUTLIER 'General case' 0 CA--C 1.555 1.161 0 N-CA-C 114.758 1.392 . . . . 0.0 114.758 -178.554 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.479 ' H ' ' C ' ' A' ' 49' ' ' SER . 21.0 ptmt -84.28 -47.17 11.05 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 105.852 -1.907 . . . . 0.0 105.852 175.564 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 85.3 mt-30 -71.1 -35.22 71.72 Favored 'General case' 0 N--CA 1.439 -0.981 0 CA-C-N 112.659 -2.064 . . . . 0.0 110.167 174.228 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -72.62 -51.61 18.87 Favored 'General case' 0 C--O 1.221 -0.436 0 CA-C-N 115.14 -0.936 . . . . 0.0 112.654 -177.805 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 96.4 m-20 -77.71 -17.89 57.15 Favored 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 114.356 1.243 . . . . 0.0 114.356 -178.978 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 70.9 m -79.67 -39.4 31.45 Favored 'General case' 0 C--N 1.299 -1.61 0 C-N-CA 119.273 -0.971 . . . . 0.0 110.402 179.125 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 19.5 t80 -70.64 -35.55 72.97 Favored 'General case' 0 CA--C 1.502 -0.9 0 N-CA-C 107.517 -1.29 . . . . 0.0 107.517 178.253 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.414 ' O ' ' CD2' ' A' ' 60' ' ' TYR . 64.2 tttm -57.14 -41.58 79.37 Favored 'General case' 0 CA--C 1.488 -1.415 0 CA-C-N 113.19 -1.823 . . . . 0.0 110.416 -178.308 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -80.27 -5.25 55.94 Favored 'General case' 0 N--CA 1.425 -1.683 0 O-C-N 120.662 -1.274 . . . . 0.0 110.175 179.528 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 65.7 t80 -72.38 -42.19 65.51 Favored 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 119.899 -0.721 . . . . 0.0 109.182 175.402 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.414 ' CD2' ' O ' ' A' ' 57' ' ' LYS . 0.3 OUTLIER -71.34 -35.37 71.17 Favored 'General case' 0 C--N 1.351 0.67 0 N-CA-C 108.093 -1.077 . . . . 0.0 108.093 179.988 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -55.03 -36.41 60.86 Favored Glycine 0 CA--C 1.526 0.724 0 CA-C-N 113.921 -1.49 . . . . 0.0 111.789 179.762 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -57.07 -45.06 83.56 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 112.179 0.437 . . . . 0.0 112.179 -177.879 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 94.0 m-70 -97.72 -74.56 0.57 Allowed 'General case' 0 C--N 1.331 -0.217 0 C-N-CA 119.75 -0.78 . . . . 0.0 111.391 -179.506 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 168.76 39.06 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.258 0 O-C-N 123.549 0.531 . . . . 0.0 109.624 -179.794 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 73.95 22.78 77.6 Favored Glycine 0 CA--C 1.523 0.578 0 N-CA-C 110.001 -1.239 . . . . 0.0 110.001 -178.856 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -84.21 -13.35 52.95 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 111.63 0.233 . . . . 0.0 111.63 -178.653 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 74.7 p -113.8 -38.02 4.37 Favored 'General case' 0 N--CA 1.462 0.157 0 C-N-CA 120.101 -0.639 . . . . 0.0 112.234 -179.204 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -37.16 97.0 0.01 OUTLIER 'General case' 0 C--N 1.343 0.301 0 CA-C-O 122.638 1.209 . . . . 0.0 113.305 -175.024 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 92.7 m -54.76 -21.45 11.07 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 112.451 -2.158 . . . . 0.0 109.369 179.285 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . 0.42 ' O ' ' N ' ' A' ' 72' ' ' ASN . 7.2 p -129.46 149.21 33.43 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.8 0 N-CA-C 107.897 -1.149 . . . . 0.0 107.897 179.644 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -52.23 88.03 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.481 0 N-CA-C 112.775 0.657 . . . . 0.0 112.775 -176.348 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . 0.42 ' N ' ' O ' ' A' ' 70' ' ' VAL . 30.6 m120 . . . . . 0 C--N 1.348 0.531 0 CA-C-O 118.237 -0.887 . . . . 0.0 112.221 179.396 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 99.2 m-20 . . . . . 0 N--CA 1.49 1.573 0 N-CA-C 109.556 -0.535 . . . . 0.0 109.556 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 64.6 tp -61.31 -44.97 96.31 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.515 -179.973 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 20.9 p 49.71 40.03 19.08 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.885 179.87 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 26.2 pttm -60.96 -22.96 64.96 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.897 -179.893 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 16.2 pm0 -70.79 -179.54 2.25 Favored 'General case' 0 CA--C 1.516 -0.362 0 CA-C-O 121.526 0.679 . . . . 0.0 111.546 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 64.2 mttp 59.29 40.53 21.19 Favored 'General case' 0 N--CA 1.445 -0.695 0 CA-C-N 114.756 -1.111 . . . . 0.0 110.908 179.96 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 52.4 t0 53.52 47.6 23.63 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.032 179.348 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.33 -40.05 92.79 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.761 179.975 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 10.7 p -138.63 140.28 39.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.651 -179.941 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 66.3 m -127.82 150.24 49.92 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.784 -179.756 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 68.5 t0 -84.35 109.33 17.75 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.082 -0.508 . . . . 0.0 109.664 179.512 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 71.9 p -75.12 162.14 28.78 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.058 0.456 . . . . 0.0 111.279 -179.168 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -125.01 54.58 0.74 Allowed Glycine 0 CA--C 1.503 -0.695 0 N-CA-C 111.284 -0.726 . . . . 0.0 111.284 -179.904 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 70.1 p -65.03 -37.54 87.93 Favored 'General case' 0 N--CA 1.443 -0.787 0 N-CA-C 107.429 -1.323 . . . . 0.0 107.429 178.389 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -67.79 -42.23 81.95 Favored 'General case' 0 CA--C 1.514 -0.426 0 CA-C-N 115.522 -0.763 . . . . 0.0 110.226 177.428 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -62.26 -37.34 85.1 Favored 'General case' 0 CA--C 1.503 -0.833 0 CA-C-N 114.728 -1.124 . . . . 0.0 109.607 179.926 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 46.7 t -56.4 -46.03 81.87 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.044 0 CA-C-N 114.932 -1.031 . . . . 0.0 109.942 -178.945 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 67.7 t -63.26 -49.32 83.56 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.036 0 CA-C-N 114.315 -1.311 . . . . 0.0 112.222 -177.687 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 64.3 tttm -64.64 -42.87 95.16 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 116.755 2.131 . . . . 0.0 116.755 -176.928 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 35.1 m -78.44 -53.78 13.28 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.17 0 C-N-CA 118.391 -1.324 . . . . 0.0 113.708 -176.135 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 53.1 t -61.64 -43.18 96.65 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.72 0 C-N-CA 118.189 -1.404 . . . . 0.0 111.411 -178.181 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -64.94 -26.39 68.29 Favored 'General case' 0 C--N 1.321 -0.647 0 C-N-CA 119.972 -0.691 . . . . 0.0 112.189 179.954 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 82.3 p -75.96 -52.09 11.02 Favored 'General case' 0 N--CA 1.463 0.202 0 C-N-CA 119.642 -0.823 . . . . 0.0 111.405 179.16 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 22.0 mp0 -70.34 -38.49 74.86 Favored 'General case' 0 C--O 1.223 -0.319 0 C-N-CA 120.838 -0.345 . . . . 0.0 111.876 178.627 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -59.74 -41.4 90.87 Favored 'General case' 0 CA--C 1.511 -0.542 0 N-CA-C 109.762 -0.458 . . . . 0.0 109.762 -177.923 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 88.9 tt0 -61.09 -46.23 91.47 Favored 'General case' 0 C--N 1.319 -0.733 0 N-CA-C 108.281 -1.007 . . . . 0.0 108.281 178.925 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 57.8 tp -65.55 -38.57 89.99 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.632 -0.713 . . . . 0.0 112.531 -179.061 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 65.8 t80 -64.9 -40.2 94.71 Favored 'General case' 0 CA--C 1.506 -0.74 0 N-CA-C 106.594 -1.632 . . . . 0.0 106.594 179.112 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 92.1 mt-10 -62.66 -37.02 84.75 Favored 'General case' 0 N--CA 1.443 -0.799 0 CA-C-N 114.65 -1.159 . . . . 0.0 108.976 177.221 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 66.9 tp -61.99 -47.54 84.35 Favored 'General case' 0 N--CA 1.438 -1.069 0 C-N-CA 117.871 -1.532 . . . . 0.0 107.012 177.656 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 64.7 tttp -50.49 -49.73 54.65 Favored 'General case' 0 CA--C 1.52 -0.184 0 CA-C-N 115.338 -0.847 . . . . 0.0 109.422 177.433 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 98.8 m-20 -129.14 86.82 2.48 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 114.785 -1.098 . . . . 0.0 110.093 179.509 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 96.1 m -66.21 -40.35 90.27 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 112.901 0.704 . . . . 0.0 112.901 -178.209 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 65.5 t30 -58.51 -40.15 82.08 Favored 'General case' 0 C--N 1.325 -0.465 0 C-N-CA 120.823 -0.351 . . . . 0.0 111.254 -177.901 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 96.2 mt-10 -106.45 137.4 44.51 Favored 'General case' 0 C--N 1.325 -0.494 0 C-N-CA 120.53 -0.468 . . . . 0.0 110.008 -179.897 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -88.12 129.57 35.27 Favored 'General case' 0 N--CA 1.433 -1.301 0 C-N-CA 118.614 -1.234 . . . . 0.0 109.943 179.333 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -48.72 -178.72 0.0 OUTLIER 'General case' 0 C--N 1.315 -0.911 0 CA-C-N 114.005 -1.452 . . . . 0.0 111.025 -179.377 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 81.3 p -153.57 170.31 21.1 Favored 'General case' 0 C--N 1.314 -0.974 0 N-CA-C 108.427 -0.953 . . . . 0.0 108.427 177.917 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 97.5 mt -60.89 -41.78 96.72 Favored 'General case' 0 C--N 1.311 -1.093 0 N-CA-C 108.154 -1.054 . . . . 0.0 108.154 -179.601 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 75.0 m -63.86 -40.11 95.78 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.502 -0.772 . . . . 0.0 111.949 179.198 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -64.13 -46.74 82.79 Favored 'General case' 0 N--CA 1.464 0.231 0 N-CA-C 113.011 0.745 . . . . 0.0 113.011 -178.34 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 77.2 mt -63.29 -34.91 78.71 Favored 'General case' 0 CA--C 1.491 -1.292 0 N-CA-C 108.578 -0.897 . . . . 0.0 108.578 -178.026 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -81.53 -28.37 10.27 Favored 'Isoleucine or valine' 0 N--CA 1.416 -2.146 0 CA-C-N 114.666 -1.152 . . . . 0.0 111.718 -176.676 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' SER . . . . . 0.52 ' C ' ' H ' ' A' ' 46' ' ' GLY . 75.8 m -61.88 -50.54 71.81 Favored 'General case' 0 N--CA 1.417 -2.075 0 N-CA-C 104.797 -2.298 . . . . 0.0 104.797 177.617 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' SER . . . . . 0.438 ' O ' ' N ' ' A' ' 47' ' ' ASN . 2.4 p -52.8 1.6 0.01 OUTLIER 'General case' 0 CA--C 1.551 0.985 0 CA-C-N 113.249 -1.796 . . . . 0.0 112.933 170.739 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . 0.52 ' H ' ' C ' ' A' ' 44' ' ' SER . . . 28.27 32.33 0.01 OUTLIER Glycine 0 C--N 1.346 1.116 0 C-N-CA 125.757 1.646 . . . . 0.0 114.679 -173.466 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . 0.438 ' N ' ' O ' ' A' ' 45' ' ' SER . 54.7 t-20 -63.79 -42.28 97.75 Favored 'General case' 0 CA--C 1.518 -0.272 0 N-CA-C 106.588 -1.634 . . . . 0.0 106.588 175.699 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 2.4 pp -121.94 166.44 16.57 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.703 0 CA-C-N 112.221 -2.263 . . . . 0.0 109.941 -179.284 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 98.7 p -81.17 166.97 20.16 Favored 'General case' 0 N--CA 1.444 -0.764 0 C-N-CA 120.544 -0.462 . . . . 0.0 110.251 -179.636 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.442 ' O ' ' N ' ' A' ' 53' ' ' ALA . 11.9 tm0? -57.93 -48.86 78.66 Favored 'General case' 0 CA--C 1.493 -1.224 0 CA-C-O 118.531 -0.747 . . . . 0.0 109.212 179.942 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.475 ' O ' ' N ' ' A' ' 55' ' ' SER . 64.3 pttt -60.0 -24.88 64.83 Favored 'General case' 0 CA--C 1.482 -1.672 0 CA-C-N 120.166 1.348 . . . . 0.0 110.953 -177.533 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . 0.419 ' O ' ' HB2' ' A' ' 55' ' ' SER . 3.6 tm0? -67.84 -37.5 81.96 Favored 'General case' 0 N--CA 1.434 -1.25 0 N-CA-C 104.978 -2.231 . . . . 0.0 104.978 175.035 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . 0.442 ' N ' ' O ' ' A' ' 50' ' ' GLN . . . -63.68 -49.11 74.45 Favored 'General case' 0 C--O 1.218 -0.557 0 C-N-CA 118.608 -1.237 . . . . 0.0 107.935 175.927 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 99.9 m-20 -70.56 -11.29 60.84 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 119.226 -0.99 . . . . 0.0 112.125 177.855 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' SER . . . . . 0.475 ' N ' ' O ' ' A' ' 51' ' ' LYS . 62.5 m -64.65 -41.29 96.23 Favored 'General case' 0 CA--C 1.503 -0.836 0 N-CA-C 109.028 -0.73 . . . . 0.0 109.028 -179.734 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -79.55 -30.49 41.75 Favored 'General case' 0 C--N 1.321 -0.669 0 C-N-CA 118.548 -1.261 . . . . 0.0 109.469 179.565 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -60.54 -27.5 67.69 Favored 'General case' 0 CA--C 1.54 0.558 0 N-CA-C 106.797 -1.557 . . . . 0.0 106.797 174.425 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -68.57 -39.38 81.02 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 112.105 -2.316 . . . . 0.0 109.881 176.255 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 66.5 t80 -71.4 -39.4 71.18 Favored 'General case' 0 C--N 1.344 0.341 0 N-CA-C 108.668 -0.864 . . . . 0.0 108.668 176.687 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.456 ' O ' ' O ' ' A' ' 63' ' ' HIS . 55.0 t80 -59.49 -39.66 84.5 Favored 'General case' 0 CA--C 1.503 -0.832 0 N-CA-C 106.998 -1.482 . . . . 0.0 106.998 177.295 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -52.43 -43.45 58.17 Favored Glycine 0 N--CA 1.436 -1.309 0 CA-C-N 113.798 -1.547 . . . . 0.0 110.463 -179.051 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 39.1 ttpt -58.77 -45.37 89.95 Favored 'General case' 0 CA--C 1.548 0.885 0 N-CA-C 113.611 0.967 . . . . 0.0 113.611 -179.325 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' HIS . . . . . 0.456 ' O ' ' O ' ' A' ' 60' ' ' TYR . 96.3 m-70 -129.76 176.3 8.13 Favored 'General case' 0 N--CA 1.482 1.152 0 CA-C-O 121.513 0.673 . . . . 0.0 112.705 -179.06 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 15.7 m -59.58 -156.87 0.0 OUTLIER 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.998 179.871 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -78.73 8.0 45.7 Favored Glycine 0 CA--C 1.529 0.933 0 N-CA-C 112.235 -0.346 . . . . 0.0 112.235 -179.083 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 24.8 pt-20 -82.32 -6.67 59.41 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 111.689 0.255 . . . . 0.0 111.689 -179.789 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 1.1 p -93.49 -70.25 0.71 Allowed 'General case' 0 CA--C 1.532 0.266 0 N-CA-C 113.228 0.825 . . . . 0.0 113.228 -178.706 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 1.1 mm-40 -36.99 100.7 0.02 OUTLIER 'General case' 0 N--CA 1.45 -0.454 0 CA-C-O 123.105 1.431 . . . . 0.0 113.964 -173.488 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 73.9 p -62.36 -15.12 46.56 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 111.479 -2.6 . . . . 0.0 109.253 179.627 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 3.8 p -130.76 139.97 49.87 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.966 0 N-CA-C 105.593 -2.003 . . . . 0.0 105.593 177.723 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -63.2 100.56 0.24 Allowed 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 119.303 -0.959 . . . . 0.0 113.015 -174.547 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 52.2 p30 . . . . . 0 C--O 1.22 -0.498 0 CA-C-O 117.964 -1.017 . . . . 0.0 110.38 178.259 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 74.4 m-20 . . . . . 0 N--CA 1.49 1.566 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 65.3 tp -108.11 121.76 45.49 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.515 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 68.0 p -88.76 -12.01 43.37 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.053 179.864 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 64.4 tttm -61.38 -41.74 97.58 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.776 0.322 . . . . 0.0 110.598 -179.909 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 24.8 pt20 -144.78 173.39 11.89 Favored 'General case' 0 CA--C 1.505 -0.785 0 CA-C-O 121.432 0.634 . . . . 0.0 111.695 -179.304 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -61.88 -39.83 93.29 Favored 'General case' 0 N--CA 1.437 -1.096 0 CA-C-N 114.939 -1.028 . . . . 0.0 111.029 -179.149 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 53.4 t0 70.08 -67.06 0.25 Allowed 'General case' 0 N--CA 1.467 0.378 0 O-C-N 123.633 0.583 . . . . 0.0 111.318 179.663 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -146.26 159.48 43.28 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.88 0.371 . . . . 0.0 110.692 -179.419 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 35.9 m -51.2 165.23 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.628 -179.634 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 40.7 t -61.89 137.34 58.24 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.238 -179.146 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 167.99 -81.79 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 115.174 -0.921 . . . . 0.0 109.028 179.595 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 10.8 t -86.02 -25.56 25.89 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.233 178.903 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -77.36 58.26 3.69 Favored Glycine 0 CA--C 1.505 -0.584 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.919 -179.594 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 70.0 p -68.02 -38.57 82.71 Favored 'General case' 0 N--CA 1.439 -1.0 0 N-CA-C 106.48 -1.674 . . . . 0.0 106.48 177.051 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -68.13 -41.26 81.95 Favored 'General case' 0 CA--C 1.515 -0.366 0 CA-C-O 122.007 0.908 . . . . 0.0 109.978 176.951 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -61.85 -38.26 87.57 Favored 'General case' 0 N--CA 1.444 -0.728 0 CA-C-N 114.456 -1.247 . . . . 0.0 110.038 -179.807 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . 0.421 ' O ' HG22 ' A' ' 20' ' ' VAL . 3.4 p -67.79 -25.65 33.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 C-N-CA 119.39 -0.924 . . . . 0.0 110.888 -178.78 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 60.8 t -63.33 -45.2 98.8 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.709 0 C-N-CA 119.75 -0.78 . . . . 0.0 109.152 179.893 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 15.0 tmtt? -64.56 -39.59 94.03 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 114.57 -1.196 . . . . 0.0 114.057 -178.925 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . 0.428 ' HB ' ' NE2' ' A' ' 52' ' ' GLN . 34.6 m -69.94 -45.17 77.62 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.126 0 N-CA-C 113.221 0.823 . . . . 0.0 113.221 -176.729 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 54.2 t -59.86 -42.36 88.86 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.842 0 C-N-CA 120.223 -0.591 . . . . 0.0 110.342 -179.403 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 98.7 mt-10 -62.35 -38.25 88.82 Favored 'General case' 0 C--N 1.321 -0.656 0 C-N-CA 120.837 -0.345 . . . . 0.0 111.561 179.74 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 73.1 m -64.89 -49.06 71.97 Favored 'General case' 0 N--CA 1.467 0.386 0 C-N-CA 120.379 -0.529 . . . . 0.0 111.431 179.636 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 18.3 mp0 -67.64 -37.42 82.42 Favored 'General case' 0 C--O 1.222 -0.389 0 CA-C-O 121.077 0.465 . . . . 0.0 109.955 178.059 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -60.48 -39.58 88.16 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.309 -0.859 . . . . 0.0 110.265 -179.338 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 54.5 tp10 -68.74 -41.27 79.19 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 123.869 0.73 . . . . 0.0 110.25 178.781 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 58.5 tp -71.04 -38.46 72.56 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.302 -0.863 . . . . 0.0 113.063 -179.525 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 85.9 t80 -65.11 -46.6 80.4 Favored 'General case' 0 CA--C 1.493 -1.225 0 N-CA-C 107.969 -1.123 . . . . 0.0 107.969 179.906 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . 0.566 ' O ' ' N ' ' A' ' 33' ' ' THR . 2.6 pp20? -71.88 -23.23 61.47 Favored 'General case' 0 N--CA 1.43 -1.43 0 C-N-CA 118.563 -1.255 . . . . 0.0 108.809 176.636 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 67.5 tp -62.91 -48.54 78.49 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 105.979 -1.86 . . . . 0.0 105.979 177.894 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -50.69 -48.27 58.7 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 113.691 -1.595 . . . . 0.0 110.606 176.805 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 28.2 m120 -89.17 -66.71 0.89 Allowed 'General case' 0 N--CA 1.479 0.996 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.935 -178.225 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.566 ' N ' ' O ' ' A' ' 29' ' ' GLU . 4.0 m 81.31 -36.0 0.11 Allowed 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.182 0.926 . . . . 0.0 112.228 178.415 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 99.1 m-20 -61.38 -41.09 96.53 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 119.819 -0.752 . . . . 0.0 109.664 -179.971 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 94.6 mt-10 -115.16 -162.36 0.82 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.07 -0.513 . . . . 0.0 109.708 -179.469 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 1.1 mptp? -129.38 133.56 47.44 Favored 'General case' 0 N--CA 1.437 -1.078 0 N-CA-C 107.241 -1.392 . . . . 0.0 107.241 176.43 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . 0.406 ' O ' ' CG2' ' A' ' 70' ' ' VAL . . . -52.54 178.21 0.02 OUTLIER 'General case' 0 C--N 1.318 -0.772 0 CA-C-O 120.989 0.423 . . . . 0.0 110.086 -179.67 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' SER . . . . . 0.441 ' CB ' ' O ' ' A' ' 71' ' ' ALA . 82.6 p -158.61 157.6 32.23 Favored 'General case' 0 CA--C 1.508 -0.644 0 N-CA-C 109.083 -0.71 . . . . 0.0 109.083 178.352 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.402 ' O ' ' HB ' ' A' ' 43' ' ' VAL . 75.6 mt -58.48 -41.65 85.73 Favored 'General case' 0 C--N 1.317 -0.841 0 C-N-CA 117.9 -1.52 . . . . 0.0 109.122 -179.216 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 93.0 p -63.35 -33.97 76.69 Favored 'General case' 0 C--N 1.313 -1.016 0 C-N-CA 119.191 -1.004 . . . . 0.0 109.817 177.805 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 57.7 mtpt -76.14 -54.83 6.24 Favored 'General case' 0 CA--C 1.52 -0.175 0 N-CA-C 114.874 1.435 . . . . 0.0 114.874 -178.211 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 82.6 mt -60.54 -41.16 93.92 Favored 'General case' 0 CA--C 1.49 -1.344 0 CA-C-O 123.023 1.392 . . . . 0.0 107.63 -176.568 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . 0.432 HG22 ' HA ' ' A' ' 50' ' ' GLN . 0.3 OUTLIER -69.58 -46.15 76.23 Favored 'Isoleucine or valine' 0 N--CA 1.398 -3.054 0 CA-C-N 111.523 -2.58 . . . . 0.0 110.873 -172.788 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' SER . . . . . 0.542 ' C ' ' H ' ' A' ' 46' ' ' GLY . 48.2 t -61.08 -46.7 89.56 Favored 'General case' 0 N--CA 1.42 -1.951 0 C-N-CA 116.359 -2.136 . . . . 0.0 105.508 178.208 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' SER . . . . . 0.4 ' O ' ' N ' ' A' ' 47' ' ' ASN . 59.1 m -50.58 2.53 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.89 0 CA-C-N 113.303 -1.772 . . . . 0.0 113.555 172.483 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . 0.542 ' H ' ' C ' ' A' ' 44' ' ' SER . . . 28.46 37.5 0.01 OUTLIER Glycine 0 C--N 1.347 1.187 0 C-N-CA 125.043 1.306 . . . . 0.0 113.42 -173.45 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . 0.4 ' N ' ' O ' ' A' ' 45' ' ' SER . 55.6 t-20 -68.01 -39.85 83.11 Favored 'General case' 0 N--CA 1.449 -0.489 0 N-CA-C 106.256 -1.757 . . . . 0.0 106.256 173.126 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 24.1 pt -129.08 161.14 39.04 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.638 0 CA-C-N 112.187 -2.278 . . . . 0.0 108.701 179.645 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' SER . . . . . 0.415 ' O ' ' N ' ' A' ' 52' ' ' GLN . 72.3 m -91.27 136.26 33.22 Favored 'General case' 0 C--O 1.216 -0.704 0 C-N-CA 119.993 -0.683 . . . . 0.0 111.597 -179.315 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.432 ' HA ' HG22 ' A' ' 43' ' ' VAL . 65.8 tp60 -48.7 -17.57 0.19 Allowed 'General case' 0 C--O 1.214 -0.79 0 CA-C-N 114.986 -1.007 . . . . 0.0 112.842 -177.392 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 63.5 pttt -71.94 -39.4 69.44 Favored 'General case' 0 C--N 1.31 -1.141 0 N-CA-C 106.35 -1.722 . . . . 0.0 106.35 177.806 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . 0.428 ' NE2' ' HB ' ' A' ' 20' ' ' VAL . 5.8 tt0 -69.69 -52.36 26.38 Favored 'General case' 0 N--CA 1.428 -1.531 0 CA-C-N 112.323 -2.217 . . . . 0.0 106.224 176.791 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -60.36 -38.51 84.08 Favored 'General case' 0 C--N 1.344 0.347 0 CA-C-N 115.375 -0.829 . . . . 0.0 111.881 -176.086 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 98.8 m-20 -62.03 -39.61 92.9 Favored 'General case' 0 C--N 1.314 -0.949 0 C-N-CA 120.197 -0.601 . . . . 0.0 112.614 179.638 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 75.4 m -62.87 -41.38 99.36 Favored 'General case' 0 C--N 1.314 -0.97 0 C-N-CA 119.213 -0.995 . . . . 0.0 110.473 -179.318 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -69.6 -39.0 77.51 Favored 'General case' 0 N--CA 1.464 0.269 0 C-N-CA 118.015 -1.474 . . . . 0.0 108.81 179.942 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -55.76 -33.34 64.22 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.173 -0.922 . . . . 0.0 108.753 178.524 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -60.5 -37.46 81.19 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-N 115.226 -0.897 . . . . 0.0 109.623 178.519 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 62.4 m-85 -62.28 -39.33 92.58 Favored 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 120.065 -0.654 . . . . 0.0 109.981 178.768 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 80.1 t80 -60.39 -46.72 88.97 Favored 'General case' 0 CA--C 1.511 -0.544 0 N-CA-C 107.583 -1.265 . . . . 0.0 107.583 174.513 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -54.09 -44.02 73.4 Favored Glycine 0 CA--C 1.529 0.942 0 CA-C-N 113.064 -1.88 . . . . 0.0 112.829 -178.685 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 60.6 tptt -58.46 -45.88 87.69 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.933 0.367 . . . . 0.0 111.568 -178.632 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 63.5 m170 -123.33 -81.59 0.64 Allowed 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 120.695 -0.402 . . . . 0.0 112.016 -179.781 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 9.4 t -167.8 -155.17 0.16 Allowed 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 120.808 -0.357 . . . . 0.0 111.047 -178.607 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -68.95 -5.05 44.96 Favored Glycine 0 CA--C 1.529 0.912 0 N-CA-C 111.626 -0.59 . . . . 0.0 111.626 -179.908 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 24.6 pt-20 -81.57 -10.78 59.36 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 111.795 0.294 . . . . 0.0 111.795 -179.079 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 80.7 p -98.61 -19.17 17.72 Favored 'General case' 0 C--N 1.331 -0.224 0 C-N-CA 119.967 -0.693 . . . . 0.0 111.886 -179.701 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -92.76 102.37 14.77 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-O 121.835 0.826 . . . . 0.0 111.76 -179.113 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 91.4 m -51.0 -23.4 2.9 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 114.058 -1.428 . . . . 0.0 110.945 -179.374 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . 0.406 ' CG2' ' O ' ' A' ' 37' ' ' ALA . 2.9 p -109.62 150.15 12.39 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.516 0 N-CA-C 108.285 -1.006 . . . . 0.0 108.285 179.249 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . 0.441 ' O ' ' CB ' ' A' ' 38' ' ' SER . . . -53.27 115.32 1.84 Allowed 'General case' 0 C--O 1.21 -1.012 0 C-N-CA 119.342 -0.943 . . . . 0.0 110.667 -177.371 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 1.3 m120 . . . . . 0 C--N 1.323 -0.564 0 CA-C-O 117.987 -1.006 . . . . 0.0 111.207 179.254 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 99.1 m-20 . . . . . 0 N--CA 1.49 1.565 0 N-CA-C 109.406 -0.59 . . . . 0.0 109.406 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 86.0 mt 58.27 48.06 13.17 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.677 179.88 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 95.7 m -116.04 129.17 56.24 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.044 -179.724 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -126.92 146.39 50.33 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.356 179.768 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 26.1 pt20 -155.35 159.96 40.34 Favored 'General case' 0 CA--C 1.516 -0.358 0 CA-C-O 121.094 0.473 . . . . 0.0 111.395 -179.985 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 29.5 tptp -134.61 129.29 34.72 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.8 178.528 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -111.66 -80.0 0.58 Allowed 'General case' 0 C--N 1.33 -0.276 0 C-N-CA 120.842 -0.343 . . . . 0.0 111.778 -179.002 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -154.77 -154.86 0.53 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.172 -178.891 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 35.1 m -53.93 -25.66 12.84 Favored 'Isoleucine or valine' 0 C--O 1.231 0.119 0 C-N-CA 120.403 -0.519 . . . . 0.0 109.709 179.869 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 68.5 m -113.98 129.09 56.63 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 178.527 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 18.5 t0 -168.27 179.24 4.57 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.274 -179.247 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 68.7 p -71.42 160.82 32.08 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.346 -0.613 . . . . 0.0 109.346 179.435 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -93.97 7.02 73.29 Favored Glycine 0 CA--C 1.504 -0.633 0 C-N-CA 120.606 -0.807 . . . . 0.0 112.861 -178.805 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 71.1 p -59.61 -39.03 82.9 Favored 'General case' 0 N--CA 1.441 -0.904 0 N-CA-C 106.175 -1.787 . . . . 0.0 106.175 179.168 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -69.9 -39.4 76.23 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 122.292 1.044 . . . . 0.0 110.795 175.696 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -59.72 -36.44 76.56 Favored 'General case' 0 N--CA 1.446 -0.671 0 CA-C-N 113.761 -1.563 . . . . 0.0 111.246 -177.46 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 9.8 p -51.79 -36.75 19.52 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 C-N-CA 119.155 -1.018 . . . . 0.0 111.027 -178.199 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 77.3 t -70.44 -45.67 73.87 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 C-N-CA 119.832 -0.747 . . . . 0.0 110.042 179.531 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 64.8 tttp -62.64 -43.85 97.77 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-N 115.302 -0.863 . . . . 0.0 113.263 -178.962 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 30.1 m -70.44 -50.65 44.17 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.18 0 N-CA-C 113.723 1.009 . . . . 0.0 113.723 -177.303 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 65.3 t -65.48 -44.89 94.07 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 C-N-CA 120.249 -0.58 . . . . 0.0 112.073 -178.495 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 98.7 mt-10 -65.0 -42.66 94.3 Favored 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 112.763 0.653 . . . . 0.0 112.763 -179.129 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 74.1 m -66.51 -45.08 80.74 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-O 121.518 0.675 . . . . 0.0 110.501 -179.909 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 99.5 mm-40 -66.0 -37.93 87.18 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 114.859 -1.064 . . . . 0.0 109.114 179.065 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -59.3 -40.36 85.93 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 114.725 -1.125 . . . . 0.0 109.516 -179.125 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 88.8 tt0 -66.15 -39.87 90.15 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.304 178.441 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 56.8 tp -64.31 -38.47 91.15 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.563 -179.591 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 87.5 t80 -66.26 -36.74 83.77 Favored 'General case' 0 CA--C 1.503 -0.856 0 N-CA-C 107.695 -1.224 . . . . 0.0 107.695 177.762 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 95.1 mt-10 -64.94 -35.6 81.7 Favored 'General case' 0 N--CA 1.445 -0.682 0 N-CA-C 108.905 -0.776 . . . . 0.0 108.905 176.638 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 66.7 tp -62.36 -47.92 82.04 Favored 'General case' 0 N--CA 1.436 -1.141 0 N-CA-C 106.619 -1.623 . . . . 0.0 106.619 177.894 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 60.9 tptt -50.82 -50.57 56.14 Favored 'General case' 0 CA--C 1.523 -0.09 0 CA-C-N 115.115 -0.948 . . . . 0.0 109.279 177.371 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 27.5 m120 -129.55 102.17 6.26 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 114.63 -1.168 . . . . 0.0 109.891 179.172 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 11.3 t -87.08 -15.75 37.61 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 112.309 0.485 . . . . 0.0 112.309 -178.241 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 48.3 t30 -59.92 -43.53 94.85 Favored 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 120.519 -0.472 . . . . 0.0 110.81 -179.079 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 70.9 mm-40 -109.79 -161.03 0.74 Allowed 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 179.791 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 75.8 mmtt -128.69 140.49 51.72 Favored 'General case' 0 N--CA 1.43 -1.466 0 N-CA-C 106.34 -1.726 . . . . 0.0 106.34 175.406 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -51.03 163.81 0.19 Allowed 'General case' 0 C--N 1.315 -0.921 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 -179.535 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' SER . . . . . 0.51 ' HA ' HG22 ' A' ' 70' ' ' VAL . 19.7 m -135.47 144.69 46.55 Favored 'General case' 0 N--CA 1.433 -1.307 0 N-CA-C 107.226 -1.398 . . . . 0.0 107.226 177.97 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.404 HD12 ' O ' ' A' ' 53' ' ' ALA . 8.5 tt -53.93 -40.64 66.92 Favored 'General case' 0 C--N 1.315 -0.901 0 N-CA-C 108.697 -0.853 . . . . 0.0 108.697 -178.365 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 92.8 p -65.3 -34.61 78.74 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.452 -0.794 . . . . 0.0 110.171 177.807 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -73.17 -49.18 29.54 Favored 'General case' 0 CA--C 1.513 -0.475 0 N-CA-C 114.122 1.156 . . . . 0.0 114.122 -178.883 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 96.3 mt -60.62 -40.58 92.4 Favored 'General case' 0 CA--C 1.49 -1.352 0 N-CA-C 107.243 -1.391 . . . . 0.0 107.243 -176.116 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -70.04 -46.88 71.4 Favored 'Isoleucine or valine' 0 N--CA 1.397 -3.081 0 CA-C-N 111.815 -2.448 . . . . 0.0 111.251 -172.906 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' SER . . . . . 0.536 ' C ' ' H ' ' A' ' 46' ' ' GLY . 74.2 m -61.37 -45.77 93.0 Favored 'General case' 0 N--CA 1.407 -2.604 0 C-N-CA 116.242 -2.183 . . . . 0.0 105.997 178.511 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' SER . . . . . 0.424 ' O ' ' N ' ' A' ' 47' ' ' ASN . 26.4 t -50.6 6.23 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.967 0 CA-C-N 113.724 -1.58 . . . . 0.0 114.082 172.536 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . 0.536 ' H ' ' C ' ' A' ' 44' ' ' SER . . . 29.17 36.11 0.01 OUTLIER Glycine 0 C--N 1.351 1.374 0 C-N-CA 124.586 1.088 . . . . 0.0 113.25 -173.013 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . 0.424 ' N ' ' O ' ' A' ' 45' ' ' SER . 95.5 m-20 -67.98 -39.55 83.27 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-O 122.779 1.275 . . . . 0.0 107.696 172.989 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 11.6 pt -131.7 159.43 43.08 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.858 0 CA-C-N 112.382 -2.19 . . . . 0.0 109.205 179.87 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' SER . . . . . 0.444 ' O ' ' N ' ' A' ' 52' ' ' GLN . 45.3 t -83.08 134.19 35.03 Favored 'General case' 0 C--O 1.211 -0.944 0 C-N-CA 120.494 -0.482 . . . . 0.0 111.14 -179.625 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 66.4 tp60 -50.44 -18.48 0.65 Allowed 'General case' 0 C--O 1.212 -0.908 0 CA-C-N 116.279 -0.418 . . . . 0.0 111.61 -179.22 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.407 ' CG ' ' N ' ' A' ' 52' ' ' GLN . 63.3 pttt -72.86 -40.6 65.53 Favored 'General case' 0 C--N 1.317 -0.831 0 N-CA-C 106.018 -1.845 . . . . 0.0 106.018 178.092 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . 0.444 ' N ' ' O ' ' A' ' 49' ' ' SER . 0.5 OUTLIER -67.63 -53.01 31.51 Favored 'General case' 0 N--CA 1.424 -1.759 0 CA-C-N 112.082 -2.326 . . . . 0.0 106.549 176.483 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . 0.404 ' O ' HD12 ' A' ' 39' ' ' LEU . . . -61.63 -38.9 89.36 Favored 'General case' 0 C--O 1.22 -0.46 0 C-N-CA 119.885 -0.726 . . . . 0.0 112.161 -177.579 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 98.0 m-20 -60.62 -39.83 89.66 Favored 'General case' 0 C--N 1.311 -1.092 0 C-N-CA 119.374 -0.93 . . . . 0.0 111.579 -179.718 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 67.3 m -64.62 -40.68 95.91 Favored 'General case' 0 C--N 1.31 -1.135 0 C-N-CA 119.751 -0.78 . . . . 0.0 111.147 179.147 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 10.7 t80 -70.44 -39.98 74.02 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-O 122.069 0.938 . . . . 0.0 109.737 -178.66 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 64.4 tttm -58.48 -33.24 69.56 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 113.886 -1.506 . . . . 0.0 108.879 179.148 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -61.4 -37.87 85.0 Favored 'General case' 0 N--CA 1.443 -0.803 0 CA-C-N 114.886 -1.052 . . . . 0.0 110.143 178.14 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 73.2 m-85 -63.28 -39.46 94.64 Favored 'General case' 0 C--N 1.342 0.281 0 C-N-CA 119.966 -0.694 . . . . 0.0 109.894 178.666 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.424 ' O ' ' HB3' ' A' ' 63' ' ' HIS . 93.1 t80 -62.22 -44.47 96.5 Favored 'General case' 0 N--CA 1.446 -0.675 0 N-CA-C 106.974 -1.491 . . . . 0.0 106.974 175.324 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -52.43 -49.22 52.62 Favored Glycine 0 CA--C 1.529 0.953 0 CA-C-N 114.749 -1.114 . . . . 0.0 110.567 -179.54 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 14.4 mptt -59.59 -2.92 0.39 Allowed 'General case' 0 CA--C 1.539 0.525 0 N-CA-C 112.812 0.671 . . . . 0.0 112.812 178.075 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' HIS . . . . . 0.424 ' HB3' ' O ' ' A' ' 60' ' ' TYR . 34.3 p80 -44.98 156.55 0.09 Allowed 'General case' 0 N--CA 1.462 0.14 0 CA-C-O 122.567 1.175 . . . . 0.0 113.76 -176.212 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 48.4 t 179.15 75.52 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 112.457 -2.156 . . . . 0.0 105.884 179.486 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 82.85 10.92 82.38 Favored Glycine 0 CA--C 1.537 1.446 0 N-CA-C 109.404 -1.478 . . . . 0.0 109.404 -175.918 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 24.4 pt-20 -143.56 171.12 14.6 Favored 'General case' 0 C--N 1.345 0.397 0 CA-C-O 120.633 0.254 . . . . 0.0 110.359 -179.597 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 12.6 t -148.55 -166.19 2.48 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 116.674 -0.239 . . . . 0.0 111.004 -179.226 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 1.7 pt20 -102.64 158.4 16.27 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-O 121.54 0.686 . . . . 0.0 110.896 177.805 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 94.5 m -56.77 -35.96 69.26 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 114.627 -1.17 . . . . 0.0 113.032 -177.905 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . 0.51 HG22 ' HA ' ' A' ' 38' ' ' SER . 4.0 p -102.09 152.55 5.46 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.57 0 N-CA-C 108.986 -0.746 . . . . 0.0 108.986 -178.271 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -87.63 75.49 9.03 Favored 'General case' 0 C--N 1.348 0.528 0 N-CA-C 113.79 1.033 . . . . 0.0 113.79 -174.901 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 50.0 p30 . . . . . 0 C--O 1.219 -0.508 0 CA-C-O 118.079 -0.962 . . . . 0.0 111.172 178.386 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 56.3 t30 . . . . . 0 N--CA 1.49 1.543 0 N-CA-C 109.587 -0.523 . . . . 0.0 109.587 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 86.5 mt 55.62 35.57 25.48 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.562 179.789 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 66.6 p -68.13 -30.93 70.19 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.365 -0.379 . . . . 0.0 110.358 179.994 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -62.69 -40.0 95.75 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.994 0.426 . . . . 0.0 110.078 179.58 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 62.6 tt0 -88.5 136.36 33.03 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.815 -0.63 . . . . 0.0 109.315 179.566 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 62.7 mttp 65.1 -170.07 0.2 Allowed 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 109.33 -0.619 . . . . 0.0 109.33 -178.363 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 37.0 t70 -139.33 110.46 6.89 Favored 'General case' 0 C--N 1.322 -0.606 0 C-N-CA 120.093 -0.643 . . . . 0.0 111.63 -178.563 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.71 149.89 45.66 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.595 -179.973 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 34.0 m -128.35 161.28 37.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.737 -179.588 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 87.4 p -147.08 163.81 35.07 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.307 -179.36 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 52.6 t0 57.8 47.13 15.93 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.226 0.536 . . . . 0.0 109.685 -179.046 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 89.7 m -62.68 133.54 54.98 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.417 -0.811 . . . . 0.0 110.831 -179.715 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -89.99 12.55 67.22 Favored Glycine 0 C--O 1.225 -0.421 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.989 -179.501 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 98.6 m -59.0 -40.31 84.48 Favored 'General case' 0 N--CA 1.438 -1.028 0 N-CA-C 106.191 -1.781 . . . . 0.0 106.191 178.513 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -67.67 -40.57 84.43 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 114.98 -1.009 . . . . 0.0 110.815 177.864 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -62.03 -39.47 92.43 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.366 -0.834 . . . . 0.0 111.062 -178.837 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 12.9 p -67.65 -28.19 40.92 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 C-N-CA 119.296 -0.962 . . . . 0.0 110.882 -178.994 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 58.3 t -61.13 -45.28 98.88 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.908 0 N-CA-C 108.491 -0.929 . . . . 0.0 108.491 179.402 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 40.2 ttpt -65.32 -39.94 93.08 Favored 'General case' 0 CA--C 1.541 0.606 0 N-CA-C 115.07 1.507 . . . . 0.0 115.07 -179.56 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 27.2 m -76.8 -51.09 19.78 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.298 0 N-CA-C 114.208 1.188 . . . . 0.0 114.208 -177.224 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . 0.422 ' HB ' ' CD1' ' A' ' 56' ' ' TYR . 79.6 t -64.22 -44.87 97.5 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.748 0 N-CA-C 112.057 0.391 . . . . 0.0 112.057 -177.887 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 97.3 mt-10 -64.6 -40.18 95.06 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 112.911 0.708 . . . . 0.0 112.911 -179.682 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 47.8 t -65.84 -47.76 73.9 Favored 'General case' 0 N--CA 1.463 0.205 0 C-N-CA 120.209 -0.596 . . . . 0.0 110.212 178.878 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -65.28 -37.51 87.4 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.206 -0.906 . . . . 0.0 110.068 178.598 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -58.1 -43.89 87.34 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 -177.845 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 88.9 tt0 -61.63 -43.91 97.98 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 114.657 -1.156 . . . . 0.0 109.596 179.74 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 53.8 tp -65.88 -37.92 87.42 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.676 -0.693 . . . . 0.0 112.389 -179.646 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 83.7 t80 -67.52 -39.46 85.1 Favored 'General case' 0 CA--C 1.509 -0.609 0 N-CA-C 106.942 -1.503 . . . . 0.0 106.942 178.896 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . 0.422 ' O ' ' N ' ' A' ' 33' ' ' THR . 94.4 mt-10 -61.94 -37.92 86.54 Favored 'General case' 0 N--CA 1.443 -0.803 0 N-CA-C 108.272 -1.01 . . . . 0.0 108.272 176.966 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 65.6 tp -63.49 -46.39 86.36 Favored 'General case' 0 N--CA 1.442 -0.872 0 N-CA-C 107.137 -1.431 . . . . 0.0 107.137 177.303 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 24.7 ttmm -50.46 -49.35 55.37 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-N 114.449 -1.25 . . . . 0.0 111.94 178.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 99.2 m-20 -108.52 -57.33 2.14 Favored 'General case' 0 N--CA 1.479 1.003 0 N-CA-C 113.515 0.931 . . . . 0.0 113.515 -177.824 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.422 ' N ' ' O ' ' A' ' 29' ' ' GLU . 0.4 OUTLIER 80.79 -41.41 0.18 Allowed 'General case' 0 N--CA 1.471 0.616 0 O-C-N 123.793 0.683 . . . . 0.0 111.999 179.859 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 65.2 t30 -60.75 -39.26 88.07 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.558 -0.457 . . . . 0.0 109.961 179.666 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 16.8 pm0 -117.51 162.32 18.17 Favored 'General case' 0 CA--C 1.513 -0.464 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.62 178.847 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -99.73 136.27 39.9 Favored 'General case' 0 N--CA 1.431 -1.397 0 N-CA-C 108.43 -0.952 . . . . 0.0 108.43 177.613 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -49.44 160.53 0.25 Allowed 'General case' 0 C--N 1.311 -1.107 0 CA-C-N 115.265 -0.879 . . . . 0.0 109.183 -179.687 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 84.7 p -146.84 169.14 19.73 Favored 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 108.735 -0.839 . . . . 0.0 108.735 179.678 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.428 ' O ' ' HB ' ' A' ' 43' ' ' VAL . 86.5 mt -60.53 -39.78 89.1 Favored 'General case' 0 C--N 1.314 -0.946 0 C-N-CA 118.508 -1.277 . . . . 0.0 108.414 179.672 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 75.4 m -64.6 -40.72 96.01 Favored 'General case' 0 C--N 1.319 -0.734 0 C-N-CA 120.459 -0.497 . . . . 0.0 111.948 178.621 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -74.86 -54.16 7.78 Favored 'General case' 0 N--CA 1.472 0.67 0 N-CA-C 114.232 1.197 . . . . 0.0 114.232 -177.389 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 87.6 mt -59.79 -34.83 73.54 Favored 'General case' 0 CA--C 1.485 -1.533 0 N-CA-C 108.549 -0.908 . . . . 0.0 108.549 -175.853 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . 0.428 ' HB ' ' O ' ' A' ' 39' ' ' LEU . 0.3 OUTLIER -80.99 -28.8 11.19 Favored 'Isoleucine or valine' 0 N--CA 1.405 -2.679 0 CA-C-N 114.051 -1.431 . . . . 0.0 112.136 -176.852 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' SER . . . . . 0.538 ' C ' ' H ' ' A' ' 46' ' ' GLY . 48.0 t -63.11 -49.93 72.5 Favored 'General case' 0 N--CA 1.428 -1.546 0 N-CA-C 103.922 -2.622 . . . . 0.0 103.922 176.337 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' SER . . . . . 0.455 ' O ' ' N ' ' A' ' 47' ' ' ASN . 63.0 m -51.49 -1.16 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.914 0 CA-C-N 112.278 -2.237 . . . . 0.0 112.744 171.362 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . 0.538 ' H ' ' C ' ' A' ' 44' ' ' SER . . . 29.27 28.36 0.01 OUTLIER Glycine 0 C--N 1.343 0.969 0 C-N-CA 126.082 1.801 . . . . 0.0 115.174 -172.834 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . 0.455 ' N ' ' O ' ' A' ' 45' ' ' SER . 39.7 t-20 -61.62 -42.52 98.99 Favored 'General case' 0 CA--C 1.512 -0.491 0 N-CA-C 104.225 -2.509 . . . . 0.0 104.225 175.571 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 16.3 pt -118.22 136.02 56.73 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.023 0 CA-C-N 111.695 -2.502 . . . . 0.0 107.791 176.443 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' SER . . . . . 0.413 ' C ' ' H ' ' A' ' 51' ' ' LYS . 84.6 p -79.94 159.87 26.17 Favored 'General case' 0 C--N 1.317 -0.829 0 C-N-CA 119.666 -0.814 . . . . 0.0 110.45 -179.337 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 60.7 tp60 -57.86 -8.16 0.9 Allowed 'General case' 0 CA--C 1.546 0.79 0 CA-C-N 115.95 -0.568 . . . . 0.0 112.023 -179.69 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.413 ' H ' ' C ' ' A' ' 49' ' ' SER . 10.9 ptmt -78.83 -43.87 24.26 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 103.956 -2.609 . . . . 0.0 103.956 176.491 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 3.7 mt-30 -68.37 -47.6 66.98 Favored 'General case' 0 N--CA 1.429 -1.49 0 CA-C-N 112.724 -2.034 . . . . 0.0 108.411 176.315 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -63.78 -43.7 95.56 Favored 'General case' 0 C--N 1.343 0.284 0 C-N-CA 119.412 -0.915 . . . . 0.0 111.309 -178.384 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 98.0 m-20 -62.37 -29.31 70.38 Favored 'General case' 0 C--N 1.319 -0.756 0 C-N-CA 120.22 -0.592 . . . . 0.0 110.641 178.906 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 47.5 t -64.47 -39.22 93.4 Favored 'General case' 0 N--CA 1.44 -0.939 0 CA-C-N 115.452 -0.795 . . . . 0.0 110.659 178.211 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . 0.422 ' CD1' ' HB ' ' A' ' 21' ' ' VAL . 0.4 OUTLIER -72.62 -40.22 66.62 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 118.886 -1.126 . . . . 0.0 111.606 -178.515 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -57.68 -28.83 64.13 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 107.275 -1.38 . . . . 0.0 107.275 176.334 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -66.63 -39.67 88.4 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 112.606 -2.088 . . . . 0.0 109.694 175.937 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 89.9 t80 -66.35 -45.66 79.42 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-O 121.113 0.482 . . . . 0.0 110.754 177.211 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -59.95 -46.54 89.09 Favored 'General case' 0 CA--C 1.511 -0.542 0 N-CA-C 106.944 -1.502 . . . . 0.0 106.944 176.466 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -54.53 -41.72 74.0 Favored Glycine 0 C--N 1.309 -0.936 0 CA-C-N 112.05 -2.341 . . . . 0.0 112.105 179.585 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 41.0 ttmt -58.27 -45.88 87.05 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 112.429 0.529 . . . . 0.0 112.429 -178.386 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 79.5 m80 -114.75 118.12 32.7 Favored 'General case' 0 N--CA 1.465 0.303 0 C-N-CA 120.511 -0.476 . . . . 0.0 111.721 -179.143 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 47.5 t -64.64 -50.22 67.97 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.289 0.566 . . . . 0.0 111.236 179.042 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -63.42 -39.72 98.06 Favored Glycine 0 N--CA 1.46 0.288 0 CA-C-N 115.042 -0.981 . . . . 0.0 111.639 -179.202 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 46.6 tp10 -97.06 121.66 39.2 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.444 -0.378 . . . . 0.0 110.7 -178.961 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 78.2 p -123.42 142.9 50.52 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 120.446 -0.501 . . . . 0.0 111.203 -179.277 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . 0.595 ' NE2' ' H ' ' A' ' 70' ' ' VAL . 0.1 OUTLIER -117.62 -86.93 0.63 Allowed 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 115.279 1.585 . . . . 0.0 115.279 -176.261 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' THR . . . . . 0.439 ' CB ' ' HB3' ' A' ' 72' ' ' ASN . 0.3 OUTLIER 30.96 34.47 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.595 0 C-N-CA 123.867 0.867 . . . . 0.0 111.718 -176.121 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . 0.595 ' H ' ' NE2' ' A' ' 68' ' ' GLN . 0.0 OUTLIER 56.21 -80.8 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.426 0 C-N-CA 125.018 1.327 . . . . 0.0 108.621 -177.488 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . 0.414 ' N ' ' O ' ' A' ' 69' ' ' THR . . . -63.71 -16.7 61.77 Favored 'General case' 0 N--CA 1.431 -1.382 0 C-N-CA 120.646 -0.422 . . . . 0.0 110.478 177.977 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . 0.439 ' HB3' ' CB ' ' A' ' 69' ' ' THR . 20.2 t30 . . . . . 0 N--CA 1.478 0.95 0 CA-C-O 118.367 -0.825 . . . . 0.0 110.362 -179.122 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 56.3 t30 . . . . . 0 N--CA 1.491 1.613 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 86.9 mt -113.36 136.6 52.58 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.189 179.669 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 65.7 p -131.68 159.64 37.78 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.749 179.952 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 30.3 mtpp -73.38 144.01 46.6 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.264 179.644 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 72.2 tp60 -123.63 128.56 49.85 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.729 179.946 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 68.7 mttm -128.25 145.96 50.89 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.418 179.725 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 67.8 t0 -133.69 -70.83 0.52 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.427 179.957 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -153.15 158.76 42.29 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.531 -179.655 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 8.4 p -57.09 -30.16 33.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.143 179.907 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 42.0 t -123.23 132.96 54.23 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.902 -0.59 . . . . 0.0 109.883 179.403 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 53.8 p-10 -82.42 -179.71 7.51 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.91 0.386 . . . . 0.0 111.53 -179.354 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 94.0 m -119.26 130.03 55.22 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.247 179.906 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -92.63 124.2 7.62 Favored Glycine 0 CA--C 1.509 -0.336 0 C-N-CA 120.771 -0.728 . . . . 0.0 111.785 -179.635 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 6.1 t -75.38 -53.51 8.59 Favored 'General case' 0 N--CA 1.444 -0.745 0 N-CA-C 107.133 -1.432 . . . . 0.0 107.133 177.43 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -68.02 -40.63 82.92 Favored 'General case' 0 N--CA 1.446 -0.643 0 CA-C-O 121.739 0.78 . . . . 0.0 109.641 176.404 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -62.14 -39.8 93.83 Favored 'General case' 0 N--CA 1.444 -0.73 0 CA-C-N 114.846 -1.07 . . . . 0.0 110.535 -179.274 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 11.8 p -62.66 -31.99 54.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 C-N-CA 117.873 -1.531 . . . . 0.0 110.646 -178.879 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 62.9 t -60.08 -46.4 94.39 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.743 0 N-CA-C 108.764 -0.828 . . . . 0.0 108.764 -179.084 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 40.2 ttpt -63.66 -38.38 90.91 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 115.043 1.497 . . . . 0.0 115.043 -179.612 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 27.0 m -78.25 -54.38 12.31 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.306 0 N-CA-C 113.835 1.05 . . . . 0.0 113.835 -177.214 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 62.3 t -62.13 -43.75 98.18 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.764 0 C-N-CA 119.705 -0.798 . . . . 0.0 111.163 -178.274 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -65.27 -32.25 73.82 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 112.821 0.674 . . . . 0.0 112.821 -179.417 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 87.5 p -75.88 -47.64 24.63 Favored 'General case' 0 C--O 1.231 0.107 0 C-N-CA 119.671 -0.811 . . . . 0.0 111.744 179.306 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 17.4 mp0 -72.07 -39.38 69.05 Favored 'General case' 0 C--O 1.22 -0.467 0 N-CA-C 112.183 0.438 . . . . 0.0 112.183 178.597 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -58.7 -41.46 86.36 Favored 'General case' 0 CA--C 1.512 -0.501 0 CA-C-O 121.422 0.629 . . . . 0.0 109.359 -177.321 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 54.0 tp10 -60.5 -46.66 89.29 Favored 'General case' 0 C--N 1.318 -0.775 0 N-CA-C 107.595 -1.261 . . . . 0.0 107.595 178.837 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 57.7 tp -64.23 -39.58 94.26 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.444 -0.798 . . . . 0.0 112.539 -179.086 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 73.2 t80 -62.44 -44.08 97.28 Favored 'General case' 0 CA--C 1.505 -0.77 0 N-CA-C 106.4 -1.704 . . . . 0.0 106.4 179.305 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 93.3 mt-10 -60.25 -37.74 81.31 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 114.818 -1.083 . . . . 0.0 108.939 178.627 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 66.5 tp -61.88 -47.98 82.56 Favored 'General case' 0 N--CA 1.435 -1.175 0 C-N-CA 117.975 -1.49 . . . . 0.0 107.153 177.908 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -50.54 -50.75 52.52 Favored 'General case' 0 CA--C 1.519 -0.229 0 CA-C-N 115.543 -0.753 . . . . 0.0 109.473 177.529 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 82.2 m-20 -129.41 109.08 10.78 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 114.621 -1.172 . . . . 0.0 110.116 179.256 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 10.2 t -94.16 -15.64 24.45 Favored 'General case' 0 C--N 1.324 -0.529 0 C-N-CA 120.645 -0.422 . . . . 0.0 111.864 -179.149 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 28.6 m120 -60.81 -39.67 89.81 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.116 0.484 . . . . 0.0 109.831 -179.598 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 95.0 mt-10 -124.22 150.66 45.02 Favored 'General case' 0 CA--C 1.507 -0.699 0 N-CA-C 108.581 -0.896 . . . . 0.0 108.581 179.189 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 49.4 mmtm -89.03 137.82 31.97 Favored 'General case' 0 N--CA 1.43 -1.457 0 C-N-CA 118.567 -1.253 . . . . 0.0 108.906 178.122 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -49.46 179.77 0.01 OUTLIER 'General case' 0 C--N 1.314 -0.964 0 CA-C-N 114.873 -1.058 . . . . 0.0 110.643 -179.949 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 76.4 p -153.04 170.66 19.91 Favored 'General case' 0 C--N 1.315 -0.929 0 N-CA-C 108.546 -0.909 . . . . 0.0 108.546 178.419 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 87.7 mt -60.84 -43.08 98.77 Favored 'General case' 0 C--N 1.312 -1.047 0 N-CA-C 107.748 -1.204 . . . . 0.0 107.748 179.689 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 74.7 m -63.08 -40.44 97.68 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.488 -0.778 . . . . 0.0 112.298 179.562 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -63.55 -48.72 76.34 Favored 'General case' 0 N--CA 1.47 0.567 0 N-CA-C 113.43 0.9 . . . . 0.0 113.43 -177.988 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 92.3 mt -60.98 -35.32 76.49 Favored 'General case' 0 CA--C 1.494 -1.186 0 N-CA-C 107.405 -1.331 . . . . 0.0 107.405 -177.757 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . 0.504 HG21 ' HA ' ' A' ' 50' ' ' GLN . 1.7 t -76.25 -31.73 21.47 Favored 'Isoleucine or valine' 0 N--CA 1.419 -2.017 0 CA-C-N 113.997 -1.456 . . . . 0.0 111.302 -178.952 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' SER . . . . . 0.501 ' C ' ' H ' ' A' ' 46' ' ' GLY . 75.0 m -62.34 -51.28 68.26 Favored 'General case' 0 N--CA 1.431 -1.402 0 N-CA-C 104.905 -2.258 . . . . 0.0 104.905 177.398 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' SER . . . . . 0.414 ' O ' ' N ' ' A' ' 47' ' ' ASN . 69.9 m -51.75 -4.36 0.02 OUTLIER 'General case' 0 CA--C 1.549 0.929 0 CA-C-N 113.23 -1.804 . . . . 0.0 112.151 170.644 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . 0.501 ' H ' ' C ' ' A' ' 44' ' ' SER . . . 28.75 34.64 0.01 OUTLIER Glycine 0 C--N 1.346 1.106 0 C-N-CA 126.034 1.778 . . . . 0.0 113.6 -172.68 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . 0.414 ' N ' ' O ' ' A' ' 45' ' ' SER . 57.0 t-20 -63.85 -44.7 92.38 Favored 'General case' 0 CA--C 1.513 -0.462 0 N-CA-C 106.113 -1.81 . . . . 0.0 106.113 176.152 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 1.2 pp -117.47 160.8 16.75 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.936 0 CA-C-N 111.329 -2.669 . . . . 0.0 108.649 179.829 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 88.6 p -77.73 170.99 15.64 Favored 'General case' 0 N--CA 1.446 -0.65 0 CA-C-O 121.583 0.706 . . . . 0.0 112.089 -178.401 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.504 ' HA ' HG21 ' A' ' 43' ' ' VAL . 3.9 tm0? -57.24 -50.1 73.94 Favored 'General case' 0 N--CA 1.437 -1.121 0 CA-C-N 115.084 -0.962 . . . . 0.0 110.347 -179.782 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.438 ' O ' ' N ' ' A' ' 55' ' ' SER . 64.1 pttt -61.13 -25.9 67.31 Favored 'General case' 0 CA--C 1.479 -1.779 0 O-C-N 120.836 -1.165 . . . . 0.0 110.09 -178.218 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 3.2 tm0? -64.96 -38.14 89.98 Favored 'General case' 0 N--CA 1.423 -1.806 0 N-CA-C 105.146 -2.168 . . . . 0.0 105.146 176.186 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . 0.417 ' HB1' ' O ' ' A' ' 50' ' ' GLN . . . -66.07 -49.04 69.02 Favored 'General case' 0 C--N 1.349 0.559 0 C-N-CA 118.09 -1.444 . . . . 0.0 110.786 176.522 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 96.2 m-20 -76.0 -13.97 60.23 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 118.986 -1.085 . . . . 0.0 113.628 -178.782 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' SER . . . . . 0.438 ' N ' ' O ' ' A' ' 51' ' ' LYS . 48.8 m -68.27 -38.77 82.07 Favored 'General case' 0 C--N 1.31 -1.13 0 N-CA-C 109.736 -0.468 . . . . 0.0 109.736 179.162 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -73.63 -37.22 65.42 Favored 'General case' 0 N--CA 1.465 0.295 0 C-N-CA 117.654 -1.618 . . . . 0.0 108.372 179.603 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -57.96 -30.34 65.93 Favored 'General case' 0 C--O 1.221 -0.439 0 N-CA-C 107.021 -1.474 . . . . 0.0 107.021 175.894 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -65.48 -38.79 90.79 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 112.431 -2.168 . . . . 0.0 109.37 176.506 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 83.8 t80 -68.49 -41.46 80.03 Favored 'General case' 0 C--N 1.344 0.33 0 CA-C-O 121.564 0.697 . . . . 0.0 109.325 176.699 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 82.0 t80 -59.23 -40.76 86.88 Favored 'General case' 0 CA--C 1.511 -0.552 0 N-CA-C 106.954 -1.499 . . . . 0.0 106.954 177.196 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -53.24 -39.92 59.33 Favored Glycine 0 N--CA 1.44 -1.08 0 CA-C-N 113.007 -1.906 . . . . 0.0 110.766 -179.731 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 24.6 tptm -57.82 -46.48 84.63 Favored 'General case' 0 C--N 1.33 -0.241 0 C-N-CA 120.916 -0.313 . . . . 0.0 110.547 179.73 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 97.4 m-70 -125.26 107.77 11.06 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-O 121.163 0.506 . . . . 0.0 110.779 179.649 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 47.1 t -62.67 -45.57 92.2 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.598 179.823 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -60.32 -37.54 93.24 Favored Glycine 0 N--CA 1.454 -0.112 0 CA-C-N 115.157 -0.929 . . . . 0.0 110.81 -178.641 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -83.97 139.89 32.26 Favored 'General case' 0 C--N 1.32 -0.716 0 C-N-CA 120.458 -0.497 . . . . 0.0 110.627 -179.267 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 94.3 m -115.4 122.9 47.24 Favored 'General case' 0 C--N 1.332 -0.194 0 C-N-CA 120.884 -0.326 . . . . 0.0 110.57 179.755 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . 0.435 ' OE1' ' O ' ' A' ' 70' ' ' VAL . 0.8 OUTLIER -38.89 166.75 0.0 OUTLIER 'General case' 0 N--CA 1.453 -0.295 0 CA-C-O 123.348 1.547 . . . . 0.0 114.887 -175.464 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 96.9 m -56.25 -35.51 67.5 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 111.628 -2.533 . . . . 0.0 111.706 -178.128 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . 0.435 ' O ' ' OE1' ' A' ' 68' ' ' GLN . 2.5 p -115.01 162.91 12.77 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.608 0 N-CA-C 108.708 -0.849 . . . . 0.0 108.708 -178.845 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -85.04 99.57 11.11 Favored 'General case' 0 N--CA 1.466 0.342 0 C-N-CA 119.455 -0.898 . . . . 0.0 113.42 -176.216 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 45.1 p30 . . . . . 0 C--O 1.22 -0.492 0 CA-C-O 117.942 -1.027 . . . . 0.0 110.281 177.073 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 17.2 p30 . . . . . 0 N--CA 1.491 1.576 0 N-CA-C 109.399 -0.593 . . . . 0.0 109.399 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 88.5 mt -113.84 142.06 46.56 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.548 -179.977 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 1.3 p 60.22 163.26 0.06 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.172 179.62 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 60.8 tptt -116.84 128.18 55.01 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.279 179.874 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 12.6 mp0 -120.77 177.71 4.98 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.147 0.499 . . . . 0.0 111.713 -179.671 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 98.1 mttt 59.61 51.49 6.35 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.319 -0.855 . . . . 0.0 111.358 179.571 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -61.26 -44.76 96.71 Favored 'General case' 0 C--N 1.319 -0.76 0 C-N-CA 120.592 -0.443 . . . . 0.0 111.314 179.907 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.02 -40.91 97.32 Favored 'General case' 0 N--CA 1.467 0.399 0 N-CA-C 112.363 0.505 . . . . 0.0 112.363 -178.87 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 97.5 t -119.23 128.17 75.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 C-N-CA 121.04 -0.264 . . . . 0.0 110.36 -179.505 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 83.2 p -65.23 157.98 27.42 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.297 0.57 . . . . 0.0 111.129 -178.772 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 53.9 p-10 -83.73 -173.48 4.74 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.292 -0.867 . . . . 0.0 111.217 -179.415 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 99.1 m -60.34 -44.74 95.24 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.107 179.991 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 166.62 -98.31 0.15 Allowed Glycine 0 C--N 1.331 0.259 0 C-N-CA 120.412 -0.899 . . . . 0.0 112.518 179.588 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 4.0 m 72.18 -75.11 0.08 Allowed 'General case' 0 N--CA 1.452 -0.375 0 N-CA-C 107.008 -1.479 . . . . 0.0 107.008 -176.706 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -66.97 -39.97 87.36 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 122.57 1.176 . . . . 0.0 108.549 176.078 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -60.61 -36.09 77.73 Favored 'General case' 0 N--CA 1.443 -0.809 0 CA-C-N 113.48 -1.691 . . . . 0.0 109.838 179.515 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -53.24 -29.72 16.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 C-N-CA 119.827 -0.749 . . . . 0.0 110.195 -178.119 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 53.1 t -70.03 -44.0 78.73 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 N-CA-C 108.745 -0.835 . . . . 0.0 108.745 177.134 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 29.5 tptp -63.57 -44.38 94.24 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 114.58 -1.191 . . . . 0.0 113.551 -179.389 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 34.0 m -66.99 -43.02 89.38 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.181 0 N-CA-C 112.756 0.65 . . . . 0.0 112.756 -176.993 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 53.2 t -62.46 -47.2 94.14 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 C-N-CA 118.82 -1.152 . . . . 0.0 110.999 -179.293 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 79.7 mm-40 -66.02 -39.85 90.56 Favored 'General case' 0 C--N 1.332 -0.192 0 N-CA-C 112.091 0.404 . . . . 0.0 112.091 -179.935 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 48.4 t -63.93 -48.35 76.9 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-O 121.95 0.881 . . . . 0.0 108.887 178.553 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 72.0 tp60 -61.87 -39.28 91.35 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 113.962 -1.472 . . . . 0.0 109.78 179.653 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -57.78 -49.98 74.79 Favored 'General case' 0 N--CA 1.447 -0.61 0 N-CA-C 108.277 -1.009 . . . . 0.0 108.277 -178.133 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 88.8 tt0 -65.35 -39.25 92.12 Favored 'General case' 0 CA--C 1.51 -0.565 0 CA-C-N 115.903 -0.59 . . . . 0.0 111.359 179.687 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 61.8 tp -61.39 -42.19 98.32 Favored 'General case' 0 N--CA 1.447 -0.588 0 C-N-CA 119.332 -0.947 . . . . 0.0 108.778 -179.789 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 89.8 t80 -60.99 -43.7 98.47 Favored 'General case' 0 N--CA 1.44 -0.946 0 N-CA-C 107.043 -1.466 . . . . 0.0 107.043 178.47 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -61.18 -31.21 70.96 Favored 'General case' 0 N--CA 1.446 -0.649 0 N-CA-C 109.875 -0.417 . . . . 0.0 109.875 178.618 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 67.0 tp -64.63 -48.72 73.81 Favored 'General case' 0 N--CA 1.44 -0.963 0 N-CA-C 106.302 -1.74 . . . . 0.0 106.302 176.91 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 64.5 tttp -51.58 -50.77 59.5 Favored 'General case' 0 CA--C 1.52 -0.185 0 CA-C-N 115.046 -0.979 . . . . 0.0 109.263 177.396 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 98.6 m-20 -129.78 98.96 4.96 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 114.499 -1.228 . . . . 0.0 110.055 179.444 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 12.7 t -76.9 -14.74 59.84 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 112.258 0.466 . . . . 0.0 112.258 -178.926 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 98.9 m-20 -61.3 -43.09 99.46 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 120.559 -0.456 . . . . 0.0 111.836 -178.175 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 99.2 mt-10 -108.1 -173.59 2.32 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.685 0.279 . . . . 0.0 111.112 -178.574 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 14.4 mptt -121.03 120.82 36.5 Favored 'General case' 0 N--CA 1.444 -0.752 0 N-CA-C 107.575 -1.268 . . . . 0.0 107.575 177.332 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -54.9 149.8 11.0 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-O 121.073 0.464 . . . . 0.0 111.42 -177.729 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 89.1 p -137.03 159.18 42.64 Favored 'General case' 0 N--CA 1.444 -0.763 0 CA-C-N 115.079 -0.964 . . . . 0.0 109.766 -179.645 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.445 HD12 ' O ' ' A' ' 53' ' ' ALA . 2.0 tt -52.3 -48.32 65.43 Favored 'General case' 0 C--N 1.311 -1.082 0 CA-C-N 115.248 -0.887 . . . . 0.0 110.296 -178.38 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 47.9 t -62.54 -42.92 99.84 Favored 'General case' 0 C--N 1.313 -0.981 0 CA-C-N 115.243 -0.89 . . . . 0.0 110.61 179.456 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 29.1 mtpp -65.52 -49.91 67.21 Favored 'General case' 0 CA--C 1.513 -0.473 0 N-CA-C 114.052 1.13 . . . . 0.0 114.052 -177.777 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 98.0 mt -61.1 -40.03 92.2 Favored 'General case' 0 CA--C 1.485 -1.549 0 CA-C-O 122.499 1.142 . . . . 0.0 108.08 -176.298 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -72.27 -45.37 61.54 Favored 'Isoleucine or valine' 0 N--CA 1.402 -2.862 0 CA-C-N 112.302 -2.226 . . . . 0.0 111.038 -172.48 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' SER . . . . . 0.52 ' C ' ' H ' ' A' ' 46' ' ' GLY . 46.7 t -61.25 -47.83 84.22 Favored 'General case' 0 N--CA 1.419 -2.023 0 C-N-CA 116.101 -2.239 . . . . 0.0 105.993 177.574 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' SER . . . . . 0.416 ' O ' ' N ' ' A' ' 47' ' ' ASN . 33.4 t -49.91 6.75 0.0 OUTLIER 'General case' 0 N--CA 1.479 1.023 0 CA-C-N 113.844 -1.526 . . . . 0.0 114.47 173.148 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . 0.52 ' H ' ' C ' ' A' ' 44' ' ' SER . . . 28.83 37.4 0.01 OUTLIER Glycine 0 C--N 1.346 1.136 0 C-N-CA 124.479 1.037 . . . . 0.0 113.428 -173.437 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . 0.416 ' N ' ' O ' ' A' ' 45' ' ' SER . 21.6 m120 -66.72 -38.78 87.39 Favored 'General case' 0 CA--C 1.512 -0.493 0 N-CA-C 106.724 -1.584 . . . . 0.0 106.724 173.339 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 11.2 pt -137.09 -166.5 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.44 -0.967 0 CA-C-N 112.259 -2.246 . . . . 0.0 107.251 179.302 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' SER . . . . . 0.406 ' C ' ' H ' ' A' ' 51' ' ' LYS . 84.8 p -127.99 148.73 50.54 Favored 'General case' 0 C--N 1.321 -0.631 0 C-N-CA 119.986 -0.686 . . . . 0.0 110.639 178.938 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 9.3 mt-30 -54.11 0.47 0.02 OUTLIER 'General case' 0 C--O 1.214 -0.768 0 N-CA-C 114.577 1.325 . . . . 0.0 114.577 -177.133 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.413 ' CG ' ' N ' ' A' ' 52' ' ' GLN . 62.8 pttt -77.06 -41.74 41.13 Favored 'General case' 0 C--N 1.313 -1.008 0 N-CA-C 103.679 -2.712 . . . . 0.0 103.679 175.934 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . 0.413 ' N ' ' CG ' ' A' ' 51' ' ' LYS . 11.3 mt-30 -71.2 -53.43 14.44 Favored 'General case' 0 N--CA 1.423 -1.823 0 CA-C-N 111.891 -2.413 . . . . 0.0 107.829 176.312 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . 0.445 ' O ' HD12 ' A' ' 39' ' ' LEU . . . -62.66 -40.73 97.99 Favored 'General case' 0 C--O 1.216 -0.678 0 N-CA-C 112.962 0.727 . . . . 0.0 112.962 -177.088 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -62.54 -39.53 93.92 Favored 'General case' 0 C--N 1.311 -1.106 0 C-N-CA 118.709 -1.197 . . . . 0.0 113.319 -178.651 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 75.8 m -65.44 -42.04 92.81 Favored 'General case' 0 C--N 1.316 -0.888 0 C-N-CA 118.987 -1.085 . . . . 0.0 110.555 179.575 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 3.1 t80 -72.65 -30.41 64.26 Favored 'General case' 0 C--N 1.334 -0.102 0 C-N-CA 118.988 -1.085 . . . . 0.0 109.405 -179.058 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -61.21 -37.24 82.3 Favored 'General case' 0 CA--C 1.501 -0.925 0 N-CA-C 108.186 -1.042 . . . . 0.0 108.186 177.59 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -65.86 -20.27 66.17 Favored 'General case' 0 N--CA 1.434 -1.24 0 CA-C-N 114.558 -1.201 . . . . 0.0 109.714 178.463 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 88.4 t80 -64.47 -46.51 82.76 Favored 'General case' 0 CA--C 1.531 0.22 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 176.083 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 61.3 t80 -62.14 -50.0 73.6 Favored 'General case' 0 C--N 1.348 0.502 0 CA-C-O 122.253 1.025 . . . . 0.0 109.873 176.187 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -55.06 -50.17 60.05 Favored Glycine 0 CA--C 1.529 0.955 0 CA-C-N 113.404 -1.726 . . . . 0.0 114.338 -178.114 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 27.4 ttpp -59.09 -43.02 91.79 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 112.736 0.643 . . . . 0.0 112.736 -177.586 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 76.2 m80 -99.37 155.36 17.57 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.173 0.511 . . . . 0.0 111.894 -178.13 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 68.8 m -119.87 147.81 44.25 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.46 -0.791 . . . . 0.0 109.368 177.848 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 80.63 2.08 89.54 Favored Glycine 0 CA--C 1.528 0.895 0 N-CA-C 110.07 -1.212 . . . . 0.0 110.07 -179.064 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -146.81 167.85 22.86 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-O 120.681 0.277 . . . . 0.0 110.352 -179.913 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 14.7 t -143.9 -150.33 0.31 Allowed 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.714 -178.055 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -95.41 158.27 15.53 Favored 'General case' 0 CA--C 1.534 0.333 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 177.699 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 98.9 m -57.38 -40.06 77.35 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 113.195 0.813 . . . . 0.0 113.195 -176.936 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 13.4 m -84.1 -156.61 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.517 0 C-N-CA 118.59 -1.244 . . . . 0.0 111.212 -179.339 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -61.48 -38.35 86.95 Favored 'General case' 0 N--CA 1.437 -1.088 0 C-N-CA 119.108 -1.037 . . . . 0.0 112.444 -176.438 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 15.0 t-20 . . . . . 0 C--O 1.219 -0.521 0 CA-C-O 117.895 -1.05 . . . . 0.0 111.335 179.97 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 14.6 t-20 . . . . . 0 N--CA 1.491 1.585 0 N-CA-C 109.286 -0.635 . . . . 0.0 109.286 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 86.2 mt -109.81 137.1 48.09 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.464 -0.334 . . . . 0.0 110.48 -179.854 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 70.5 p -69.51 -33.5 72.92 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.402 179.693 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -138.63 127.79 24.15 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 109.349 -0.612 . . . . 0.0 109.349 179.444 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 54.1 tt0 -147.36 142.49 27.15 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.983 0.42 . . . . 0.0 111.447 -178.778 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 68.7 mttm -116.65 138.54 51.37 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 109.021 -0.733 . . . . 0.0 109.021 178.836 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 68.2 t0 -119.28 111.17 17.86 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.155 0.502 . . . . 0.0 111.161 -178.535 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.53 -39.18 90.12 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.328 179.886 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 35.1 m -87.87 29.83 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.261 0 N-CA-C 112.023 0.379 . . . . 0.0 112.023 -178.593 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 65.9 m -60.73 -39.04 87.15 Favored 'General case' 0 C--N 1.331 -0.222 0 C-N-CA 120.908 -0.317 . . . . 0.0 110.34 179.4 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 98.9 m-20 -59.06 143.51 48.29 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.003 0.43 . . . . 0.0 110.456 -179.461 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 67.5 p -100.14 10.56 41.08 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.756 -0.656 . . . . 0.0 111.365 -179.085 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -77.46 -133.76 0.66 Allowed Glycine 0 C--N 1.331 0.304 0 C-N-CA 120.593 -0.813 . . . . 0.0 111.358 -179.607 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 3.0 m 75.16 -67.85 0.23 Allowed 'General case' 0 CA--C 1.515 -0.389 0 N-CA-C 106.676 -1.601 . . . . 0.0 106.676 -177.094 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -66.29 -38.9 88.84 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 122.044 0.926 . . . . 0.0 108.744 176.355 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -60.32 -37.3 80.17 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-N 114.32 -1.309 . . . . 0.0 110.036 179.894 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -54.09 -31.75 21.99 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 C-N-CA 119.296 -0.962 . . . . 0.0 109.599 -178.275 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 66.1 t -64.11 -46.88 92.42 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 N-CA-C 107.699 -1.222 . . . . 0.0 107.699 177.641 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 41.0 ttmt -60.37 -44.39 95.64 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-N 114.064 -1.426 . . . . 0.0 113.482 -177.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 28.5 m -68.14 -49.7 65.16 Favored 'Isoleucine or valine' 0 N--CA 1.46 0.055 0 CA-C-N 118.833 0.742 . . . . 0.0 111.827 -178.59 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 54.0 t -61.23 -47.78 91.94 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.851 0 C-N-CA 119.846 -0.742 . . . . 0.0 111.529 -177.954 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -68.46 -29.83 68.56 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 112.605 0.595 . . . . 0.0 112.605 -179.247 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 70.9 m -73.45 -50.79 19.82 Favored 'General case' 0 N--CA 1.464 0.249 0 C-N-CA 119.771 -0.771 . . . . 0.0 109.351 177.732 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 99.8 mm-40 -65.04 -37.7 88.43 Favored 'General case' 0 C--O 1.217 -0.649 0 CA-C-N 114.648 -1.16 . . . . 0.0 109.595 179.953 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -55.37 -44.95 76.52 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 108.126 -1.064 . . . . 0.0 108.126 -177.872 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 88.9 tt0 -66.61 -38.45 87.0 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.451 -0.795 . . . . 0.0 110.803 178.364 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 66.5 tp -63.75 -45.82 88.14 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.17 -0.923 . . . . 0.0 109.937 179.392 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 38.8 t80 -65.94 -40.05 91.01 Favored 'General case' 0 N--CA 1.441 -0.917 0 N-CA-C 107.261 -1.385 . . . . 0.0 107.261 -178.919 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 95.6 mt-10 -72.91 -10.85 60.25 Favored 'General case' 0 N--CA 1.441 -0.884 0 CA-C-N 115.083 -0.962 . . . . 0.0 110.287 177.432 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 62.7 tp -69.15 -48.22 62.92 Favored 'General case' 0 N--CA 1.437 -1.103 0 N-CA-C 104.25 -2.5 . . . . 0.0 104.25 174.843 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 64.9 tttp -51.5 -48.44 62.91 Favored 'General case' 0 CA--C 1.509 -0.629 0 CA-C-N 113.519 -1.673 . . . . 0.0 108.164 176.174 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 98.7 m-20 -128.6 94.56 3.9 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-N 114.492 -1.231 . . . . 0.0 110.738 -179.969 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 68.8 p -83.51 -15.37 49.62 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 120.882 -0.327 . . . . 0.0 111.429 -179.308 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 98.5 m-20 -95.01 4.03 54.24 Favored 'General case' 0 C--N 1.33 -0.248 0 C-N-CA 120.83 -0.348 . . . . 0.0 110.746 179.499 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 94.1 mt-10 -134.33 157.89 45.21 Favored 'General case' 0 CA--C 1.509 -0.599 0 N-CA-C 109.329 -0.619 . . . . 0.0 109.329 179.925 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 14.7 mptt -100.09 137.82 38.0 Favored 'General case' 0 N--CA 1.437 -1.104 0 N-CA-C 106.859 -1.534 . . . . 0.0 106.859 176.129 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . 0.437 ' C ' ' CG2' ' A' ' 70' ' ' VAL . . . -85.98 -156.06 0.27 Allowed 'General case' 0 C--N 1.316 -0.85 0 N-CA-C 107.724 -1.213 . . . . 0.0 107.724 177.73 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 79.0 p -160.91 168.92 23.66 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 175.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.407 HD23 ' HB3' ' A' ' 56' ' ' TYR . 72.7 mt -59.88 -46.8 88.18 Favored 'General case' 0 C--N 1.316 -0.885 0 C-N-CA 119.374 -0.93 . . . . 0.0 109.541 179.727 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 91.9 p -60.38 -34.42 73.87 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 120.431 -0.507 . . . . 0.0 109.682 179.858 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -69.33 -36.77 77.26 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-O 121.078 0.465 . . . . 0.0 111.014 178.274 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 87.2 mt -69.25 -35.86 76.55 Favored 'General case' 0 CA--C 1.496 -1.102 0 CA-C-N 115.47 -0.787 . . . . 0.0 109.267 179.896 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -80.27 -34.96 15.18 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.713 0 C-N-CA 119.264 -0.974 . . . . 0.0 110.908 -176.641 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' SER . . . . . 0.546 ' C ' ' H ' ' A' ' 46' ' ' GLY . 47.9 t -59.24 -51.15 71.22 Favored 'General case' 0 N--CA 1.431 -1.39 0 N-CA-C 104.635 -2.357 . . . . 0.0 104.635 179.691 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' SER . . . . . 0.433 ' O ' ' N ' ' A' ' 47' ' ' ASN . 24.7 p -54.41 12.65 0.0 OUTLIER 'General case' 0 CA--C 1.558 1.264 0 CA-C-N 113.926 -1.488 . . . . 0.0 113.677 170.429 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . 0.546 ' H ' ' C ' ' A' ' 44' ' ' SER . . . 28.59 33.78 0.01 OUTLIER Glycine 0 C--N 1.347 1.171 0 C-N-CA 125.201 1.382 . . . . 0.0 114.486 -173.161 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . 0.433 ' N ' ' O ' ' A' ' 45' ' ' SER . 19.1 m120 -66.95 -40.82 87.62 Favored 'General case' 0 CA--C 1.52 -0.186 0 CA-C-O 122.329 1.062 . . . . 0.0 109.138 174.519 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 23.4 pt -137.37 164.76 28.63 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-N 113.098 -1.865 . . . . 0.0 111.716 -177.447 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 67.6 m -76.48 155.75 33.57 Favored 'General case' 0 N--CA 1.439 -0.983 0 N-CA-C 107.524 -1.287 . . . . 0.0 107.524 178.192 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 71.5 tp60 -56.88 -46.4 81.91 Favored 'General case' 0 C--O 1.202 -1.401 0 C-N-CA 119.697 -0.801 . . . . 0.0 109.801 -179.163 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 21.9 pttp -64.11 -30.93 71.96 Favored 'General case' 0 CA--C 1.501 -0.939 0 CA-C-N 119.089 0.858 . . . . 0.0 110.709 -179.248 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 33.5 tt0 -66.5 -38.14 86.59 Favored 'General case' 0 N--CA 1.421 -1.875 0 N-CA-C 103.639 -2.726 . . . . 0.0 103.639 177.437 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -65.96 -51.84 54.91 Favored 'General case' 0 N--CA 1.443 -0.777 0 CA-C-N 114.413 -1.267 . . . . 0.0 110.315 177.822 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 98.2 m-20 -58.11 -47.0 84.59 Favored 'General case' 0 CA--C 1.504 -0.805 0 C-N-CA 120.291 -0.563 . . . . 0.0 112.119 -177.172 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 74.2 m -53.8 -36.06 62.06 Favored 'General case' 0 N--CA 1.436 -1.172 0 C-N-CA 119.312 -0.955 . . . . 0.0 110.724 -177.282 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . 0.418 ' HE2' ' HB3' ' A' ' 68' ' ' GLN . 8.3 t80 -70.16 -41.51 73.73 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 116.996 -1.882 . . . . 0.0 109.052 176.984 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -47.92 -44.39 29.81 Favored 'General case' 0 CA--C 1.498 -1.042 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.22 -175.912 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -59.64 -51.28 70.5 Favored 'General case' 0 N--CA 1.434 -1.234 0 N-CA-C 106.959 -1.497 . . . . 0.0 106.959 179.432 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 91.9 t80 -48.92 -45.66 41.82 Favored 'General case' 0 N--CA 1.466 0.356 0 N-CA-C 109.583 -0.525 . . . . 0.0 109.583 -177.236 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -58.53 -43.33 89.19 Favored 'General case' 0 CA--C 1.508 -0.663 0 N-CA-C 108.208 -1.034 . . . . 0.0 108.208 175.791 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -53.63 -43.81 68.47 Favored Glycine 0 CA--C 1.535 1.321 0 CA-C-N 114.159 -1.382 . . . . 0.0 111.93 -179.889 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -58.48 -38.88 78.52 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 112.33 0.493 . . . . 0.0 112.33 -179.857 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -37.78 165.0 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.44 0 N-CA-C 114.229 1.196 . . . . 0.0 114.229 -176.668 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 30.1 t -118.72 -76.03 0.58 Allowed 'General case' 0 CA--C 1.537 0.448 0 CA-C-N 114.453 -1.248 . . . . 0.0 111.506 179.182 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -101.14 4.19 55.41 Favored Glycine 0 CA--C 1.537 1.456 0 C-N-CA 121.173 -0.537 . . . . 0.0 114.127 -178.098 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 24.7 pt-20 -150.06 161.81 41.63 Favored 'General case' 0 C--O 1.216 -0.708 0 CA-C-N 118.39 1.095 . . . . 0.0 111.245 -179.425 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' THR . . . . . 0.435 ' O ' ' O ' ' A' ' 68' ' ' GLN . 69.6 p -125.94 153.85 43.67 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 120.574 -0.45 . . . . 0.0 109.808 179.96 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . 0.435 ' O ' ' O ' ' A' ' 67' ' ' THR . 21.6 pt20 -42.95 -178.97 0.0 OUTLIER 'General case' 0 C--N 1.344 0.361 0 CA-C-O 122.715 1.245 . . . . 0.0 114.187 -178.266 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 98.0 m -61.52 -39.3 90.51 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 113.772 -1.558 . . . . 0.0 111.778 178.771 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . 0.437 ' CG2' ' C ' ' A' ' 37' ' ' ALA . 7.4 p -109.23 144.88 16.75 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.642 0 CA-C-O 121.404 0.621 . . . . 0.0 111.68 -177.512 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -70.05 76.26 0.49 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.532 -178.446 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.469 0.505 0 CA-C-O 117.962 -1.018 . . . . 0.0 111.482 179.707 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 99.1 m-20 . . . . . 0 N--CA 1.491 1.605 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 66.8 tp -108.21 124.06 49.71 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.353 179.99 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 2.6 m 75.55 -49.9 0.63 Allowed 'General case' 0 N--CA 1.468 0.433 0 O-C-N 123.702 0.626 . . . . 0.0 111.538 179.93 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 64.0 tttm -60.42 -44.85 95.35 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.909 -0.316 . . . . 0.0 110.725 -179.706 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 64.7 tt0 -129.71 127.11 39.79 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.935 0.398 . . . . 0.0 111.006 179.88 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 74.1 mmtt -63.58 -39.23 93.86 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.454 179.563 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 52.8 t0 56.24 43.89 25.8 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.547 -179.734 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . 62.2 151.37 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.211 179.526 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 7.9 p -63.89 -28.76 45.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.328 179.587 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 5.2 t 67.54 47.15 1.25 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.127 179.815 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 99.1 m-20 -65.56 146.41 54.88 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.387 179.354 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 12.0 t -147.45 151.36 36.29 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.969 0.414 . . . . 0.0 110.877 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -103.72 57.88 0.54 Allowed Glycine 0 CA--C 1.502 -0.731 0 N-CA-C 111.619 -0.593 . . . . 0.0 111.619 179.894 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 99.1 m -61.0 -46.19 91.78 Favored 'General case' 0 N--CA 1.438 -1.068 0 N-CA-C 106.28 -1.748 . . . . 0.0 106.28 177.407 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -68.35 -39.87 81.71 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.057 -0.974 . . . . 0.0 110.97 177.282 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -59.93 -37.18 78.76 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 114.305 -1.316 . . . . 0.0 110.28 -178.419 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 2.6 p -53.28 -35.64 24.46 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 C-N-CA 119.34 -0.944 . . . . 0.0 109.919 -178.076 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 61.4 t -63.63 -48.48 86.57 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-O 121.635 0.731 . . . . 0.0 109.207 178.936 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -61.93 -43.77 98.16 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 114.637 -1.165 . . . . 0.0 113.587 -178.7 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 28.5 m -71.95 -54.11 17.87 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.186 0 C-N-CA 119.949 -0.7 . . . . 0.0 112.621 -178.321 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 53.2 t -61.1 -45.32 98.8 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.666 0 C-N-CA 119.398 -0.921 . . . . 0.0 111.975 -177.38 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -61.72 -51.64 67.57 Favored 'General case' 0 C--N 1.331 -0.207 0 C-N-CA 118.557 -1.257 . . . . 0.0 109.973 -179.892 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 48.4 t -58.54 -48.73 79.9 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 120.26 -0.576 . . . . 0.0 110.801 -176.771 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 28.3 mm100 -63.97 -40.38 96.26 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.647 0.737 . . . . 0.0 109.186 179.536 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -57.47 -42.76 83.24 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 114.608 -1.178 . . . . 0.0 110.484 -177.133 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 54.0 tp10 -65.24 -39.12 92.28 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.935 0.874 . . . . 0.0 109.18 178.394 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 53.6 tp -62.2 -44.22 97.08 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 114.316 -1.311 . . . . 0.0 109.622 -179.844 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 55.3 t80 -62.26 -38.85 90.87 Favored 'General case' 0 CA--C 1.504 -0.81 0 N-CA-C 107.475 -1.306 . . . . 0.0 107.475 -179.142 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . 0.44 ' O ' ' N ' ' A' ' 33' ' ' THR . 96.4 mt-10 -59.43 -43.79 93.01 Favored 'General case' 0 N--CA 1.44 -0.926 0 N-CA-C 106.72 -1.585 . . . . 0.0 106.72 178.694 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 64.3 tp -62.46 -43.58 98.47 Favored 'General case' 0 N--CA 1.443 -0.805 0 C-N-CA 118.513 -1.275 . . . . 0.0 108.743 178.387 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -49.03 -49.11 42.75 Favored 'General case' 0 CA--C 1.519 -0.224 0 CA-C-N 115.345 -0.843 . . . . 0.0 110.513 179.759 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 32.5 m120 -109.44 -66.11 1.09 Allowed 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 120.066 -0.654 . . . . 0.0 112.396 -179.356 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.44 ' N ' ' O ' ' A' ' 29' ' ' GLU . 0.2 OUTLIER 79.28 -34.75 0.15 Allowed 'General case' 0 N--CA 1.471 0.582 0 O-C-N 123.653 0.595 . . . . 0.0 112.53 179.067 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 99.2 m-20 -61.07 -39.28 89.3 Favored 'General case' 0 C--N 1.332 -0.162 0 N-CA-C 108.636 -0.876 . . . . 0.0 108.636 179.41 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 9.6 mm-40 -117.84 153.94 32.65 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 114.748 -1.115 . . . . 0.0 108.122 178.579 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -87.61 129.76 35.0 Favored 'General case' 0 N--CA 1.435 -1.215 0 C-N-CA 118.57 -1.252 . . . . 0.0 109.802 179.962 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -45.59 143.02 2.08 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 114.02 -1.446 . . . . 0.0 109.083 -178.522 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 14.2 m -122.92 147.91 46.06 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 107.198 -1.408 . . . . 0.0 107.198 179.818 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 7.7 tt -54.72 -50.24 68.82 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 108.448 -0.945 . . . . 0.0 108.448 -177.708 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 74.1 m -59.42 -38.66 81.2 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 179.586 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 61.7 mtpt -65.85 -38.24 88.33 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 120.781 0.324 . . . . 0.0 111.864 178.714 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 88.5 mt -64.51 -38.73 92.02 Favored 'General case' 0 CA--C 1.485 -1.542 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 -178.025 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -81.93 -35.29 13.27 Favored 'Isoleucine or valine' 0 N--CA 1.417 -2.105 0 C-N-CA 118.956 -1.098 . . . . 0.0 110.92 -176.762 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' SER . . . . . 0.583 ' C ' ' H ' ' A' ' 46' ' ' GLY . 47.9 t -60.85 -50.87 71.69 Favored 'General case' 0 N--CA 1.43 -1.442 0 N-CA-C 105.353 -2.091 . . . . 0.0 105.353 178.583 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' SER . . . . . 0.452 ' O ' ' N ' ' A' ' 47' ' ' ASN . 89.6 p -54.08 9.5 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.125 0 CA-C-N 113.727 -1.579 . . . . 0.0 113.055 171.579 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . 0.583 ' H ' ' C ' ' A' ' 44' ' ' SER . . . 29.04 30.45 0.01 OUTLIER Glycine 0 C--N 1.343 0.964 0 C-N-CA 125.531 1.539 . . . . 0.0 114.613 -172.702 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . 0.452 ' N ' ' O ' ' A' ' 45' ' ' SER . 56.1 t30 -66.16 -42.66 88.67 Favored 'General case' 0 CA--C 1.517 -0.29 0 N-CA-C 104.874 -2.269 . . . . 0.0 104.874 175.193 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 36.2 pt -129.14 166.83 25.75 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.766 0 CA-C-N 111.619 -2.537 . . . . 0.0 107.902 177.922 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' SER . . . . . 0.597 ' C ' ' H ' ' A' ' 51' ' ' LYS . 67.6 m -119.5 156.5 30.14 Favored 'General case' 0 C--N 1.32 -0.702 0 C-N-CA 120.534 -0.466 . . . . 0.0 110.815 -179.151 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 12.6 tp60 -50.84 6.14 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.348 0 N-CA-C 114.743 1.386 . . . . 0.0 114.743 -179.536 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.597 ' H ' ' C ' ' A' ' 49' ' ' SER . 71.9 mmtt -83.43 -52.99 6.04 Favored 'General case' 0 C--N 1.309 -1.183 0 N-CA-C 104.757 -2.312 . . . . 0.0 104.757 176.147 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 4.1 mt-30 -85.28 -29.22 24.76 Favored 'General case' 0 N--CA 1.431 -1.425 0 CA-C-N 110.989 -2.823 . . . . 0.0 110.333 178.105 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -65.17 -49.99 67.66 Favored 'General case' 0 N--CA 1.443 -0.801 0 C-N-CA 118.304 -1.358 . . . . 0.0 109.606 179.8 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 99.2 m-20 -60.9 -51.84 67.58 Favored 'General case' 0 CA--C 1.498 -1.038 0 C-N-CA 117.932 -1.507 . . . . 0.0 112.13 -178.152 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 67.2 m -56.67 -38.27 71.99 Favored 'General case' 0 N--CA 1.434 -1.269 0 C-N-CA 118.534 -1.267 . . . . 0.0 112.122 -175.62 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 22.9 t80 -72.21 -39.5 68.51 Favored 'General case' 0 CA--C 1.516 -0.355 0 C-N-CA 117.488 -1.685 . . . . 0.0 109.627 178.806 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 64.8 tttp -50.71 -40.27 53.66 Favored 'General case' 0 CA--C 1.493 -1.221 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.453 -176.348 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . 0.41 ' O ' ' N ' ' A' ' 61' ' ' GLY . . . -59.13 -50.86 72.43 Favored 'General case' 0 N--CA 1.431 -1.391 0 N-CA-C 106.459 -1.682 . . . . 0.0 106.459 178.783 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 90.1 t80 -45.37 -44.51 11.91 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 120.02 -0.672 . . . . 0.0 110.14 -176.345 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 35.7 t80 -60.0 -47.34 86.22 Favored 'General case' 0 CA--C 1.514 -0.436 0 CA-C-O 122.184 0.992 . . . . 0.0 108.952 175.092 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . 0.41 ' N ' ' O ' ' A' ' 58' ' ' ALA . . . -53.69 -47.08 65.5 Favored Glycine 0 CA--C 1.536 1.391 0 CA-C-N 113.491 -1.686 . . . . 0.0 113.251 -179.196 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 63.9 tttm -58.5 -46.46 86.65 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.971 0.386 . . . . 0.0 111.962 -179.028 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 98.7 m-70 -81.85 144.91 30.68 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.199 0.523 . . . . 0.0 111.53 -179.104 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 69.0 m -127.65 152.39 47.75 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.245 179.31 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 81.48 0.94 89.85 Favored Glycine 0 CA--C 1.525 0.668 0 N-CA-C 110.116 -1.194 . . . . 0.0 110.116 -178.895 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 24.7 pt-20 -151.63 153.24 34.07 Favored 'General case' 0 C--O 1.231 0.112 0 CA-C-O 120.893 0.378 . . . . 0.0 110.458 179.599 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' THR . . . . . 0.473 ' O ' ' O ' ' A' ' 68' ' ' GLN . 91.9 m -128.74 133.33 48.09 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.756 -179.546 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . 0.473 ' O ' ' O ' ' A' ' 67' ' ' THR . 23.5 pt20 -42.06 -178.73 0.0 OUTLIER 'General case' 0 CA--C 1.557 1.242 0 CA-C-O 121.984 0.897 . . . . 0.0 113.049 179.776 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 77.8 p -65.92 -17.08 64.42 Favored 'General case' 0 N--CA 1.48 1.034 0 N-CA-C 112.458 0.54 . . . . 0.0 112.458 -179.78 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . 0.433 ' O ' ' HG3' ' A' ' 68' ' ' GLN . 0.1 OUTLIER -123.43 115.03 44.22 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.718 0 N-CA-C 107.269 -1.382 . . . . 0.0 107.269 -179.778 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -87.71 114.1 24.01 Favored 'General case' 0 C--O 1.22 -0.463 0 O-C-N 121.014 -1.053 . . . . 0.0 113.327 -175.777 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 53.9 m-20 . . . . . 0 C--O 1.22 -0.462 0 CA-C-O 118.019 -0.991 . . . . 0.0 111.23 178.797 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 75.3 m-20 . . . . . 0 N--CA 1.493 1.682 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -69.17 144.44 53.8 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.17 -179.659 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 80.6 p -128.23 160.0 33.48 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.155 179.786 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -62.55 -39.55 93.99 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.914 -179.422 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 65.0 tt0 -76.1 128.47 35.05 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.475 -0.33 . . . . 0.0 110.978 -179.654 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 23.1 pttp -175.93 38.64 0.01 OUTLIER 'General case' 0 C--O 1.233 0.199 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.256 179.7 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 55.3 p-10 -138.4 13.62 2.78 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 113.212 0.819 . . . . 0.0 113.212 -178.655 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -140.62 135.93 32.23 Favored 'General case' 0 C--N 1.331 -0.222 0 C-N-CA 120.363 -0.535 . . . . 0.0 110.84 179.561 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 60.8 t -62.87 -45.93 97.61 Favored 'Isoleucine or valine' 0 C--O 1.232 0.164 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.333 179.633 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 77.3 p -160.66 -34.22 0.05 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.782 179.543 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -115.53 148.75 39.16 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.883 -179.795 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 76.7 p -106.2 -9.37 16.92 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.198 179.663 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 74.34 19.32 79.86 Favored Glycine 0 CA--C 1.505 -0.587 0 N-CA-C 111.271 -0.732 . . . . 0.0 111.271 -179.918 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 98.5 m -59.91 -41.71 92.31 Favored 'General case' 0 N--CA 1.434 -1.236 0 N-CA-C 106.335 -1.728 . . . . 0.0 106.335 178.175 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -67.62 -40.98 84.66 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.025 -0.989 . . . . 0.0 111.517 178.451 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -61.92 -39.42 91.97 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 115.481 -0.782 . . . . 0.0 110.826 -178.87 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 14.1 p -67.8 -28.96 43.42 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 C-N-CA 118.98 -1.088 . . . . 0.0 111.113 -179.046 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 55.8 t -60.55 -44.61 97.0 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.821 0 N-CA-C 108.955 -0.758 . . . . 0.0 108.955 -179.236 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.1 tmmt? -65.44 -36.01 82.64 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 114.99 -1.005 . . . . 0.0 113.631 -179.685 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 33.0 m -82.96 -49.9 16.3 Favored 'Isoleucine or valine' 0 C--N 1.342 0.263 0 O-C-N 121.449 -0.782 . . . . 0.0 113.086 -178.527 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 59.3 t -63.1 -44.75 99.65 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 C-N-CA 120.309 -0.556 . . . . 0.0 111.258 -178.861 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 96.3 mt-10 -60.72 -42.48 97.35 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 119.884 -0.727 . . . . 0.0 111.467 -178.988 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 74.6 m -64.9 -42.74 94.49 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 119.542 -0.863 . . . . 0.0 110.816 179.349 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 97.9 mm-40 -68.97 -40.19 79.0 Favored 'General case' 0 CA--C 1.53 0.177 0 C-N-CA 120.467 -0.493 . . . . 0.0 110.757 -178.948 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.41 ' O ' ' HG3' ' A' ' 29' ' ' GLU . . . -58.04 -41.49 83.39 Favored 'General case' 0 CA--C 1.502 -0.889 0 N-CA-C 108.61 -0.885 . . . . 0.0 108.61 -177.9 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 89.0 tt0 -59.79 -43.48 94.38 Favored 'General case' 0 C--N 1.31 -1.144 0 CA-C-N 114.084 -1.416 . . . . 0.0 108.354 179.088 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 60.2 tp -68.41 -39.15 81.72 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 113.162 0.801 . . . . 0.0 113.162 -179.651 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 94.1 t80 -63.51 -49.36 73.84 Favored 'General case' 0 CA--C 1.494 -1.21 0 N-CA-C 108.465 -0.939 . . . . 0.0 108.465 -179.561 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . 0.41 ' HG3' ' O ' ' A' ' 25' ' ' ALA . 2.6 pp20? -69.18 -23.21 63.9 Favored 'General case' 0 N--CA 1.428 -1.558 0 C-N-CA 118.997 -1.081 . . . . 0.0 109.022 178.235 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 64.3 tp -63.9 -49.05 74.22 Favored 'General case' 0 N--CA 1.44 -0.948 0 N-CA-C 105.828 -1.916 . . . . 0.0 105.828 177.803 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -51.01 -49.21 60.89 Favored 'General case' 0 CA--C 1.519 -0.239 0 CA-C-N 114.275 -1.33 . . . . 0.0 108.805 176.159 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 98.7 m-20 -127.24 106.96 9.59 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-N 114.828 -1.078 . . . . 0.0 109.967 179.507 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 76.6 p -90.3 -2.44 58.01 Favored 'General case' 0 C--N 1.324 -0.524 0 C-N-CA 120.287 -0.565 . . . . 0.0 112.307 -177.948 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 66.5 t30 -60.26 -38.22 82.84 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 108.451 -0.944 . . . . 0.0 108.451 179.385 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 21.0 pt-20 -139.88 157.56 45.51 Favored 'General case' 0 CA--C 1.506 -0.742 0 CA-C-N 114.664 -1.153 . . . . 0.0 111.259 179.053 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 30.4 mtpp -89.36 145.37 25.39 Favored 'General case' 0 N--CA 1.425 -1.696 0 C-N-CA 119.625 -0.83 . . . . 0.0 108.86 177.459 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -57.41 -178.97 0.04 OUTLIER 'General case' 0 C--N 1.297 -1.682 0 CA-C-N 114.202 -1.363 . . . . 0.0 109.157 179.354 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' SER . . . . . 0.429 ' OG ' ' HG3' ' A' ' 41' ' ' LYS . 59.7 p -154.41 168.31 27.08 Favored 'General case' 0 C--N 1.315 -0.892 0 C-N-CA 120.048 -0.661 . . . . 0.0 109.464 178.018 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 6.3 tt -57.62 -44.62 85.66 Favored 'General case' 0 C--N 1.31 -1.136 0 N-CA-C 107.658 -1.238 . . . . 0.0 107.658 -179.361 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 94.0 p -70.81 -37.08 73.22 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 115.187 -0.915 . . . . 0.0 113.033 178.616 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . 0.429 ' HG3' ' OG ' ' A' ' 38' ' ' SER . 97.9 mttt -69.69 -50.92 39.21 Favored 'General case' 0 N--CA 1.471 0.582 0 N-CA-C 113.278 0.844 . . . . 0.0 113.278 -177.914 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.534 ' HB3' HG12 ' A' ' 48' ' ' ILE . 89.9 mt -61.73 -38.05 86.5 Favored 'General case' 0 CA--C 1.482 -1.635 0 CA-C-O 122.225 1.012 . . . . 0.0 108.665 -176.129 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -81.44 -26.55 10.19 Favored 'Isoleucine or valine' 0 N--CA 1.404 -2.757 0 CA-C-N 113.316 -1.765 . . . . 0.0 112.285 -177.056 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' SER . . . . . 0.542 ' C ' ' H ' ' A' ' 46' ' ' GLY . 48.0 t -65.81 -50.42 64.71 Favored 'General case' 0 N--CA 1.422 -1.874 0 N-CA-C 102.963 -2.977 . . . . 0.0 102.963 175.294 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' SER . . . . . 0.496 ' O ' ' N ' ' A' ' 47' ' ' ASN . 60.3 m -51.97 2.53 0.01 OUTLIER 'General case' 0 CA--C 1.547 0.846 0 CA-C-N 111.443 -2.617 . . . . 0.0 113.214 170.902 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . 0.542 ' H ' ' C ' ' A' ' 44' ' ' SER . . . 28.89 21.21 0.0 OUTLIER Glycine 0 CA--C 1.536 1.346 0 C-N-CA 126.478 1.989 . . . . 0.0 116.389 -172.771 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . 0.496 ' N ' ' O ' ' A' ' 45' ' ' SER . 50.5 t30 -59.8 -55.25 36.52 Favored 'General case' 0 CA--C 1.507 -0.693 0 N-CA-C 104.602 -2.37 . . . . 0.0 104.602 177.74 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.534 HG12 ' HB3' ' A' ' 42' ' ' LEU . 29.5 pt -92.95 146.72 6.04 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.242 0 N-CA-C 104.1 -2.555 . . . . 0.0 104.1 174.47 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' SER . . . . . 0.407 ' O ' ' N ' ' A' ' 52' ' ' GLN . 68.2 m -98.82 163.22 12.71 Favored 'General case' 0 C--N 1.311 -1.091 0 C-N-CA 119.309 -0.956 . . . . 0.0 110.903 -178.177 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 63.3 tp60 -50.22 -15.24 0.21 Allowed 'General case' 0 C--N 1.308 -1.21 0 CA-C-N 114.569 -1.196 . . . . 0.0 112.041 -177.479 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 26.0 pttm -81.62 -36.17 29.21 Favored 'General case' 0 CA--C 1.516 -0.351 0 N-CA-C 107.201 -1.407 . . . . 0.0 107.201 177.618 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . 0.407 ' N ' ' O ' ' A' ' 49' ' ' SER . 16.2 mt-30 -79.14 -23.34 44.06 Favored 'General case' 0 N--CA 1.439 -0.979 0 CA-C-N 113.047 -1.888 . . . . 0.0 109.603 176.559 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -84.7 -44.67 13.17 Favored 'General case' 0 C--O 1.219 -0.529 0 C-N-CA 118.785 -1.166 . . . . 0.0 108.279 175.151 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 99.8 m-20 -63.68 -38.99 93.19 Favored 'General case' 0 CA--C 1.506 -0.714 0 CA-C-N 114.966 -1.016 . . . . 0.0 111.265 179.015 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 67.6 m -65.7 -40.99 92.86 Favored 'General case' 0 N--CA 1.437 -1.085 0 C-N-CA 119.563 -0.855 . . . . 0.0 110.109 178.866 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 3.5 t80 -71.48 -40.61 70.12 Favored 'General case' 0 C--N 1.342 0.263 0 C-N-CA 118.333 -1.347 . . . . 0.0 109.916 -179.109 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -58.23 -24.1 58.11 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.112 -0.949 . . . . 0.0 108.495 177.806 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -66.34 -40.21 89.71 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-N 113.595 -1.639 . . . . 0.0 109.233 175.99 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 91.5 t80 -63.92 -47.18 81.57 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-O 121.304 0.573 . . . . 0.0 111.022 177.178 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 91.3 t80 -61.28 -40.8 95.48 Favored 'General case' 0 CA--C 1.512 -0.488 0 N-CA-C 107.325 -1.361 . . . . 0.0 107.325 177.47 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -53.32 -43.27 64.95 Favored Glycine 0 N--CA 1.444 -0.794 0 CA-C-N 113.054 -1.885 . . . . 0.0 111.391 -179.379 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 56.2 mtmt -59.01 -41.05 86.76 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 112.362 0.504 . . . . 0.0 112.362 179.946 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 78.8 m80 -126.37 107.77 10.61 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-O 121.221 0.534 . . . . 0.0 112.079 -179.197 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 47.8 t -63.43 -46.52 85.97 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.664 -0.698 . . . . 0.0 111.47 178.929 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -60.33 -36.45 90.99 Favored Glycine 0 C--O 1.229 -0.171 0 CA-C-N 115.001 -0.999 . . . . 0.0 110.892 -178.799 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -83.34 150.27 26.21 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.529 -0.336 . . . . 0.0 110.762 -178.743 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 9.4 t -124.71 119.46 29.03 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.257 0.551 . . . . 0.0 110.903 -179.965 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 1.2 pt20 -36.85 155.4 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 115.906 1.817 . . . . 0.0 115.906 -175.274 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 89.9 m -46.94 -27.26 1.21 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 110.676 -2.965 . . . . 0.0 112.35 -178.027 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 2.9 p -116.92 155.16 18.5 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.294 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 179.288 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -65.66 78.03 0.07 Allowed 'General case' 0 C--O 1.224 -0.261 0 N-CA-C 114.569 1.322 . . . . 0.0 114.569 -174.892 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 . . . . . 0 C--O 1.22 -0.463 0 CA-C-O 118.006 -0.997 . . . . 0.0 111.336 177.963 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.457 0 N-CA-C 109.19 -0.67 . . . . 0.0 109.19 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 16' ' ' ALA . . . . . 0.646 ' O ' HG22 ' A' ' 20' ' ' VAL . . . -63.03 -37.64 88.01 Favored 'General case' 0 CA--C 1.506 -0.719 0 CA-C-N 114.856 -1.065 . . . . 0.0 109.71 178.934 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 17' ' ' VAL . . . . . 0.677 HG21 ' HB3' ' A' ' 55' ' ' SER . 54.6 t -60.03 -42.95 91.49 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.834 0 CA-C-N 115.162 -0.926 . . . . 0.0 109.969 -179.966 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 67.9 t -65.45 -44.3 94.34 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.104 0 CA-C-N 115.268 -0.878 . . . . 0.0 110.257 -179.444 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 60.7 tptt -64.78 -42.93 94.7 Favored 'General case' 0 CA--C 1.538 0.502 0 N-CA-C 113.638 0.977 . . . . 0.0 113.638 -179.798 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.733 HG21 ' HG2' ' A' ' 52' ' ' GLN . 28.3 m -74.09 -51.53 23.54 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.296 0 N-CA-C 113.822 1.045 . . . . 0.0 113.822 -176.962 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 21' ' ' VAL . . . . . 0.636 HG21 ' HB2' ' A' ' 56' ' ' TYR . 75.4 t -62.97 -45.22 99.44 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 C-N-CA 120.341 -0.544 . . . . 0.0 111.057 -178.079 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -63.3 -37.85 88.87 Favored 'General case' 0 C--N 1.323 -0.587 0 N-CA-C 113.294 0.85 . . . . 0.0 113.294 -178.829 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 48.0 t -65.35 -49.83 67.9 Favored 'General case' 0 N--CA 1.463 0.212 0 C-N-CA 119.776 -0.77 . . . . 0.0 110.702 179.082 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 99.7 mm-40 -67.45 -38.49 84.58 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.485 179.53 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.436 ' HA ' HD11 ' A' ' 42' ' ' LEU . . . -59.56 -42.45 92.45 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.282 -0.872 . . . . 0.0 109.909 -178.019 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 88.8 tt0 -64.69 -41.51 95.99 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.268 -0.878 . . . . 0.0 110.27 179.278 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 55.9 tp -68.38 -38.0 80.93 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.56 -0.746 . . . . 0.0 112.156 -179.786 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' TYR . . . . . 0.697 ' HD2' ' HB2' ' A' ' 37' ' ' ALA . 49.2 t80 -67.83 -37.13 81.53 Favored 'General case' 0 CA--C 1.504 -0.812 0 N-CA-C 106.969 -1.493 . . . . 0.0 106.969 179.182 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 91.0 mt-10 -63.51 -37.03 85.75 Favored 'General case' 0 N--CA 1.442 -0.839 0 CA-C-N 115.249 -0.887 . . . . 0.0 108.868 176.525 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 66.5 tp -62.64 -47.81 82.11 Favored 'General case' 0 N--CA 1.438 -1.05 0 N-CA-C 107.06 -1.459 . . . . 0.0 107.06 177.488 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 29.6 tptp -50.48 -50.09 53.54 Favored 'General case' 0 CA--C 1.521 -0.16 0 CA-C-N 115.18 -0.918 . . . . 0.0 109.383 177.66 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 81.7 m-20 -129.26 86.75 2.46 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 114.744 -1.116 . . . . 0.0 110.325 179.571 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 96.3 m -66.36 -39.75 89.34 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 112.323 0.49 . . . . 0.0 112.323 -178.827 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 65.7 t30 -58.35 -39.49 79.68 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.577 -0.283 . . . . 0.0 111.494 -177.862 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -108.63 141.08 41.1 Favored 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 120.598 -0.441 . . . . 0.0 110.073 179.919 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 2.5 mptp? -89.94 121.98 32.54 Favored 'General case' 0 N--CA 1.438 -1.049 0 C-N-CA 119.861 -0.736 . . . . 0.0 109.415 178.839 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' ALA . . . . . 0.697 ' HB2' ' HD2' ' A' ' 28' ' ' TYR . . . -52.46 -173.36 0.0 OUTLIER 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.614 -179.827 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 80.2 p -160.63 168.55 24.69 Favored 'General case' 0 C--N 1.317 -0.838 0 N-CA-C 109.257 -0.646 . . . . 0.0 109.257 178.343 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.609 HD22 ' HA ' ' A' ' 53' ' ' ALA . 54.1 mt -59.99 -40.19 88.31 Favored 'General case' 0 C--N 1.311 -1.07 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 179.15 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 74.8 m -62.82 -40.33 97.07 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 116.059 -0.518 . . . . 0.0 110.549 178.302 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -72.48 -48.85 37.51 Favored 'General case' 0 N--CA 1.464 0.256 0 N-CA-C 113.382 0.882 . . . . 0.0 113.382 -178.842 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.436 HD11 ' HA ' ' A' ' 25' ' ' ALA . 95.3 mt -62.46 -35.53 79.59 Favored 'General case' 0 CA--C 1.484 -1.56 0 N-CA-C 108.948 -0.76 . . . . 0.0 108.948 -175.601 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.423 HG23 ' O ' ' A' ' 48' ' ' ILE . 0.4 OUTLIER -78.78 -34.04 16.99 Favored 'Isoleucine or valine' 0 N--CA 1.409 -2.484 0 CA-C-N 114.385 -1.279 . . . . 0.0 111.217 -176.101 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 44' ' ' SER . . . . . 0.557 ' C ' ' H ' ' A' ' 46' ' ' GLY . 47.9 t -62.84 -49.89 73.11 Favored 'General case' 0 N--CA 1.425 -1.717 0 N-CA-C 104.201 -2.518 . . . . 0.0 104.201 176.363 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 45' ' ' SER . . . . . 0.484 ' O ' ' N ' ' A' ' 47' ' ' ASN . 70.5 m -51.62 9.69 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.044 0 CA-C-N 112.253 -2.249 . . . . 0.0 114.053 172.125 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 46' ' ' GLY . . . . . 0.557 ' H ' ' C ' ' A' ' 44' ' ' SER . . . 29.4 25.28 0.0 OUTLIER Glycine 0 CA--C 1.539 1.588 0 C-N-CA 125.679 1.609 . . . . 0.0 115.711 -172.288 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 47' ' ' ASN . . . . . 0.484 ' N ' ' O ' ' A' ' 45' ' ' SER . 21.6 m120 -63.04 -41.92 99.61 Favored 'General case' 0 CA--C 1.51 -0.573 0 N-CA-C 106.529 -1.656 . . . . 0.0 106.529 174.306 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 0.423 ' O ' HG23 ' A' ' 43' ' ' VAL . 17.4 pt -131.16 160.98 41.88 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.157 0 CA-C-N 111.71 -2.496 . . . . 0.0 109.5 178.952 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 69.7 m -108.38 157.1 18.7 Favored 'General case' 0 C--N 1.313 -1.019 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.549 -179.02 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' GLN . . . . . 0.82 ' HA ' ' HB3' ' A' ' 53' ' ' ALA . 24.1 tp60 -47.18 -6.06 0.01 OUTLIER 'General case' 0 CA--C 1.555 1.161 0 N-CA-C 114.758 1.392 . . . . 0.0 114.758 -178.554 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 21.0 ptmt -84.28 -47.17 11.05 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 105.852 -1.907 . . . . 0.0 105.852 175.564 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' GLN . . . . . 0.733 ' HG2' HG21 ' A' ' 20' ' ' VAL . 85.3 mt-30 -71.1 -35.22 71.72 Favored 'General case' 0 N--CA 1.439 -0.981 0 CA-C-N 112.659 -2.064 . . . . 0.0 110.167 174.228 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 53' ' ' ALA . . . . . 0.82 ' HB3' ' HA ' ' A' ' 50' ' ' GLN . . . -72.62 -51.61 18.87 Favored 'General case' 0 C--O 1.221 -0.436 0 CA-C-N 115.14 -0.936 . . . . 0.0 112.654 -177.805 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 96.4 m-20 -77.71 -17.89 57.15 Favored 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 114.356 1.243 . . . . 0.0 114.356 -178.978 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' SER . . . . . 0.677 ' HB3' HG21 ' A' ' 17' ' ' VAL . 70.9 m -79.67 -39.4 31.45 Favored 'General case' 0 C--N 1.299 -1.61 0 C-N-CA 119.273 -0.971 . . . . 0.0 110.402 179.125 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 56' ' ' TYR . . . . . 0.636 ' HB2' HG21 ' A' ' 21' ' ' VAL . 19.5 t80 -70.64 -35.55 72.97 Favored 'General case' 0 CA--C 1.502 -0.9 0 N-CA-C 107.517 -1.29 . . . . 0.0 107.517 178.253 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 57' ' ' LYS . . . . . 0.479 ' HB2' HD13 ' A' ' 39' ' ' LEU . 64.2 tttm -57.14 -41.58 79.37 Favored 'General case' 0 CA--C 1.488 -1.415 0 CA-C-N 113.19 -1.823 . . . . 0.0 110.416 -178.308 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -80.27 -5.25 55.94 Favored 'General case' 0 N--CA 1.425 -1.683 0 O-C-N 120.662 -1.274 . . . . 0.0 110.175 179.528 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 65.7 t80 . . . . . 0 N--CA 1.45 -0.461 0 C-N-CA 119.899 -0.721 . . . . 0.0 109.182 175.402 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.449 HG22 ' O ' ' A' ' 37' ' ' ALA . 7.2 p . . . . . 0 N--CA 1.443 -0.8 0 N-CA-C 107.897 -1.149 . . . . 0.0 107.897 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.469 0.481 0 N-CA-C 112.775 0.657 . . . . 0.0 112.775 -176.348 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.514 -0.426 0 CA-C-O 121.537 0.684 . . . . 0.0 110.226 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 16' ' ' ALA . . . . . 0.421 ' O ' HG22 ' A' ' 20' ' ' VAL . . . -62.26 -37.34 85.1 Favored 'General case' 0 CA--C 1.503 -0.833 0 CA-C-N 114.728 -1.124 . . . . 0.0 109.607 179.926 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 17' ' ' VAL . . . . . 0.822 HG22 ' HB3' ' A' ' 55' ' ' SER . 46.7 t -56.4 -46.03 81.87 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.044 0 CA-C-N 114.932 -1.031 . . . . 0.0 109.942 -178.945 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 67.7 t -63.26 -49.32 83.56 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.036 0 CA-C-N 114.315 -1.311 . . . . 0.0 112.222 -177.687 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 64.3 tttm -64.64 -42.87 95.16 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 116.755 2.131 . . . . 0.0 116.755 -176.928 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.476 HG23 ' N ' ' A' ' 21' ' ' VAL . 35.1 m -78.44 -53.78 13.28 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.17 0 C-N-CA 118.391 -1.324 . . . . 0.0 113.708 -176.135 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 21' ' ' VAL . . . . . 0.476 ' N ' HG23 ' A' ' 20' ' ' VAL . 53.1 t -61.64 -43.18 96.65 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.72 0 C-N-CA 118.189 -1.404 . . . . 0.0 111.411 -178.181 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -64.94 -26.39 68.29 Favored 'General case' 0 C--N 1.321 -0.647 0 C-N-CA 119.972 -0.691 . . . . 0.0 112.189 179.954 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 82.3 p -75.96 -52.09 11.02 Favored 'General case' 0 N--CA 1.463 0.202 0 C-N-CA 119.642 -0.823 . . . . 0.0 111.405 179.16 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' GLN . . . . . 0.524 ' HB3' HD22 ' A' ' 42' ' ' LEU . 22.0 mp0 -70.34 -38.49 74.86 Favored 'General case' 0 C--O 1.223 -0.319 0 C-N-CA 120.838 -0.345 . . . . 0.0 111.876 178.627 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -59.74 -41.4 90.87 Favored 'General case' 0 CA--C 1.511 -0.542 0 N-CA-C 109.762 -0.458 . . . . 0.0 109.762 -177.923 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 88.9 tt0 -61.09 -46.23 91.47 Favored 'General case' 0 C--N 1.319 -0.733 0 N-CA-C 108.281 -1.007 . . . . 0.0 108.281 178.925 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 57.8 tp -65.55 -38.57 89.99 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.632 -0.713 . . . . 0.0 112.531 -179.061 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' TYR . . . . . 0.569 ' HD2' ' HB2' ' A' ' 37' ' ' ALA . 65.8 t80 -64.9 -40.2 94.71 Favored 'General case' 0 CA--C 1.506 -0.74 0 N-CA-C 106.594 -1.632 . . . . 0.0 106.594 179.112 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 92.1 mt-10 -62.66 -37.02 84.75 Favored 'General case' 0 N--CA 1.443 -0.799 0 CA-C-N 114.65 -1.159 . . . . 0.0 108.976 177.221 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 66.9 tp -61.99 -47.54 84.35 Favored 'General case' 0 N--CA 1.438 -1.069 0 C-N-CA 117.871 -1.532 . . . . 0.0 107.012 177.656 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 64.7 tttp -50.49 -49.73 54.65 Favored 'General case' 0 CA--C 1.52 -0.184 0 CA-C-N 115.338 -0.847 . . . . 0.0 109.422 177.433 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 98.8 m-20 -129.14 86.82 2.48 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 114.785 -1.098 . . . . 0.0 110.093 179.509 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 96.1 m -66.21 -40.35 90.27 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 112.901 0.704 . . . . 0.0 112.901 -178.209 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 65.5 t30 -58.51 -40.15 82.08 Favored 'General case' 0 C--N 1.325 -0.465 0 C-N-CA 120.823 -0.351 . . . . 0.0 111.254 -177.901 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 96.2 mt-10 -106.45 137.4 44.51 Favored 'General case' 0 C--N 1.325 -0.494 0 C-N-CA 120.53 -0.468 . . . . 0.0 110.008 -179.897 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -88.12 129.57 35.27 Favored 'General case' 0 N--CA 1.433 -1.301 0 C-N-CA 118.614 -1.234 . . . . 0.0 109.943 179.333 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' ALA . . . . . 0.569 ' HB2' ' HD2' ' A' ' 28' ' ' TYR . . . -48.72 -178.72 0.0 OUTLIER 'General case' 0 C--N 1.315 -0.911 0 CA-C-N 114.005 -1.452 . . . . 0.0 111.025 -179.377 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 38' ' ' SER . . . . . 0.404 ' HA ' HG22 ' A' ' 70' ' ' VAL . 81.3 p -153.57 170.31 21.1 Favored 'General case' 0 C--N 1.314 -0.974 0 N-CA-C 108.427 -0.953 . . . . 0.0 108.427 177.917 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.681 HD21 ' HB3' ' A' ' 56' ' ' TYR . 97.5 mt -60.89 -41.78 96.72 Favored 'General case' 0 C--N 1.311 -1.093 0 N-CA-C 108.154 -1.054 . . . . 0.0 108.154 -179.601 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 75.0 m -63.86 -40.11 95.78 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.502 -0.772 . . . . 0.0 111.949 179.198 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -64.13 -46.74 82.79 Favored 'General case' 0 N--CA 1.464 0.231 0 N-CA-C 113.011 0.745 . . . . 0.0 113.011 -178.34 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.524 HD22 ' HB3' ' A' ' 24' ' ' GLN . 77.2 mt -63.29 -34.91 78.71 Favored 'General case' 0 CA--C 1.491 -1.292 0 N-CA-C 108.578 -0.897 . . . . 0.0 108.578 -178.026 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.914 HG21 ' HA ' ' A' ' 50' ' ' GLN . 0.4 OUTLIER -81.53 -28.37 10.27 Favored 'Isoleucine or valine' 0 N--CA 1.416 -2.146 0 CA-C-N 114.666 -1.152 . . . . 0.0 111.718 -176.676 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 44' ' ' SER . . . . . 0.557 ' C ' ' H ' ' A' ' 46' ' ' GLY . 75.8 m -61.88 -50.54 71.81 Favored 'General case' 0 N--CA 1.417 -2.075 0 N-CA-C 104.797 -2.298 . . . . 0.0 104.797 177.617 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 45' ' ' SER . . . . . 0.438 ' O ' ' N ' ' A' ' 47' ' ' ASN . 2.4 p -52.8 1.6 0.01 OUTLIER 'General case' 0 CA--C 1.551 0.985 0 CA-C-N 113.249 -1.796 . . . . 0.0 112.933 170.739 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 46' ' ' GLY . . . . . 0.557 ' H ' ' C ' ' A' ' 44' ' ' SER . . . 28.27 32.33 0.01 OUTLIER Glycine 0 C--N 1.346 1.116 0 C-N-CA 125.757 1.646 . . . . 0.0 114.679 -173.466 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 47' ' ' ASN . . . . . 0.438 ' N ' ' O ' ' A' ' 45' ' ' SER . 54.7 t-20 -63.79 -42.28 97.75 Favored 'General case' 0 CA--C 1.518 -0.272 0 N-CA-C 106.588 -1.634 . . . . 0.0 106.588 175.699 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 0.735 HD12 HG23 ' A' ' 43' ' ' VAL . 2.4 pp -121.94 166.44 16.57 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.703 0 CA-C-N 112.221 -2.263 . . . . 0.0 109.941 -179.284 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 98.7 p -81.17 166.97 20.16 Favored 'General case' 0 N--CA 1.444 -0.764 0 C-N-CA 120.544 -0.462 . . . . 0.0 110.251 -179.636 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' GLN . . . . . 0.914 ' HA ' HG21 ' A' ' 43' ' ' VAL . 11.9 tm0? -57.93 -48.86 78.66 Favored 'General case' 0 CA--C 1.493 -1.224 0 CA-C-O 118.531 -0.747 . . . . 0.0 109.212 179.942 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 51' ' ' LYS . . . . . 0.475 ' O ' ' N ' ' A' ' 55' ' ' SER . 64.3 pttt -60.0 -24.88 64.83 Favored 'General case' 0 CA--C 1.482 -1.672 0 CA-C-N 120.166 1.348 . . . . 0.0 110.953 -177.533 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 52' ' ' GLN . . . . . 0.462 ' HG2' HG21 ' A' ' 20' ' ' VAL . 3.6 tm0? -67.84 -37.5 81.96 Favored 'General case' 0 N--CA 1.434 -1.25 0 N-CA-C 104.978 -2.231 . . . . 0.0 104.978 175.035 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 53' ' ' ALA . . . . . 0.644 ' O ' HD13 ' A' ' 39' ' ' LEU . . . -63.68 -49.11 74.45 Favored 'General case' 0 C--O 1.218 -0.557 0 C-N-CA 118.608 -1.237 . . . . 0.0 107.935 175.927 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 99.9 m-20 -70.56 -11.29 60.84 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 119.226 -0.99 . . . . 0.0 112.125 177.855 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' SER . . . . . 0.822 ' HB3' HG22 ' A' ' 17' ' ' VAL . 62.5 m -64.65 -41.29 96.23 Favored 'General case' 0 CA--C 1.503 -0.836 0 N-CA-C 109.028 -0.73 . . . . 0.0 109.028 -179.734 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 56' ' ' TYR . . . . . 0.681 ' HB3' HD21 ' A' ' 39' ' ' LEU . 1.1 t80 -79.55 -30.49 41.75 Favored 'General case' 0 C--N 1.321 -0.669 0 C-N-CA 118.548 -1.261 . . . . 0.0 109.469 179.565 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -60.54 -27.5 67.69 Favored 'General case' 0 CA--C 1.54 0.558 0 N-CA-C 106.797 -1.557 . . . . 0.0 106.797 174.425 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' ALA . . . . . 0.784 ' HB3' ' O ' ' A' ' 55' ' ' SER . . . -68.57 -39.38 81.02 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 112.105 -2.316 . . . . 0.0 109.881 176.255 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 66.5 t80 . . . . . 0 C--N 1.344 0.341 0 N-CA-C 108.668 -0.864 . . . . 0.0 108.668 176.687 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.404 HG22 ' HA ' ' A' ' 38' ' ' SER . 3.8 p . . . . . 0 N--CA 1.44 -0.966 0 N-CA-C 105.593 -2.003 . . . . 0.0 105.593 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.334 0 C-N-CA 119.303 -0.959 . . . . 0.0 113.015 -174.547 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.515 -0.366 0 CA-C-O 122.007 0.908 . . . . 0.0 109.978 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -61.85 -38.26 87.57 Favored 'General case' 0 N--CA 1.444 -0.728 0 CA-C-N 114.456 -1.247 . . . . 0.0 110.038 -179.807 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' VAL . . . . . 0.826 HG11 ' HB3' ' A' ' 55' ' ' SER . 3.4 p -67.79 -25.65 33.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 C-N-CA 119.39 -0.924 . . . . 0.0 110.888 -178.78 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 60.8 t -63.33 -45.2 98.8 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.709 0 C-N-CA 119.75 -0.78 . . . . 0.0 109.152 179.893 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 15.0 tmtt? -64.56 -39.59 94.03 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 114.57 -1.196 . . . . 0.0 114.057 -178.925 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.467 HG21 ' CG ' ' A' ' 52' ' ' GLN . 34.6 m -69.94 -45.17 77.62 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.126 0 N-CA-C 113.221 0.823 . . . . 0.0 113.221 -176.729 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 21' ' ' VAL . . . . . 0.519 HG21 ' HB2' ' A' ' 56' ' ' TYR . 54.2 t -59.86 -42.36 88.86 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.842 0 C-N-CA 120.223 -0.591 . . . . 0.0 110.342 -179.403 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 98.7 mt-10 -62.35 -38.25 88.82 Favored 'General case' 0 C--N 1.321 -0.656 0 C-N-CA 120.837 -0.345 . . . . 0.0 111.561 179.74 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 73.1 m -64.89 -49.06 71.97 Favored 'General case' 0 N--CA 1.467 0.386 0 C-N-CA 120.379 -0.529 . . . . 0.0 111.431 179.636 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 18.3 mp0 -67.64 -37.42 82.42 Favored 'General case' 0 C--O 1.222 -0.389 0 CA-C-O 121.077 0.465 . . . . 0.0 109.955 178.059 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.406 ' O ' ' HG3' ' A' ' 29' ' ' GLU . . . -60.48 -39.58 88.16 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.309 -0.859 . . . . 0.0 110.265 -179.338 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 54.5 tp10 -68.74 -41.27 79.19 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 123.869 0.73 . . . . 0.0 110.25 178.781 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 58.5 tp -71.04 -38.46 72.56 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.302 -0.863 . . . . 0.0 113.063 -179.525 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' TYR . . . . . 0.43 ' HD2' ' HB2' ' A' ' 37' ' ' ALA . 85.9 t80 -65.11 -46.6 80.4 Favored 'General case' 0 CA--C 1.493 -1.225 0 N-CA-C 107.969 -1.123 . . . . 0.0 107.969 179.906 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 29' ' ' GLU . . . . . 0.566 ' O ' ' N ' ' A' ' 33' ' ' THR . 2.6 pp20? -71.88 -23.23 61.47 Favored 'General case' 0 N--CA 1.43 -1.43 0 C-N-CA 118.563 -1.255 . . . . 0.0 108.809 176.636 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 67.5 tp -62.91 -48.54 78.49 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 105.979 -1.86 . . . . 0.0 105.979 177.894 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -50.69 -48.27 58.7 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 113.691 -1.595 . . . . 0.0 110.606 176.805 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 28.2 m120 -89.17 -66.71 0.89 Allowed 'General case' 0 N--CA 1.479 0.996 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.935 -178.225 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.566 ' N ' ' O ' ' A' ' 29' ' ' GLU . 4.0 m 81.31 -36.0 0.11 Allowed 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.182 0.926 . . . . 0.0 112.228 178.415 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 99.1 m-20 -61.38 -41.09 96.53 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 119.819 -0.752 . . . . 0.0 109.664 -179.971 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 94.6 mt-10 -115.16 -162.36 0.82 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.07 -0.513 . . . . 0.0 109.708 -179.469 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 1.1 mptp? -129.38 133.56 47.44 Favored 'General case' 0 N--CA 1.437 -1.078 0 N-CA-C 107.241 -1.392 . . . . 0.0 107.241 176.43 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' ALA . . . . . 0.43 ' HB2' ' HD2' ' A' ' 28' ' ' TYR . . . -52.54 178.21 0.02 OUTLIER 'General case' 0 C--N 1.318 -0.772 0 CA-C-O 120.989 0.423 . . . . 0.0 110.086 -179.67 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 38' ' ' SER . . . . . 0.441 ' CB ' ' O ' ' A' ' 71' ' ' ALA . 82.6 p -158.61 157.6 32.23 Favored 'General case' 0 CA--C 1.508 -0.644 0 N-CA-C 109.083 -0.71 . . . . 0.0 109.083 178.352 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.526 HD11 ' HB3' ' A' ' 56' ' ' TYR . 75.6 mt -58.48 -41.65 85.73 Favored 'General case' 0 C--N 1.317 -0.841 0 C-N-CA 117.9 -1.52 . . . . 0.0 109.122 -179.216 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 93.0 p -63.35 -33.97 76.69 Favored 'General case' 0 C--N 1.313 -1.016 0 C-N-CA 119.191 -1.004 . . . . 0.0 109.817 177.805 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 57.7 mtpt -76.14 -54.83 6.24 Favored 'General case' 0 CA--C 1.52 -0.175 0 N-CA-C 114.874 1.435 . . . . 0.0 114.874 -178.211 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 82.6 mt -60.54 -41.16 93.92 Favored 'General case' 0 CA--C 1.49 -1.344 0 CA-C-O 123.023 1.392 . . . . 0.0 107.63 -176.568 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.461 ' HB ' ' O ' ' A' ' 39' ' ' LEU . 0.3 OUTLIER -69.58 -46.15 76.23 Favored 'Isoleucine or valine' 0 N--CA 1.398 -3.054 0 CA-C-N 111.523 -2.58 . . . . 0.0 110.873 -172.788 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 44' ' ' SER . . . . . 0.564 ' C ' ' H ' ' A' ' 46' ' ' GLY . 48.2 t -61.08 -46.7 89.56 Favored 'General case' 0 N--CA 1.42 -1.951 0 C-N-CA 116.359 -2.136 . . . . 0.0 105.508 178.208 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 45' ' ' SER . . . . . 0.4 ' O ' ' N ' ' A' ' 47' ' ' ASN . 59.1 m -50.58 2.53 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.89 0 CA-C-N 113.303 -1.772 . . . . 0.0 113.555 172.483 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 46' ' ' GLY . . . . . 0.564 ' H ' ' C ' ' A' ' 44' ' ' SER . . . 28.46 37.5 0.01 OUTLIER Glycine 0 C--N 1.347 1.187 0 C-N-CA 125.043 1.306 . . . . 0.0 113.42 -173.45 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 47' ' ' ASN . . . . . 0.4 ' N ' ' O ' ' A' ' 45' ' ' SER . 55.6 t-20 -68.01 -39.85 83.11 Favored 'General case' 0 N--CA 1.449 -0.489 0 N-CA-C 106.256 -1.757 . . . . 0.0 106.256 173.126 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 24.1 pt -129.08 161.14 39.04 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.638 0 CA-C-N 112.187 -2.278 . . . . 0.0 108.701 179.645 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' SER . . . . . 0.403 ' O ' ' N ' ' A' ' 52' ' ' GLN . 72.3 m -91.27 136.26 33.22 Favored 'General case' 0 C--O 1.216 -0.704 0 C-N-CA 119.993 -0.683 . . . . 0.0 111.597 -179.315 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 50' ' ' GLN . . . . . 0.591 ' HA ' ' HB3' ' A' ' 53' ' ' ALA . 65.8 tp60 -48.7 -17.57 0.19 Allowed 'General case' 0 C--O 1.214 -0.79 0 CA-C-N 114.986 -1.007 . . . . 0.0 112.842 -177.392 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 63.5 pttt -71.94 -39.4 69.44 Favored 'General case' 0 C--N 1.31 -1.141 0 N-CA-C 106.35 -1.722 . . . . 0.0 106.35 177.806 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' GLN . . . . . 0.467 ' CG ' HG21 ' A' ' 20' ' ' VAL . 3.9 tt0 -69.69 -52.36 26.38 Favored 'General case' 0 N--CA 1.428 -1.531 0 CA-C-N 112.323 -2.217 . . . . 0.0 106.224 176.791 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 53' ' ' ALA . . . . . 0.591 ' HB3' ' HA ' ' A' ' 50' ' ' GLN . . . -60.36 -38.51 84.08 Favored 'General case' 0 C--N 1.344 0.347 0 CA-C-N 115.375 -0.829 . . . . 0.0 111.881 -176.086 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 98.8 m-20 -62.03 -39.61 92.9 Favored 'General case' 0 C--N 1.314 -0.949 0 C-N-CA 120.197 -0.601 . . . . 0.0 112.614 179.638 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' SER . . . . . 0.826 ' HB3' HG11 ' A' ' 17' ' ' VAL . 75.4 m -62.87 -41.38 99.36 Favored 'General case' 0 C--N 1.314 -0.97 0 C-N-CA 119.213 -0.995 . . . . 0.0 110.473 -179.318 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 56' ' ' TYR . . . . . 0.526 ' HB3' HD11 ' A' ' 39' ' ' LEU . 0.9 OUTLIER -69.6 -39.0 77.51 Favored 'General case' 0 N--CA 1.464 0.269 0 C-N-CA 118.015 -1.474 . . . . 0.0 108.81 179.942 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 57' ' ' LYS . . . . . 0.434 ' HB2' HD13 ' A' ' 39' ' ' LEU . 87.9 tttt -55.76 -33.34 64.22 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.173 -0.922 . . . . 0.0 108.753 178.524 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 58' ' ' ALA . . . . . 0.504 ' HB3' ' O ' ' A' ' 55' ' ' SER . . . -60.5 -37.46 81.19 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-N 115.226 -0.897 . . . . 0.0 109.623 178.519 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 62.4 m-85 . . . . . 0 N--CA 1.465 0.317 0 C-N-CA 120.065 -0.654 . . . . 0.0 109.981 178.768 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.406 ' CG2' ' O ' ' A' ' 37' ' ' ALA . 2.9 p . . . . . 0 N--CA 1.449 -0.516 0 N-CA-C 108.285 -1.006 . . . . 0.0 108.285 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 71' ' ' ALA . . . . . 0.441 ' O ' ' CB ' ' A' ' 38' ' ' SER . . . . . . . . 0 C--O 1.21 -1.012 0 C-N-CA 119.342 -0.943 . . . . 0.0 110.667 -177.371 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.235 0.297 0 CA-C-O 122.292 1.044 . . . . 0.0 110.795 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 16' ' ' ALA . . . . . 0.6 ' O ' HG22 ' A' ' 20' ' ' VAL . . . -59.72 -36.44 76.56 Favored 'General case' 0 N--CA 1.446 -0.671 0 CA-C-N 113.761 -1.563 . . . . 0.0 111.246 -177.46 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 17' ' ' VAL . . . . . 0.567 HG11 ' HE1' ' A' ' 59' ' ' TYR . 9.8 p -51.79 -36.75 19.52 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 C-N-CA 119.155 -1.018 . . . . 0.0 111.027 -178.199 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 77.3 t -70.44 -45.67 73.87 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 C-N-CA 119.832 -0.747 . . . . 0.0 110.042 179.531 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 64.8 tttp -62.64 -43.85 97.77 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-N 115.302 -0.863 . . . . 0.0 113.263 -178.962 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.747 HG21 ' HG2' ' A' ' 52' ' ' GLN . 30.1 m -70.44 -50.65 44.17 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.18 0 N-CA-C 113.723 1.009 . . . . 0.0 113.723 -177.303 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 21' ' ' VAL . . . . . 0.67 HG11 ' CD2' ' A' ' 56' ' ' TYR . 65.3 t -65.48 -44.89 94.07 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 C-N-CA 120.249 -0.58 . . . . 0.0 112.073 -178.495 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 98.7 mt-10 -65.0 -42.66 94.3 Favored 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 112.763 0.653 . . . . 0.0 112.763 -179.129 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 74.1 m -66.51 -45.08 80.74 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-O 121.518 0.675 . . . . 0.0 110.501 -179.909 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 99.5 mm-40 -66.0 -37.93 87.18 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 114.859 -1.064 . . . . 0.0 109.114 179.065 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.427 ' HB2' ' O ' ' A' ' 21' ' ' VAL . . . -59.3 -40.36 85.93 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 114.725 -1.125 . . . . 0.0 109.516 -179.125 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 88.8 tt0 -66.15 -39.87 90.15 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.304 178.441 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 56.8 tp -64.31 -38.47 91.15 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.563 -179.591 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' TYR . . . . . 0.444 ' HB3' ' HB2' ' A' ' 37' ' ' ALA . 87.5 t80 -66.26 -36.74 83.77 Favored 'General case' 0 CA--C 1.503 -0.856 0 N-CA-C 107.695 -1.224 . . . . 0.0 107.695 177.762 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 95.1 mt-10 -64.94 -35.6 81.7 Favored 'General case' 0 N--CA 1.445 -0.682 0 N-CA-C 108.905 -0.776 . . . . 0.0 108.905 176.638 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 66.7 tp -62.36 -47.92 82.04 Favored 'General case' 0 N--CA 1.436 -1.141 0 N-CA-C 106.619 -1.623 . . . . 0.0 106.619 177.894 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 60.9 tptt -50.82 -50.57 56.14 Favored 'General case' 0 CA--C 1.523 -0.09 0 CA-C-N 115.115 -0.948 . . . . 0.0 109.279 177.371 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 27.5 m120 -129.55 102.17 6.26 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 114.63 -1.168 . . . . 0.0 109.891 179.172 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 11.3 t -87.08 -15.75 37.61 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 112.309 0.485 . . . . 0.0 112.309 -178.241 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 16.9 t-20 -59.92 -43.53 94.85 Favored 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 120.519 -0.472 . . . . 0.0 110.81 -179.079 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 70.9 mm-40 -109.79 -161.03 0.74 Allowed 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 179.791 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 75.8 mmtt -128.69 140.49 51.72 Favored 'General case' 0 N--CA 1.43 -1.466 0 N-CA-C 106.34 -1.726 . . . . 0.0 106.34 175.406 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' ALA . . . . . 0.444 ' HB2' ' HB3' ' A' ' 28' ' ' TYR . . . -51.03 163.81 0.19 Allowed 'General case' 0 C--N 1.315 -0.921 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 -179.535 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 38' ' ' SER . . . . . 0.532 ' HA ' HG22 ' A' ' 70' ' ' VAL . 19.7 m -135.47 144.69 46.55 Favored 'General case' 0 N--CA 1.433 -1.307 0 N-CA-C 107.226 -1.398 . . . . 0.0 107.226 177.97 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.431 HD21 ' HB1' ' A' ' 53' ' ' ALA . 8.5 tt -53.93 -40.64 66.92 Favored 'General case' 0 C--N 1.315 -0.901 0 N-CA-C 108.697 -0.853 . . . . 0.0 108.697 -178.365 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 92.8 p -65.3 -34.61 78.74 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.452 -0.794 . . . . 0.0 110.171 177.807 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' LYS . . . . . 0.404 ' HG3' ' HB2' ' A' ' 38' ' ' SER . 97.7 mttt -73.17 -49.18 29.54 Favored 'General case' 0 CA--C 1.513 -0.475 0 N-CA-C 114.122 1.156 . . . . 0.0 114.122 -178.883 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.439 HD23 HD22 ' A' ' 47' ' ' ASN . 96.3 mt -60.62 -40.58 92.4 Favored 'General case' 0 CA--C 1.49 -1.352 0 N-CA-C 107.243 -1.391 . . . . 0.0 107.243 -176.116 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.401 HG21 ' HA ' ' A' ' 50' ' ' GLN . 0.3 OUTLIER -70.04 -46.88 71.4 Favored 'Isoleucine or valine' 0 N--CA 1.397 -3.081 0 CA-C-N 111.815 -2.448 . . . . 0.0 111.251 -172.906 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 44' ' ' SER . . . . . 0.543 ' C ' ' H ' ' A' ' 46' ' ' GLY . 74.2 m -61.37 -45.77 93.0 Favored 'General case' 0 N--CA 1.407 -2.604 0 C-N-CA 116.242 -2.183 . . . . 0.0 105.997 178.511 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 45' ' ' SER . . . . . 0.424 ' O ' ' N ' ' A' ' 47' ' ' ASN . 26.4 t -50.6 6.23 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.967 0 CA-C-N 113.724 -1.58 . . . . 0.0 114.082 172.536 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 46' ' ' GLY . . . . . 0.543 ' H ' ' C ' ' A' ' 44' ' ' SER . . . 29.17 36.11 0.01 OUTLIER Glycine 0 C--N 1.351 1.374 0 C-N-CA 124.586 1.088 . . . . 0.0 113.25 -173.013 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 47' ' ' ASN . . . . . 0.439 HD22 HD23 ' A' ' 42' ' ' LEU . 95.5 m-20 -67.98 -39.55 83.27 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-O 122.779 1.275 . . . . 0.0 107.696 172.989 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 11.6 pt -131.7 159.43 43.08 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.858 0 CA-C-N 112.382 -2.19 . . . . 0.0 109.205 179.87 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' SER . . . . . 0.444 ' O ' ' N ' ' A' ' 52' ' ' GLN . 45.3 t -83.08 134.19 35.03 Favored 'General case' 0 C--O 1.211 -0.944 0 C-N-CA 120.494 -0.482 . . . . 0.0 111.14 -179.625 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 50' ' ' GLN . . . . . 0.456 ' HA ' ' HB3' ' A' ' 53' ' ' ALA . 66.4 tp60 -50.44 -18.48 0.65 Allowed 'General case' 0 C--O 1.212 -0.908 0 CA-C-N 116.279 -0.418 . . . . 0.0 111.61 -179.22 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 51' ' ' LYS . . . . . 0.407 ' CG ' ' N ' ' A' ' 52' ' ' GLN . 63.3 pttt -72.86 -40.6 65.53 Favored 'General case' 0 C--N 1.317 -0.831 0 N-CA-C 106.018 -1.845 . . . . 0.0 106.018 178.092 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 52' ' ' GLN . . . . . 0.747 ' HG2' HG21 ' A' ' 20' ' ' VAL . 0.0 OUTLIER -67.63 -53.01 31.51 Favored 'General case' 0 N--CA 1.424 -1.759 0 CA-C-N 112.082 -2.326 . . . . 0.0 106.549 176.483 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 53' ' ' ALA . . . . . 0.456 ' HB3' ' HA ' ' A' ' 50' ' ' GLN . . . -61.63 -38.9 89.36 Favored 'General case' 0 C--O 1.22 -0.46 0 C-N-CA 119.885 -0.726 . . . . 0.0 112.161 -177.579 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 98.0 m-20 -60.62 -39.83 89.66 Favored 'General case' 0 C--N 1.311 -1.092 0 C-N-CA 119.374 -0.93 . . . . 0.0 111.579 -179.718 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' SER . . . . . 0.461 ' CB ' HG21 ' A' ' 17' ' ' VAL . 67.3 m -64.62 -40.68 95.91 Favored 'General case' 0 C--N 1.31 -1.135 0 C-N-CA 119.751 -0.78 . . . . 0.0 111.147 179.147 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 56' ' ' TYR . . . . . 0.67 ' CD2' HG11 ' A' ' 21' ' ' VAL . 10.7 t80 -70.44 -39.98 74.02 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-O 122.069 0.938 . . . . 0.0 109.737 -178.66 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 64.4 tttm -58.48 -33.24 69.56 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 113.886 -1.506 . . . . 0.0 108.879 179.148 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' ALA . . . . . 0.449 ' HB3' ' O ' ' A' ' 55' ' ' SER . . . -61.4 -37.87 85.0 Favored 'General case' 0 N--CA 1.443 -0.803 0 CA-C-N 114.886 -1.052 . . . . 0.0 110.143 178.14 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 59' ' ' TYR . . . . . 0.567 ' HE1' HG11 ' A' ' 17' ' ' VAL . 73.2 m-85 . . . . . 0 C--N 1.342 0.281 0 C-N-CA 119.966 -0.694 . . . . 0.0 109.894 178.666 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.532 HG22 ' HA ' ' A' ' 38' ' ' SER . 4.0 p . . . . . 0 CA--C 1.54 0.57 0 N-CA-C 108.986 -0.746 . . . . 0.0 108.986 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.348 0.528 0 N-CA-C 113.79 1.033 . . . . 0.0 113.79 -174.901 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.365 0 CA-C-O 121.302 0.573 . . . . 0.0 110.815 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -62.03 -39.47 92.43 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.366 -0.834 . . . . 0.0 111.062 -178.837 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' VAL . . . . . 0.562 ' HA ' HG22 ' A' ' 20' ' ' VAL . 12.9 p -67.65 -28.19 40.92 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 C-N-CA 119.296 -0.962 . . . . 0.0 110.882 -178.994 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 58.3 t -61.13 -45.28 98.88 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.908 0 N-CA-C 108.491 -0.929 . . . . 0.0 108.491 179.402 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 40.2 ttpt -65.32 -39.94 93.08 Favored 'General case' 0 CA--C 1.541 0.606 0 N-CA-C 115.07 1.507 . . . . 0.0 115.07 -179.56 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.755 HG21 ' HG2' ' A' ' 52' ' ' GLN . 27.2 m -76.8 -51.09 19.78 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.298 0 N-CA-C 114.208 1.188 . . . . 0.0 114.208 -177.224 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 21' ' ' VAL . . . . . 0.485 ' N ' HG23 ' A' ' 20' ' ' VAL . 79.6 t -64.22 -44.87 97.5 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.748 0 N-CA-C 112.057 0.391 . . . . 0.0 112.057 -177.887 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 97.3 mt-10 -64.6 -40.18 95.06 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 112.911 0.708 . . . . 0.0 112.911 -179.682 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 47.8 t -65.84 -47.76 73.9 Favored 'General case' 0 N--CA 1.463 0.205 0 C-N-CA 120.209 -0.596 . . . . 0.0 110.212 178.878 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -65.28 -37.51 87.4 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.206 -0.906 . . . . 0.0 110.068 178.598 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.973 ' HB1' HG11 ' A' ' 70' ' ' VAL . . . -58.1 -43.89 87.34 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 -177.845 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 88.9 tt0 -61.63 -43.91 97.98 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 114.657 -1.156 . . . . 0.0 109.596 179.74 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 53.8 tp -65.88 -37.92 87.42 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.676 -0.693 . . . . 0.0 112.389 -179.646 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' TYR . . . . . 0.736 ' HB3' ' HB2' ' A' ' 37' ' ' ALA . 83.7 t80 -67.52 -39.46 85.1 Favored 'General case' 0 CA--C 1.509 -0.609 0 N-CA-C 106.942 -1.503 . . . . 0.0 106.942 178.896 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 29' ' ' GLU . . . . . 0.422 ' O ' ' N ' ' A' ' 33' ' ' THR . 94.4 mt-10 -61.94 -37.92 86.54 Favored 'General case' 0 N--CA 1.443 -0.803 0 N-CA-C 108.272 -1.01 . . . . 0.0 108.272 176.966 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 65.6 tp -63.49 -46.39 86.36 Favored 'General case' 0 N--CA 1.442 -0.872 0 N-CA-C 107.137 -1.431 . . . . 0.0 107.137 177.303 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 24.7 ttmm -50.46 -49.35 55.37 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-N 114.449 -1.25 . . . . 0.0 111.94 178.987 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 8.9 m120 -108.52 -57.33 2.14 Favored 'General case' 0 N--CA 1.479 1.003 0 N-CA-C 113.515 0.931 . . . . 0.0 113.515 -177.824 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.422 ' N ' ' O ' ' A' ' 29' ' ' GLU . 0.4 OUTLIER 80.79 -41.41 0.18 Allowed 'General case' 0 N--CA 1.471 0.616 0 O-C-N 123.793 0.683 . . . . 0.0 111.999 179.859 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 65.2 t30 -60.75 -39.26 88.07 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.558 -0.457 . . . . 0.0 109.961 179.666 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 16.8 pm0 -117.51 162.32 18.17 Favored 'General case' 0 CA--C 1.513 -0.464 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.62 178.847 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.511 ' HB2' ' HB2' ' A' ' 71' ' ' ALA . 99.2 mttt -99.73 136.27 39.9 Favored 'General case' 0 N--CA 1.431 -1.397 0 N-CA-C 108.43 -0.952 . . . . 0.0 108.43 177.613 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 37' ' ' ALA . . . . . 0.736 ' HB2' ' HB3' ' A' ' 28' ' ' TYR . . . -49.44 160.53 0.25 Allowed 'General case' 0 C--N 1.311 -1.107 0 CA-C-N 115.265 -0.879 . . . . 0.0 109.183 -179.687 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 38' ' ' SER . . . . . 0.412 ' H ' ' HB2' ' A' ' 41' ' ' LYS . 84.7 p -146.84 169.14 19.73 Favored 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 108.735 -0.839 . . . . 0.0 108.735 179.678 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.61 HD22 ' HA ' ' A' ' 53' ' ' ALA . 86.5 mt -60.53 -39.78 89.1 Favored 'General case' 0 C--N 1.314 -0.946 0 C-N-CA 118.508 -1.277 . . . . 0.0 108.414 179.672 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 75.4 m -64.6 -40.72 96.01 Favored 'General case' 0 C--N 1.319 -0.734 0 C-N-CA 120.459 -0.497 . . . . 0.0 111.948 178.621 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' LYS . . . . . 0.412 ' HB2' ' H ' ' A' ' 38' ' ' SER . 99.3 mttt -74.86 -54.16 7.78 Favored 'General case' 0 N--CA 1.472 0.67 0 N-CA-C 114.232 1.197 . . . . 0.0 114.232 -177.389 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.495 ' HG ' ' HB1' ' A' ' 37' ' ' ALA . 87.6 mt -59.79 -34.83 73.54 Favored 'General case' 0 CA--C 1.485 -1.533 0 N-CA-C 108.549 -0.908 . . . . 0.0 108.549 -175.853 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.539 HG23 ' O ' ' A' ' 48' ' ' ILE . 0.3 OUTLIER -80.99 -28.8 11.19 Favored 'Isoleucine or valine' 0 N--CA 1.405 -2.679 0 CA-C-N 114.051 -1.431 . . . . 0.0 112.136 -176.852 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 44' ' ' SER . . . . . 0.563 ' C ' ' H ' ' A' ' 46' ' ' GLY . 48.0 t -63.11 -49.93 72.5 Favored 'General case' 0 N--CA 1.428 -1.546 0 N-CA-C 103.922 -2.622 . . . . 0.0 103.922 176.337 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 45' ' ' SER . . . . . 0.455 ' O ' ' N ' ' A' ' 47' ' ' ASN . 63.0 m -51.49 -1.16 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.914 0 CA-C-N 112.278 -2.237 . . . . 0.0 112.744 171.362 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 46' ' ' GLY . . . . . 0.563 ' H ' ' C ' ' A' ' 44' ' ' SER . . . 29.27 28.36 0.01 OUTLIER Glycine 0 C--N 1.343 0.969 0 C-N-CA 126.082 1.801 . . . . 0.0 115.174 -172.834 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 47' ' ' ASN . . . . . 0.455 ' N ' ' O ' ' A' ' 45' ' ' SER . 39.7 t-20 -61.62 -42.52 98.99 Favored 'General case' 0 CA--C 1.512 -0.491 0 N-CA-C 104.225 -2.509 . . . . 0.0 104.225 175.571 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 0.539 ' O ' HG23 ' A' ' 43' ' ' VAL . 16.3 pt -118.22 136.02 56.73 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.023 0 CA-C-N 111.695 -2.502 . . . . 0.0 107.791 176.443 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 84.6 p -79.94 159.87 26.17 Favored 'General case' 0 C--N 1.317 -0.829 0 C-N-CA 119.666 -0.814 . . . . 0.0 110.45 -179.337 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' GLN . . . . . 0.515 ' HA ' ' HB3' ' A' ' 53' ' ' ALA . 60.7 tp60 -57.86 -8.16 0.9 Allowed 'General case' 0 CA--C 1.546 0.79 0 CA-C-N 115.95 -0.568 . . . . 0.0 112.023 -179.69 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 10.9 ptmt -78.83 -43.87 24.26 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 103.956 -2.609 . . . . 0.0 103.956 176.491 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' GLN . . . . . 0.755 ' HG2' HG21 ' A' ' 20' ' ' VAL . 1.4 mt-30 -68.37 -47.6 66.98 Favored 'General case' 0 N--CA 1.429 -1.49 0 CA-C-N 112.724 -2.034 . . . . 0.0 108.411 176.315 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 53' ' ' ALA . . . . . 0.61 ' HA ' HD22 ' A' ' 39' ' ' LEU . . . -63.78 -43.7 95.56 Favored 'General case' 0 C--N 1.343 0.284 0 C-N-CA 119.412 -0.915 . . . . 0.0 111.309 -178.384 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 98.0 m-20 -62.37 -29.31 70.38 Favored 'General case' 0 C--N 1.319 -0.756 0 C-N-CA 120.22 -0.592 . . . . 0.0 110.641 178.906 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' SER . . . . . 0.769 ' O ' ' HB3' ' A' ' 58' ' ' ALA . 47.5 t -64.47 -39.22 93.4 Favored 'General case' 0 N--CA 1.44 -0.939 0 CA-C-N 115.452 -0.795 . . . . 0.0 110.659 178.211 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 56' ' ' TYR . . . . . 0.564 ' HB3' HD21 ' A' ' 39' ' ' LEU . 0.4 OUTLIER -72.62 -40.22 66.62 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 118.886 -1.126 . . . . 0.0 111.606 -178.515 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -57.68 -28.83 64.13 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 107.275 -1.38 . . . . 0.0 107.275 176.334 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' ALA . . . . . 0.769 ' HB3' ' O ' ' A' ' 55' ' ' SER . . . -66.63 -39.67 88.4 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 112.606 -2.088 . . . . 0.0 109.694 175.937 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 89.9 t80 . . . . . 0 N--CA 1.47 0.575 0 CA-C-O 121.113 0.482 . . . . 0.0 110.754 177.211 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.973 HG11 ' HB1' ' A' ' 25' ' ' ALA . 0.0 OUTLIER . . . . . 0 N--CA 1.468 0.426 0 N-CA-C 108.621 -0.881 . . . . 0.0 108.621 . . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 71' ' ' ALA . . . . . 0.511 ' HB2' ' HB2' ' A' ' 36' ' ' LYS . . . . . . . . 0 N--CA 1.431 -1.382 0 C-N-CA 120.646 -0.422 . . . . 0.0 110.478 177.977 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.446 -0.643 0 CA-C-O 121.739 0.78 . . . . 0.0 109.641 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -62.14 -39.8 93.83 Favored 'General case' 0 N--CA 1.444 -0.73 0 CA-C-N 114.846 -1.07 . . . . 0.0 110.535 -179.274 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' VAL . . . . . 0.506 HG21 ' CB ' ' A' ' 55' ' ' SER . 11.8 p -62.66 -31.99 54.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 C-N-CA 117.873 -1.531 . . . . 0.0 110.646 -178.879 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 62.9 t -60.08 -46.4 94.39 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.743 0 N-CA-C 108.764 -0.828 . . . . 0.0 108.764 -179.084 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 40.2 ttpt -63.66 -38.38 90.91 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 115.043 1.497 . . . . 0.0 115.043 -179.612 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.491 HG23 ' N ' ' A' ' 21' ' ' VAL . 27.0 m -78.25 -54.38 12.31 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.306 0 N-CA-C 113.835 1.05 . . . . 0.0 113.835 -177.214 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 21' ' ' VAL . . . . . 0.491 ' N ' HG23 ' A' ' 20' ' ' VAL . 62.3 t -62.13 -43.75 98.18 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.764 0 C-N-CA 119.705 -0.798 . . . . 0.0 111.163 -178.274 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -65.27 -32.25 73.82 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 112.821 0.674 . . . . 0.0 112.821 -179.417 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 87.5 p -75.88 -47.64 24.63 Favored 'General case' 0 C--O 1.231 0.107 0 C-N-CA 119.671 -0.811 . . . . 0.0 111.744 179.306 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' GLN . . . . . 0.513 ' HB3' HD22 ' A' ' 42' ' ' LEU . 17.4 mp0 -72.07 -39.38 69.05 Favored 'General case' 0 C--O 1.22 -0.467 0 N-CA-C 112.183 0.438 . . . . 0.0 112.183 178.597 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -58.7 -41.46 86.36 Favored 'General case' 0 CA--C 1.512 -0.501 0 CA-C-O 121.422 0.629 . . . . 0.0 109.359 -177.321 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 54.0 tp10 -60.5 -46.66 89.29 Favored 'General case' 0 C--N 1.318 -0.775 0 N-CA-C 107.595 -1.261 . . . . 0.0 107.595 178.837 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 57.7 tp -64.23 -39.58 94.26 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.444 -0.798 . . . . 0.0 112.539 -179.086 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' TYR . . . . . 0.562 ' HD2' ' HB2' ' A' ' 37' ' ' ALA . 73.2 t80 -62.44 -44.08 97.28 Favored 'General case' 0 CA--C 1.505 -0.77 0 N-CA-C 106.4 -1.704 . . . . 0.0 106.4 179.305 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 93.3 mt-10 -60.25 -37.74 81.31 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 114.818 -1.083 . . . . 0.0 108.939 178.627 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 66.5 tp -61.88 -47.98 82.56 Favored 'General case' 0 N--CA 1.435 -1.175 0 C-N-CA 117.975 -1.49 . . . . 0.0 107.153 177.908 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -50.54 -50.75 52.52 Favored 'General case' 0 CA--C 1.519 -0.229 0 CA-C-N 115.543 -0.753 . . . . 0.0 109.473 177.529 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 82.2 m-20 -129.41 109.08 10.78 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 114.621 -1.172 . . . . 0.0 110.116 179.256 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 10.2 t -94.16 -15.64 24.45 Favored 'General case' 0 C--N 1.324 -0.529 0 C-N-CA 120.645 -0.422 . . . . 0.0 111.864 -179.149 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 28.6 m120 -60.81 -39.67 89.81 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.116 0.484 . . . . 0.0 109.831 -179.598 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 95.0 mt-10 -124.22 150.66 45.02 Favored 'General case' 0 CA--C 1.507 -0.699 0 N-CA-C 108.581 -0.896 . . . . 0.0 108.581 179.189 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 49.4 mmtm -89.03 137.82 31.97 Favored 'General case' 0 N--CA 1.43 -1.457 0 C-N-CA 118.567 -1.253 . . . . 0.0 108.906 178.122 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' ALA . . . . . 0.562 ' HB2' ' HD2' ' A' ' 28' ' ' TYR . . . -49.46 179.77 0.01 OUTLIER 'General case' 0 C--N 1.314 -0.964 0 CA-C-N 114.873 -1.058 . . . . 0.0 110.643 -179.949 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 38' ' ' SER . . . . . 0.41 ' H ' ' HB2' ' A' ' 41' ' ' LYS . 76.4 p -153.04 170.66 19.91 Favored 'General case' 0 C--N 1.315 -0.929 0 N-CA-C 108.546 -0.909 . . . . 0.0 108.546 178.419 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.725 HD21 ' HB3' ' A' ' 56' ' ' TYR . 87.7 mt -60.84 -43.08 98.77 Favored 'General case' 0 C--N 1.312 -1.047 0 N-CA-C 107.748 -1.204 . . . . 0.0 107.748 179.689 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 74.7 m -63.08 -40.44 97.68 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.488 -0.778 . . . . 0.0 112.298 179.562 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' LYS . . . . . 0.41 ' HB2' ' H ' ' A' ' 38' ' ' SER . 68.4 mttm -63.55 -48.72 76.34 Favored 'General case' 0 N--CA 1.47 0.567 0 N-CA-C 113.43 0.9 . . . . 0.0 113.43 -177.988 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.513 HD22 ' HB3' ' A' ' 24' ' ' GLN . 92.3 mt -60.98 -35.32 76.49 Favored 'General case' 0 CA--C 1.494 -1.186 0 N-CA-C 107.405 -1.331 . . . . 0.0 107.405 -177.757 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.654 ' CG2' ' HB2' ' A' ' 53' ' ' ALA . 1.7 t -76.25 -31.73 21.47 Favored 'Isoleucine or valine' 0 N--CA 1.419 -2.017 0 CA-C-N 113.997 -1.456 . . . . 0.0 111.302 -178.952 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 44' ' ' SER . . . . . 0.562 ' C ' ' H ' ' A' ' 46' ' ' GLY . 75.0 m -62.34 -51.28 68.26 Favored 'General case' 0 N--CA 1.431 -1.402 0 N-CA-C 104.905 -2.258 . . . . 0.0 104.905 177.398 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 45' ' ' SER . . . . . 0.414 ' O ' ' N ' ' A' ' 47' ' ' ASN . 69.9 m -51.75 -4.36 0.02 OUTLIER 'General case' 0 CA--C 1.549 0.929 0 CA-C-N 113.23 -1.804 . . . . 0.0 112.151 170.644 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 46' ' ' GLY . . . . . 0.562 ' H ' ' C ' ' A' ' 44' ' ' SER . . . 28.75 34.64 0.01 OUTLIER Glycine 0 C--N 1.346 1.106 0 C-N-CA 126.034 1.778 . . . . 0.0 113.6 -172.68 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 47' ' ' ASN . . . . . 0.414 ' N ' ' O ' ' A' ' 45' ' ' SER . 57.0 t-20 -63.85 -44.7 92.38 Favored 'General case' 0 CA--C 1.513 -0.462 0 N-CA-C 106.113 -1.81 . . . . 0.0 106.113 176.152 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 0.644 ' O ' HD12 ' A' ' 48' ' ' ILE . 1.2 pp -117.47 160.8 16.75 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.936 0 CA-C-N 111.329 -2.669 . . . . 0.0 108.649 179.829 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 88.6 p -77.73 170.99 15.64 Favored 'General case' 0 N--CA 1.446 -0.65 0 CA-C-O 121.583 0.706 . . . . 0.0 112.089 -178.401 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' GLN . . . . . 0.405 ' HA ' HG21 ' A' ' 43' ' ' VAL . 1.0 OUTLIER -57.24 -50.1 73.94 Favored 'General case' 0 N--CA 1.437 -1.121 0 CA-C-N 115.084 -0.962 . . . . 0.0 110.347 -179.782 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 51' ' ' LYS . . . . . 0.438 ' O ' ' N ' ' A' ' 55' ' ' SER . 64.1 pttt -61.13 -25.9 67.31 Favored 'General case' 0 CA--C 1.479 -1.779 0 O-C-N 120.836 -1.165 . . . . 0.0 110.09 -178.218 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 52' ' ' GLN . . . . . 0.415 ' HG2' HG21 ' A' ' 20' ' ' VAL . 3.2 tm0? -64.96 -38.14 89.98 Favored 'General case' 0 N--CA 1.423 -1.806 0 N-CA-C 105.146 -2.168 . . . . 0.0 105.146 176.186 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 53' ' ' ALA . . . . . 0.654 ' HB2' ' CG2' ' A' ' 43' ' ' VAL . . . -66.07 -49.04 69.02 Favored 'General case' 0 C--N 1.349 0.559 0 C-N-CA 118.09 -1.444 . . . . 0.0 110.786 176.522 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 96.2 m-20 -76.0 -13.97 60.23 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 118.986 -1.085 . . . . 0.0 113.628 -178.782 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' SER . . . . . 0.772 ' O ' ' HB3' ' A' ' 58' ' ' ALA . 48.8 m -68.27 -38.77 82.07 Favored 'General case' 0 C--N 1.31 -1.13 0 N-CA-C 109.736 -0.468 . . . . 0.0 109.736 179.162 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 56' ' ' TYR . . . . . 0.725 ' HB3' HD21 ' A' ' 39' ' ' LEU . 1.6 t80 -73.63 -37.22 65.42 Favored 'General case' 0 N--CA 1.465 0.295 0 C-N-CA 117.654 -1.618 . . . . 0.0 108.372 179.603 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -57.96 -30.34 65.93 Favored 'General case' 0 C--O 1.221 -0.439 0 N-CA-C 107.021 -1.474 . . . . 0.0 107.021 175.894 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' ALA . . . . . 0.772 ' HB3' ' O ' ' A' ' 55' ' ' SER . . . -65.48 -38.79 90.79 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 112.431 -2.168 . . . . 0.0 109.37 176.506 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 83.8 t80 . . . . . 0 C--N 1.344 0.33 0 CA-C-O 121.564 0.697 . . . . 0.0 109.325 176.699 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 2.5 p . . . . . 0 C--O 1.217 -0.608 0 N-CA-C 108.708 -0.849 . . . . 0.0 108.708 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.342 0 C-N-CA 119.455 -0.898 . . . . 0.0 113.42 -176.216 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.236 0.372 0 CA-C-O 122.57 1.176 . . . . 0.0 108.549 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -60.61 -36.09 77.73 Favored 'General case' 0 N--CA 1.443 -0.809 0 CA-C-N 113.48 -1.691 . . . . 0.0 109.838 179.515 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' VAL . . . . . 0.682 HG21 ' HB2' ' A' ' 55' ' ' SER . 0.3 OUTLIER -53.24 -29.72 16.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 C-N-CA 119.827 -0.749 . . . . 0.0 110.195 -178.119 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 18' ' ' VAL . . . . . 0.401 HG13 ' HE1' ' A' ' 56' ' ' TYR . 53.1 t -70.03 -44.0 78.73 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 N-CA-C 108.745 -0.835 . . . . 0.0 108.745 177.134 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 29.5 tptp -63.57 -44.38 94.24 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 114.58 -1.191 . . . . 0.0 113.551 -179.389 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.725 HG21 ' HG2' ' A' ' 52' ' ' GLN . 34.0 m -66.99 -43.02 89.38 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.181 0 N-CA-C 112.756 0.65 . . . . 0.0 112.756 -176.993 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 21' ' ' VAL . . . . . 0.569 HG21 ' HB2' ' A' ' 56' ' ' TYR . 53.2 t -62.46 -47.2 94.14 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 C-N-CA 118.82 -1.152 . . . . 0.0 110.999 -179.293 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 79.7 mm-40 -66.02 -39.85 90.56 Favored 'General case' 0 C--N 1.332 -0.192 0 N-CA-C 112.091 0.404 . . . . 0.0 112.091 -179.935 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 48.4 t -63.93 -48.35 76.9 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-O 121.95 0.881 . . . . 0.0 108.887 178.553 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' GLN . . . . . 0.45 ' HG3' HD22 ' A' ' 42' ' ' LEU . 12.5 tp-100 -61.87 -39.28 91.35 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 113.962 -1.472 . . . . 0.0 109.78 179.653 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.843 ' CB ' HG11 ' A' ' 70' ' ' VAL . . . -57.78 -49.98 74.79 Favored 'General case' 0 N--CA 1.447 -0.61 0 N-CA-C 108.277 -1.009 . . . . 0.0 108.277 -178.133 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 88.8 tt0 -65.35 -39.25 92.12 Favored 'General case' 0 CA--C 1.51 -0.565 0 CA-C-N 115.903 -0.59 . . . . 0.0 111.359 179.687 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 61.8 tp -61.39 -42.19 98.32 Favored 'General case' 0 N--CA 1.447 -0.588 0 C-N-CA 119.332 -0.947 . . . . 0.0 108.778 -179.789 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' TYR . . . . . 0.448 ' HB3' ' HB2' ' A' ' 37' ' ' ALA . 89.8 t80 -60.99 -43.7 98.47 Favored 'General case' 0 N--CA 1.44 -0.946 0 N-CA-C 107.043 -1.466 . . . . 0.0 107.043 178.47 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -61.18 -31.21 70.96 Favored 'General case' 0 N--CA 1.446 -0.649 0 N-CA-C 109.875 -0.417 . . . . 0.0 109.875 178.618 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 67.0 tp -64.63 -48.72 73.81 Favored 'General case' 0 N--CA 1.44 -0.963 0 N-CA-C 106.302 -1.74 . . . . 0.0 106.302 176.91 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 64.5 tttp -51.58 -50.77 59.5 Favored 'General case' 0 CA--C 1.52 -0.185 0 CA-C-N 115.046 -0.979 . . . . 0.0 109.263 177.396 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 98.6 m-20 -129.78 98.96 4.96 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 114.499 -1.228 . . . . 0.0 110.055 179.444 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 12.7 t -76.9 -14.74 59.84 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 112.258 0.466 . . . . 0.0 112.258 -178.926 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 98.9 m-20 -61.3 -43.09 99.46 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 120.559 -0.456 . . . . 0.0 111.836 -178.175 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 99.2 mt-10 -108.1 -173.59 2.32 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.685 0.279 . . . . 0.0 111.112 -178.574 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 14.4 mptt -121.03 120.82 36.5 Favored 'General case' 0 N--CA 1.444 -0.752 0 N-CA-C 107.575 -1.268 . . . . 0.0 107.575 177.332 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' ALA . . . . . 0.448 ' HB2' ' HB3' ' A' ' 28' ' ' TYR . . . -54.9 149.8 11.0 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-O 121.073 0.464 . . . . 0.0 111.42 -177.729 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 38' ' ' SER . . . . . 0.637 ' HB3' ' HB3' ' A' ' 71' ' ' ALA . 89.1 p -137.03 159.18 42.64 Favored 'General case' 0 N--CA 1.444 -0.763 0 CA-C-N 115.079 -0.964 . . . . 0.0 109.766 -179.645 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.543 ' CD2' ' HB1' ' A' ' 53' ' ' ALA . 2.0 tt -52.3 -48.32 65.43 Favored 'General case' 0 C--N 1.311 -1.082 0 CA-C-N 115.248 -0.887 . . . . 0.0 110.296 -178.38 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 47.9 t -62.54 -42.92 99.84 Favored 'General case' 0 C--N 1.313 -0.981 0 CA-C-N 115.243 -0.89 . . . . 0.0 110.61 179.456 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 29.1 mtpp -65.52 -49.91 67.21 Favored 'General case' 0 CA--C 1.513 -0.473 0 N-CA-C 114.052 1.13 . . . . 0.0 114.052 -177.777 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.521 HD11 ' HA ' ' A' ' 25' ' ' ALA . 98.0 mt -61.1 -40.03 92.2 Favored 'General case' 0 CA--C 1.485 -1.549 0 CA-C-O 122.499 1.142 . . . . 0.0 108.08 -176.298 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -72.27 -45.37 61.54 Favored 'Isoleucine or valine' 0 N--CA 1.402 -2.862 0 CA-C-N 112.302 -2.226 . . . . 0.0 111.038 -172.48 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 44' ' ' SER . . . . . 0.531 ' C ' ' H ' ' A' ' 46' ' ' GLY . 46.7 t -61.25 -47.83 84.22 Favored 'General case' 0 N--CA 1.419 -2.023 0 C-N-CA 116.101 -2.239 . . . . 0.0 105.993 177.574 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 45' ' ' SER . . . . . 0.416 ' O ' ' N ' ' A' ' 47' ' ' ASN . 33.4 t -49.91 6.75 0.0 OUTLIER 'General case' 0 N--CA 1.479 1.023 0 CA-C-N 113.844 -1.526 . . . . 0.0 114.47 173.148 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 46' ' ' GLY . . . . . 0.531 ' H ' ' C ' ' A' ' 44' ' ' SER . . . 28.83 37.4 0.01 OUTLIER Glycine 0 C--N 1.346 1.136 0 C-N-CA 124.479 1.037 . . . . 0.0 113.428 -173.437 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 47' ' ' ASN . . . . . 0.416 ' N ' ' O ' ' A' ' 45' ' ' SER . 21.6 m120 -66.72 -38.78 87.39 Favored 'General case' 0 CA--C 1.512 -0.493 0 N-CA-C 106.724 -1.584 . . . . 0.0 106.724 173.339 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 0.416 HG23 ' HG2' ' A' ' 24' ' ' GLN . 11.2 pt -137.09 -166.5 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.44 -0.967 0 CA-C-N 112.259 -2.246 . . . . 0.0 107.251 179.302 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 84.8 p -127.99 148.73 50.54 Favored 'General case' 0 C--N 1.321 -0.631 0 C-N-CA 119.986 -0.686 . . . . 0.0 110.639 178.938 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' GLN . . . . . 0.734 ' HA ' ' HB3' ' A' ' 53' ' ' ALA . 2.7 mt-30 -54.11 0.47 0.02 OUTLIER 'General case' 0 C--O 1.214 -0.768 0 N-CA-C 114.577 1.325 . . . . 0.0 114.577 -177.133 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 51' ' ' LYS . . . . . 0.413 ' CG ' ' N ' ' A' ' 52' ' ' GLN . 62.8 pttt -77.06 -41.74 41.13 Favored 'General case' 0 C--N 1.313 -1.008 0 N-CA-C 103.679 -2.712 . . . . 0.0 103.679 175.934 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 52' ' ' GLN . . . . . 0.725 ' HG2' HG21 ' A' ' 20' ' ' VAL . 11.0 mt-30 -71.2 -53.43 14.44 Favored 'General case' 0 N--CA 1.423 -1.823 0 CA-C-N 111.891 -2.413 . . . . 0.0 107.829 176.312 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 53' ' ' ALA . . . . . 0.734 ' HB3' ' HA ' ' A' ' 50' ' ' GLN . . . -62.66 -40.73 97.99 Favored 'General case' 0 C--O 1.216 -0.678 0 N-CA-C 112.962 0.727 . . . . 0.0 112.962 -177.088 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -62.54 -39.53 93.92 Favored 'General case' 0 C--N 1.311 -1.106 0 C-N-CA 118.709 -1.197 . . . . 0.0 113.319 -178.651 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' SER . . . . . 0.682 ' HB2' HG21 ' A' ' 17' ' ' VAL . 75.8 m -65.44 -42.04 92.81 Favored 'General case' 0 C--N 1.316 -0.888 0 C-N-CA 118.987 -1.085 . . . . 0.0 110.555 179.575 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 56' ' ' TYR . . . . . 0.569 ' HB2' HG21 ' A' ' 21' ' ' VAL . 3.1 t80 -72.65 -30.41 64.26 Favored 'General case' 0 C--N 1.334 -0.102 0 C-N-CA 118.988 -1.085 . . . . 0.0 109.405 -179.058 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -61.21 -37.24 82.3 Favored 'General case' 0 CA--C 1.501 -0.925 0 N-CA-C 108.186 -1.042 . . . . 0.0 108.186 177.59 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -65.86 -20.27 66.17 Favored 'General case' 0 N--CA 1.434 -1.24 0 CA-C-N 114.558 -1.201 . . . . 0.0 109.714 178.463 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 88.4 t80 . . . . . 0 CA--C 1.531 0.22 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 176.083 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.843 HG11 ' CB ' ' A' ' 25' ' ' ALA . 13.4 m . . . . . 0 N--CA 1.469 0.517 0 CA-C-O 119.914 -0.089 . . . . 0.0 111.212 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' ALA . . . . . 0.637 ' HB3' ' HB3' ' A' ' 38' ' ' SER . . . . . . . . 0 N--CA 1.437 -1.088 0 C-N-CA 119.108 -1.037 . . . . 0.0 112.444 -176.438 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.453 -0.28 0 CA-C-O 122.044 0.926 . . . . 0.0 108.744 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -60.32 -37.3 80.17 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-N 114.32 -1.309 . . . . 0.0 110.036 179.894 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' VAL . . . . . 0.856 HG21 ' HB2' ' A' ' 55' ' ' SER . 0.8 OUTLIER -54.09 -31.75 21.99 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 C-N-CA 119.296 -0.962 . . . . 0.0 109.599 -178.275 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 66.1 t -64.11 -46.88 92.42 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 N-CA-C 107.699 -1.222 . . . . 0.0 107.699 177.641 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 41.0 ttmt -60.37 -44.39 95.64 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-N 114.064 -1.426 . . . . 0.0 113.482 -177.997 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.613 HG21 ' CG ' ' A' ' 52' ' ' GLN . 28.5 m -68.14 -49.7 65.16 Favored 'Isoleucine or valine' 0 N--CA 1.46 0.055 0 CA-C-N 118.833 0.742 . . . . 0.0 111.827 -178.59 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 21' ' ' VAL . . . . . 0.682 HG21 ' HB2' ' A' ' 56' ' ' TYR . 54.0 t -61.23 -47.78 91.94 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.851 0 C-N-CA 119.846 -0.742 . . . . 0.0 111.529 -177.954 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -68.46 -29.83 68.56 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 112.605 0.595 . . . . 0.0 112.605 -179.247 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 70.9 m -73.45 -50.79 19.82 Favored 'General case' 0 N--CA 1.464 0.249 0 C-N-CA 119.771 -0.771 . . . . 0.0 109.351 177.732 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 99.8 mm-40 -65.04 -37.7 88.43 Favored 'General case' 0 C--O 1.217 -0.649 0 CA-C-N 114.648 -1.16 . . . . 0.0 109.595 179.953 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.7 ' HB1' ' HB ' ' A' ' 70' ' ' VAL . . . -55.37 -44.95 76.52 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 108.126 -1.064 . . . . 0.0 108.126 -177.872 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 88.9 tt0 -66.61 -38.45 87.0 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.451 -0.795 . . . . 0.0 110.803 178.364 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 66.5 tp -63.75 -45.82 88.14 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.17 -0.923 . . . . 0.0 109.937 179.392 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' TYR . . . . . 0.582 ' CD2' ' HB2' ' A' ' 37' ' ' ALA . 38.8 t80 -65.94 -40.05 91.01 Favored 'General case' 0 N--CA 1.441 -0.917 0 N-CA-C 107.261 -1.385 . . . . 0.0 107.261 -178.919 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 95.6 mt-10 -72.91 -10.85 60.25 Favored 'General case' 0 N--CA 1.441 -0.884 0 CA-C-N 115.083 -0.962 . . . . 0.0 110.287 177.432 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.404 ' HA ' HD12 ' A' ' 30' ' ' LEU . 62.7 tp -69.15 -48.22 62.92 Favored 'General case' 0 N--CA 1.437 -1.103 0 N-CA-C 104.25 -2.5 . . . . 0.0 104.25 174.843 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 64.9 tttp -51.5 -48.44 62.91 Favored 'General case' 0 CA--C 1.509 -0.629 0 CA-C-N 113.519 -1.673 . . . . 0.0 108.164 176.174 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 98.7 m-20 -128.6 94.56 3.9 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-N 114.492 -1.231 . . . . 0.0 110.738 -179.969 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 68.8 p -83.51 -15.37 49.62 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 120.882 -0.327 . . . . 0.0 111.429 -179.308 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 98.5 m-20 -95.01 4.03 54.24 Favored 'General case' 0 C--N 1.33 -0.248 0 C-N-CA 120.83 -0.348 . . . . 0.0 110.746 179.499 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 94.1 mt-10 -134.33 157.89 45.21 Favored 'General case' 0 CA--C 1.509 -0.599 0 N-CA-C 109.329 -0.619 . . . . 0.0 109.329 179.925 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 14.7 mptt -100.09 137.82 38.0 Favored 'General case' 0 N--CA 1.437 -1.104 0 N-CA-C 106.859 -1.534 . . . . 0.0 106.859 176.129 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' ALA . . . . . 0.582 ' HB2' ' CD2' ' A' ' 28' ' ' TYR . . . -85.98 -156.06 0.27 Allowed 'General case' 0 C--N 1.316 -0.85 0 N-CA-C 107.724 -1.213 . . . . 0.0 107.724 177.73 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 38' ' ' SER . . . . . 0.465 ' H ' ' HB2' ' A' ' 41' ' ' LYS . 79.0 p -160.91 168.92 23.66 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 175.96 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.554 ' HB3' ' HB1' ' A' ' 53' ' ' ALA . 72.7 mt -59.88 -46.8 88.18 Favored 'General case' 0 C--N 1.316 -0.885 0 C-N-CA 119.374 -0.93 . . . . 0.0 109.541 179.727 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 91.9 p -60.38 -34.42 73.87 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 120.431 -0.507 . . . . 0.0 109.682 179.858 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' LYS . . . . . 0.465 ' HB2' ' H ' ' A' ' 38' ' ' SER . 98.0 mttt -69.33 -36.77 77.26 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-O 121.078 0.465 . . . . 0.0 111.014 178.274 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.445 HD23 ' HA ' ' A' ' 42' ' ' LEU . 87.2 mt -69.25 -35.86 76.55 Favored 'General case' 0 CA--C 1.496 -1.102 0 CA-C-N 115.47 -0.787 . . . . 0.0 109.267 179.896 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.778 HG21 ' HA ' ' A' ' 50' ' ' GLN . 0.3 OUTLIER -80.27 -34.96 15.18 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.713 0 C-N-CA 119.264 -0.974 . . . . 0.0 110.908 -176.641 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 44' ' ' SER . . . . . 0.548 ' C ' ' H ' ' A' ' 46' ' ' GLY . 47.9 t -59.24 -51.15 71.22 Favored 'General case' 0 N--CA 1.431 -1.39 0 N-CA-C 104.635 -2.357 . . . . 0.0 104.635 179.691 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 45' ' ' SER . . . . . 0.433 ' O ' ' N ' ' A' ' 47' ' ' ASN . 24.7 p -54.41 12.65 0.0 OUTLIER 'General case' 0 CA--C 1.558 1.264 0 CA-C-N 113.926 -1.488 . . . . 0.0 113.677 170.429 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 46' ' ' GLY . . . . . 0.548 ' H ' ' C ' ' A' ' 44' ' ' SER . . . 28.59 33.78 0.01 OUTLIER Glycine 0 C--N 1.347 1.171 0 C-N-CA 125.201 1.382 . . . . 0.0 114.486 -173.161 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 47' ' ' ASN . . . . . 0.433 ' N ' ' O ' ' A' ' 45' ' ' SER . 19.1 m120 -66.95 -40.82 87.62 Favored 'General case' 0 CA--C 1.52 -0.186 0 CA-C-O 122.329 1.062 . . . . 0.0 109.138 174.519 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 0.594 ' O ' HG23 ' A' ' 43' ' ' VAL . 23.4 pt -137.37 164.76 28.63 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-N 113.098 -1.865 . . . . 0.0 111.716 -177.447 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 67.6 m -76.48 155.75 33.57 Favored 'General case' 0 N--CA 1.439 -0.983 0 N-CA-C 107.524 -1.287 . . . . 0.0 107.524 178.192 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' GLN . . . . . 0.778 ' HA ' HG21 ' A' ' 43' ' ' VAL . 71.5 tp60 -56.88 -46.4 81.91 Favored 'General case' 0 C--O 1.202 -1.401 0 C-N-CA 119.697 -0.801 . . . . 0.0 109.801 -179.163 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 21.9 pttp -64.11 -30.93 71.96 Favored 'General case' 0 CA--C 1.501 -0.939 0 CA-C-N 119.089 0.858 . . . . 0.0 110.709 -179.248 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' GLN . . . . . 0.613 ' CG ' HG21 ' A' ' 20' ' ' VAL . 12.0 tt0 -66.5 -38.14 86.59 Favored 'General case' 0 N--CA 1.421 -1.875 0 N-CA-C 103.639 -2.726 . . . . 0.0 103.639 177.437 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 53' ' ' ALA . . . . . 0.603 ' HB3' ' O ' ' A' ' 50' ' ' GLN . . . -65.96 -51.84 54.91 Favored 'General case' 0 N--CA 1.443 -0.777 0 CA-C-N 114.413 -1.267 . . . . 0.0 110.315 177.822 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 98.2 m-20 -58.11 -47.0 84.59 Favored 'General case' 0 CA--C 1.504 -0.805 0 C-N-CA 120.291 -0.563 . . . . 0.0 112.119 -177.172 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' SER . . . . . 0.856 ' HB2' HG21 ' A' ' 17' ' ' VAL . 74.2 m -53.8 -36.06 62.06 Favored 'General case' 0 N--CA 1.436 -1.172 0 C-N-CA 119.312 -0.955 . . . . 0.0 110.724 -177.282 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 56' ' ' TYR . . . . . 0.682 ' HB2' HG21 ' A' ' 21' ' ' VAL . 8.3 t80 -70.16 -41.51 73.73 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 116.996 -1.882 . . . . 0.0 109.052 176.984 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -47.92 -44.39 29.81 Favored 'General case' 0 CA--C 1.498 -1.042 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.22 -175.912 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -59.64 -51.28 70.5 Favored 'General case' 0 N--CA 1.434 -1.234 0 N-CA-C 106.959 -1.497 . . . . 0.0 106.959 179.432 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 91.9 t80 . . . . . 0 N--CA 1.466 0.356 0 N-CA-C 109.583 -0.525 . . . . 0.0 109.583 -177.236 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.7 ' HB ' ' HB1' ' A' ' 25' ' ' ALA . 7.4 p . . . . . 0 N--CA 1.446 -0.642 0 CA-C-O 121.404 0.621 . . . . 0.0 111.68 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.234 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.532 -178.446 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.235 0.337 0 CA-C-O 122.047 0.927 . . . . 0.0 110.97 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -59.93 -37.18 78.76 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 114.305 -1.316 . . . . 0.0 110.28 -178.419 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' VAL . . . . . 0.606 HG21 ' HB2' ' A' ' 55' ' ' SER . 2.6 p -53.28 -35.64 24.46 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 C-N-CA 119.34 -0.944 . . . . 0.0 109.919 -178.076 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 61.4 t -63.63 -48.48 86.57 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-O 121.635 0.731 . . . . 0.0 109.207 178.936 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -61.93 -43.77 98.16 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 114.637 -1.165 . . . . 0.0 113.587 -178.7 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.673 HG21 ' HG2' ' A' ' 52' ' ' GLN . 28.5 m -71.95 -54.11 17.87 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.186 0 C-N-CA 119.949 -0.7 . . . . 0.0 112.621 -178.321 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 21' ' ' VAL . . . . . 0.596 HG21 ' HB2' ' A' ' 56' ' ' TYR . 53.2 t -61.1 -45.32 98.8 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.666 0 C-N-CA 119.398 -0.921 . . . . 0.0 111.975 -177.38 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -61.72 -51.64 67.57 Favored 'General case' 0 C--N 1.331 -0.207 0 C-N-CA 118.557 -1.257 . . . . 0.0 109.973 -179.892 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 48.4 t -58.54 -48.73 79.9 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 120.26 -0.576 . . . . 0.0 110.801 -176.771 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 74.5 mm-40 -63.97 -40.38 96.26 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.647 0.737 . . . . 0.0 109.186 179.536 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.483 ' HB1' ' HB ' ' A' ' 70' ' ' VAL . . . -57.47 -42.76 83.24 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 114.608 -1.178 . . . . 0.0 110.484 -177.133 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 54.0 tp10 -65.24 -39.12 92.28 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.935 0.874 . . . . 0.0 109.18 178.394 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 53.6 tp -62.2 -44.22 97.08 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 114.316 -1.311 . . . . 0.0 109.622 -179.844 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 55.3 t80 -62.26 -38.85 90.87 Favored 'General case' 0 CA--C 1.504 -0.81 0 N-CA-C 107.475 -1.306 . . . . 0.0 107.475 -179.142 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' GLU . . . . . 0.44 ' O ' ' N ' ' A' ' 33' ' ' THR . 96.4 mt-10 -59.43 -43.79 93.01 Favored 'General case' 0 N--CA 1.44 -0.926 0 N-CA-C 106.72 -1.585 . . . . 0.0 106.72 178.694 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 64.3 tp -62.46 -43.58 98.47 Favored 'General case' 0 N--CA 1.443 -0.805 0 C-N-CA 118.513 -1.275 . . . . 0.0 108.743 178.387 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -49.03 -49.11 42.75 Favored 'General case' 0 CA--C 1.519 -0.224 0 CA-C-N 115.345 -0.843 . . . . 0.0 110.513 179.759 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 32.5 m120 -109.44 -66.11 1.09 Allowed 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 120.066 -0.654 . . . . 0.0 112.396 -179.356 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.44 ' N ' ' O ' ' A' ' 29' ' ' GLU . 0.2 OUTLIER 79.28 -34.75 0.15 Allowed 'General case' 0 N--CA 1.471 0.582 0 O-C-N 123.653 0.595 . . . . 0.0 112.53 179.067 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 99.2 m-20 -61.07 -39.28 89.3 Favored 'General case' 0 C--N 1.332 -0.162 0 N-CA-C 108.636 -0.876 . . . . 0.0 108.636 179.41 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 9.6 mm-40 -117.84 153.94 32.65 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 114.748 -1.115 . . . . 0.0 108.122 178.579 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -87.61 129.76 35.0 Favored 'General case' 0 N--CA 1.435 -1.215 0 C-N-CA 118.57 -1.252 . . . . 0.0 109.802 179.962 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' ALA . . . . . 0.666 ' C ' HG23 ' A' ' 70' ' ' VAL . . . -45.59 143.02 2.08 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 114.02 -1.446 . . . . 0.0 109.083 -178.522 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 38' ' ' SER . . . . . 0.556 ' CA ' HG23 ' A' ' 70' ' ' VAL . 14.2 m -122.92 147.91 46.06 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 107.198 -1.408 . . . . 0.0 107.198 179.818 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.675 HD21 ' HB1' ' A' ' 53' ' ' ALA . 7.7 tt -54.72 -50.24 68.82 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 108.448 -0.945 . . . . 0.0 108.448 -177.708 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 74.1 m -59.42 -38.66 81.2 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 179.586 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' LYS . . . . . 0.425 ' HB2' ' H ' ' A' ' 38' ' ' SER . 61.7 mtpt -65.85 -38.24 88.33 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 120.781 0.324 . . . . 0.0 111.864 178.714 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.575 ' CD1' HG21 ' A' ' 70' ' ' VAL . 88.5 mt -64.51 -38.73 92.02 Favored 'General case' 0 CA--C 1.485 -1.542 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 -178.025 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -81.93 -35.29 13.27 Favored 'Isoleucine or valine' 0 N--CA 1.417 -2.105 0 C-N-CA 118.956 -1.098 . . . . 0.0 110.92 -176.762 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 44' ' ' SER . . . . . 0.585 ' C ' ' H ' ' A' ' 46' ' ' GLY . 47.9 t -60.85 -50.87 71.69 Favored 'General case' 0 N--CA 1.43 -1.442 0 N-CA-C 105.353 -2.091 . . . . 0.0 105.353 178.583 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 45' ' ' SER . . . . . 0.452 ' O ' ' N ' ' A' ' 47' ' ' ASN . 89.6 p -54.08 9.5 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.125 0 CA-C-N 113.727 -1.579 . . . . 0.0 113.055 171.579 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 46' ' ' GLY . . . . . 0.585 ' H ' ' C ' ' A' ' 44' ' ' SER . . . 29.04 30.45 0.01 OUTLIER Glycine 0 C--N 1.343 0.964 0 C-N-CA 125.531 1.539 . . . . 0.0 114.613 -172.702 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 47' ' ' ASN . . . . . 0.452 ' N ' ' O ' ' A' ' 45' ' ' SER . 56.1 t30 -66.16 -42.66 88.67 Favored 'General case' 0 CA--C 1.517 -0.29 0 N-CA-C 104.874 -2.269 . . . . 0.0 104.874 175.193 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 36.2 pt -129.14 166.83 25.75 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.766 0 CA-C-N 111.619 -2.537 . . . . 0.0 107.902 177.922 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' SER . . . . . 0.537 ' C ' ' H ' ' A' ' 51' ' ' LYS . 67.6 m -119.5 156.5 30.14 Favored 'General case' 0 C--N 1.32 -0.702 0 C-N-CA 120.534 -0.466 . . . . 0.0 110.815 -179.151 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 50' ' ' GLN . . . . . 0.838 ' HA ' ' HB3' ' A' ' 53' ' ' ALA . 12.6 tp60 -50.84 6.14 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.348 0 N-CA-C 114.743 1.386 . . . . 0.0 114.743 -179.536 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 51' ' ' LYS . . . . . 0.537 ' H ' ' C ' ' A' ' 49' ' ' SER . 71.9 mmtt -83.43 -52.99 6.04 Favored 'General case' 0 C--N 1.309 -1.183 0 N-CA-C 104.757 -2.312 . . . . 0.0 104.757 176.147 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 52' ' ' GLN . . . . . 0.673 ' HG2' HG21 ' A' ' 20' ' ' VAL . 3.8 mt-30 -85.28 -29.22 24.76 Favored 'General case' 0 N--CA 1.431 -1.425 0 CA-C-N 110.989 -2.823 . . . . 0.0 110.333 178.105 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 53' ' ' ALA . . . . . 0.838 ' HB3' ' HA ' ' A' ' 50' ' ' GLN . . . -65.17 -49.99 67.66 Favored 'General case' 0 N--CA 1.443 -0.801 0 C-N-CA 118.304 -1.358 . . . . 0.0 109.606 179.8 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 99.2 m-20 -60.9 -51.84 67.58 Favored 'General case' 0 CA--C 1.498 -1.038 0 C-N-CA 117.932 -1.507 . . . . 0.0 112.13 -178.152 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' SER . . . . . 0.606 ' HB2' HG21 ' A' ' 17' ' ' VAL . 67.2 m -56.67 -38.27 71.99 Favored 'General case' 0 N--CA 1.434 -1.269 0 C-N-CA 118.534 -1.267 . . . . 0.0 112.122 -175.62 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 56' ' ' TYR . . . . . 0.596 ' HB2' HG21 ' A' ' 21' ' ' VAL . 22.9 t80 -72.21 -39.5 68.51 Favored 'General case' 0 CA--C 1.516 -0.355 0 C-N-CA 117.488 -1.685 . . . . 0.0 109.627 178.806 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 64.8 tttp -50.71 -40.27 53.66 Favored 'General case' 0 CA--C 1.493 -1.221 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.453 -176.348 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -59.13 -50.86 72.43 Favored 'General case' 0 N--CA 1.431 -1.391 0 N-CA-C 106.459 -1.682 . . . . 0.0 106.459 178.783 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 90.1 t80 . . . . . 0 N--CA 1.473 0.703 0 C-N-CA 120.02 -0.672 . . . . 0.0 110.14 -176.345 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.666 HG23 ' C ' ' A' ' 37' ' ' ALA . 0.1 OUTLIER . . . . . 0 CA--C 1.542 0.662 0 N-CA-C 107.269 -1.382 . . . . 0.0 107.269 . . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.463 0 O-C-N 121.014 -1.053 . . . . 0.0 113.327 -175.777 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.513 -0.463 0 CA-C-O 121.369 0.604 . . . . 0.0 111.517 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -61.92 -39.42 91.97 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 115.481 -0.782 . . . . 0.0 110.826 -178.87 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' VAL . . . . . 0.533 ' HA ' HG22 ' A' ' 20' ' ' VAL . 14.1 p -67.8 -28.96 43.42 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 C-N-CA 118.98 -1.088 . . . . 0.0 111.113 -179.046 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 55.8 t -60.55 -44.61 97.0 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.821 0 N-CA-C 108.955 -0.758 . . . . 0.0 108.955 -179.236 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.1 tmmt? -65.44 -36.01 82.64 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 114.99 -1.005 . . . . 0.0 113.631 -179.685 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.533 HG22 ' HA ' ' A' ' 17' ' ' VAL . 33.0 m -82.96 -49.9 16.3 Favored 'Isoleucine or valine' 0 C--N 1.342 0.263 0 O-C-N 121.449 -0.782 . . . . 0.0 113.086 -178.527 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 21' ' ' VAL . . . . . 0.509 ' N ' HG23 ' A' ' 20' ' ' VAL . 59.3 t -63.1 -44.75 99.65 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 C-N-CA 120.309 -0.556 . . . . 0.0 111.258 -178.861 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 96.3 mt-10 -60.72 -42.48 97.35 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 119.884 -0.727 . . . . 0.0 111.467 -178.988 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 74.6 m -64.9 -42.74 94.49 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 119.542 -0.863 . . . . 0.0 110.816 179.349 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 28.3 mm100 -68.97 -40.19 79.0 Favored 'General case' 0 CA--C 1.53 0.177 0 C-N-CA 120.467 -0.493 . . . . 0.0 110.757 -178.948 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.431 ' O ' ' HG3' ' A' ' 29' ' ' GLU . . . -58.04 -41.49 83.39 Favored 'General case' 0 CA--C 1.502 -0.889 0 N-CA-C 108.61 -0.885 . . . . 0.0 108.61 -177.9 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 89.0 tt0 -59.79 -43.48 94.38 Favored 'General case' 0 C--N 1.31 -1.144 0 CA-C-N 114.084 -1.416 . . . . 0.0 108.354 179.088 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 60.2 tp -68.41 -39.15 81.72 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 113.162 0.801 . . . . 0.0 113.162 -179.651 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' TYR . . . . . 0.515 ' HD2' ' HB2' ' A' ' 37' ' ' ALA . 94.1 t80 -63.51 -49.36 73.84 Favored 'General case' 0 CA--C 1.494 -1.21 0 N-CA-C 108.465 -0.939 . . . . 0.0 108.465 -179.561 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 29' ' ' GLU . . . . . 0.431 ' HG3' ' O ' ' A' ' 25' ' ' ALA . 2.6 pp20? -69.18 -23.21 63.9 Favored 'General case' 0 N--CA 1.428 -1.558 0 C-N-CA 118.997 -1.081 . . . . 0.0 109.022 178.235 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 64.3 tp -63.9 -49.05 74.22 Favored 'General case' 0 N--CA 1.44 -0.948 0 N-CA-C 105.828 -1.916 . . . . 0.0 105.828 177.803 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -51.01 -49.21 60.89 Favored 'General case' 0 CA--C 1.519 -0.239 0 CA-C-N 114.275 -1.33 . . . . 0.0 108.805 176.159 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 98.7 m-20 -127.24 106.96 9.59 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-N 114.828 -1.078 . . . . 0.0 109.967 179.507 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 76.6 p -90.3 -2.44 58.01 Favored 'General case' 0 C--N 1.324 -0.524 0 C-N-CA 120.287 -0.565 . . . . 0.0 112.307 -177.948 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 66.5 t30 -60.26 -38.22 82.84 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 108.451 -0.944 . . . . 0.0 108.451 179.385 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 21.0 pt-20 -139.88 157.56 45.51 Favored 'General case' 0 CA--C 1.506 -0.742 0 CA-C-N 114.664 -1.153 . . . . 0.0 111.259 179.053 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 30.4 mtpp -89.36 145.37 25.39 Favored 'General case' 0 N--CA 1.425 -1.696 0 C-N-CA 119.625 -0.83 . . . . 0.0 108.86 177.459 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' ALA . . . . . 0.515 ' HB2' ' HD2' ' A' ' 28' ' ' TYR . . . -57.41 -178.97 0.04 OUTLIER 'General case' 0 C--N 1.297 -1.682 0 CA-C-N 114.202 -1.363 . . . . 0.0 109.157 179.354 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 38' ' ' SER . . . . . 0.442 ' OG ' ' HG3' ' A' ' 41' ' ' LYS . 59.7 p -154.41 168.31 27.08 Favored 'General case' 0 C--N 1.315 -0.892 0 C-N-CA 120.048 -0.661 . . . . 0.0 109.464 178.018 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.432 HD11 ' HB2' ' A' ' 57' ' ' LYS . 6.3 tt -57.62 -44.62 85.66 Favored 'General case' 0 C--N 1.31 -1.136 0 N-CA-C 107.658 -1.238 . . . . 0.0 107.658 -179.361 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 94.0 p -70.81 -37.08 73.22 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 115.187 -0.915 . . . . 0.0 113.033 178.616 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' LYS . . . . . 0.442 ' HG3' ' OG ' ' A' ' 38' ' ' SER . 97.9 mttt -69.69 -50.92 39.21 Favored 'General case' 0 N--CA 1.471 0.582 0 N-CA-C 113.278 0.844 . . . . 0.0 113.278 -177.914 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.604 ' HB3' HG12 ' A' ' 48' ' ' ILE . 89.9 mt -61.73 -38.05 86.5 Favored 'General case' 0 CA--C 1.482 -1.635 0 CA-C-O 122.225 1.012 . . . . 0.0 108.665 -176.129 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.41 HG21 ' CB ' ' A' ' 53' ' ' ALA . 0.4 OUTLIER -81.44 -26.55 10.19 Favored 'Isoleucine or valine' 0 N--CA 1.404 -2.757 0 CA-C-N 113.316 -1.765 . . . . 0.0 112.285 -177.056 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 44' ' ' SER . . . . . 0.583 ' C ' ' H ' ' A' ' 46' ' ' GLY . 48.0 t -65.81 -50.42 64.71 Favored 'General case' 0 N--CA 1.422 -1.874 0 N-CA-C 102.963 -2.977 . . . . 0.0 102.963 175.294 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 45' ' ' SER . . . . . 0.496 ' O ' ' N ' ' A' ' 47' ' ' ASN . 60.3 m -51.97 2.53 0.01 OUTLIER 'General case' 0 CA--C 1.547 0.846 0 CA-C-N 111.443 -2.617 . . . . 0.0 113.214 170.902 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 46' ' ' GLY . . . . . 0.583 ' H ' ' C ' ' A' ' 44' ' ' SER . . . 28.89 21.21 0.0 OUTLIER Glycine 0 CA--C 1.536 1.346 0 C-N-CA 126.478 1.989 . . . . 0.0 116.389 -172.771 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 47' ' ' ASN . . . . . 0.496 ' N ' ' O ' ' A' ' 45' ' ' SER . 1.0 OUTLIER -59.8 -55.25 36.52 Favored 'General case' 0 CA--C 1.507 -0.693 0 N-CA-C 104.602 -2.37 . . . . 0.0 104.602 177.74 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 0.604 HG12 ' HB3' ' A' ' 42' ' ' LEU . 29.5 pt -92.95 146.72 6.04 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.242 0 N-CA-C 104.1 -2.555 . . . . 0.0 104.1 174.47 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 49' ' ' SER . . . . . 0.401 ' O ' ' N ' ' A' ' 52' ' ' GLN . 68.2 m -98.82 163.22 12.71 Favored 'General case' 0 C--N 1.311 -1.091 0 C-N-CA 119.309 -0.956 . . . . 0.0 110.903 -178.177 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 63.3 tp60 -50.22 -15.24 0.21 Allowed 'General case' 0 C--N 1.308 -1.21 0 CA-C-N 114.569 -1.196 . . . . 0.0 112.041 -177.479 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 26.0 pttm -81.62 -36.17 29.21 Favored 'General case' 0 CA--C 1.516 -0.351 0 N-CA-C 107.201 -1.407 . . . . 0.0 107.201 177.618 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' GLN . . . . . 0.521 ' HG2' HG21 ' A' ' 20' ' ' VAL . 7.8 mt-30 -79.14 -23.34 44.06 Favored 'General case' 0 N--CA 1.439 -0.979 0 CA-C-N 113.047 -1.888 . . . . 0.0 109.603 176.559 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 53' ' ' ALA . . . . . 0.41 ' CB ' HG21 ' A' ' 43' ' ' VAL . . . -84.7 -44.67 13.17 Favored 'General case' 0 C--O 1.219 -0.529 0 C-N-CA 118.785 -1.166 . . . . 0.0 108.279 175.151 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 99.8 m-20 -63.68 -38.99 93.19 Favored 'General case' 0 CA--C 1.506 -0.714 0 CA-C-N 114.966 -1.016 . . . . 0.0 111.265 179.015 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' SER . . . . . 0.726 ' O ' ' HB3' ' A' ' 58' ' ' ALA . 67.6 m -65.7 -40.99 92.86 Favored 'General case' 0 N--CA 1.437 -1.085 0 C-N-CA 119.563 -0.855 . . . . 0.0 110.109 178.866 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 56' ' ' TYR . . . . . 0.422 ' HB2' HG21 ' A' ' 21' ' ' VAL . 3.5 t80 -71.48 -40.61 70.12 Favored 'General case' 0 C--N 1.342 0.263 0 C-N-CA 118.333 -1.347 . . . . 0.0 109.916 -179.109 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 57' ' ' LYS . . . . . 0.432 ' HB2' HD11 ' A' ' 39' ' ' LEU . 88.7 tttt -58.23 -24.1 58.11 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.112 -0.949 . . . . 0.0 108.495 177.806 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 58' ' ' ALA . . . . . 0.726 ' HB3' ' O ' ' A' ' 55' ' ' SER . . . -66.34 -40.21 89.71 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-N 113.595 -1.639 . . . . 0.0 109.233 175.99 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 91.5 t80 . . . . . 0 N--CA 1.471 0.615 0 CA-C-O 121.304 0.573 . . . . 0.0 111.022 177.178 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 2.9 p . . . . . 0 N--CA 1.465 0.294 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.224 -0.261 0 N-CA-C 114.569 1.322 . . . . 0.0 114.569 -174.892 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 13.9 m120 . . . . . 0 N--CA 1.49 1.548 0 N-CA-C 109.386 -0.598 . . . . 0.0 109.386 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 86.6 mt 57.88 31.57 20.73 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.464 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 12.7 t -148.86 152.99 37.42 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.441 179.884 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -128.37 147.43 50.64 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.703 -179.834 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 64.6 tt0 55.83 99.09 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.922 179.592 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 64.9 pttt -150.58 157.53 43.1 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.379 179.57 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 68.4 t0 -123.79 106.65 10.66 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.31 -179.866 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -149.13 149.85 31.71 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.613 179.769 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 91.3 t -123.73 127.69 74.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.563 179.923 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 96.4 p -154.65 161.45 41.57 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.692 179.856 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 53.7 p-10 -84.36 -178.25 6.87 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.018 179.857 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 12.4 t -148.51 151.76 35.7 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.57 179.867 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -115.97 -130.91 4.73 Favored Glycine 0 CA--C 1.51 -0.221 0 N-CA-C 111.354 -0.699 . . . . 0.0 111.354 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 2.7 m 74.32 -64.45 0.39 Allowed 'General case' 0 CA--C 1.516 -0.354 0 N-CA-C 108.458 -0.942 . . . . 0.0 108.458 -178.31 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -66.15 -41.6 90.18 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 109.19 -0.67 . . . . 0.0 109.19 177.726 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' ALA . . . . . 0.646 ' O ' HG22 ' A' ' 20' ' ' VAL . . . -63.03 -37.64 88.01 Favored 'General case' 0 CA--C 1.506 -0.719 0 CA-C-N 114.856 -1.065 . . . . 0.0 109.71 178.934 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' VAL . . . . . 0.677 HG21 ' HB3' ' A' ' 55' ' ' SER . 54.6 t -60.03 -42.95 91.49 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.834 0 CA-C-N 115.162 -0.926 . . . . 0.0 109.969 -179.966 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 67.9 t -65.45 -44.3 94.34 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.104 0 CA-C-N 115.268 -0.878 . . . . 0.0 110.257 -179.444 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 60.7 tptt -64.78 -42.93 94.7 Favored 'General case' 0 CA--C 1.538 0.502 0 N-CA-C 113.638 0.977 . . . . 0.0 113.638 -179.798 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.733 HG21 ' HG2' ' A' ' 52' ' ' GLN . 28.3 m -74.09 -51.53 23.54 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.296 0 N-CA-C 113.822 1.045 . . . . 0.0 113.822 -176.962 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' VAL . . . . . 0.636 HG21 ' HB2' ' A' ' 56' ' ' TYR . 75.4 t -62.97 -45.22 99.44 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 C-N-CA 120.341 -0.544 . . . . 0.0 111.057 -178.079 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -63.3 -37.85 88.87 Favored 'General case' 0 C--N 1.323 -0.587 0 N-CA-C 113.294 0.85 . . . . 0.0 113.294 -178.829 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 48.0 t -65.35 -49.83 67.9 Favored 'General case' 0 N--CA 1.463 0.212 0 C-N-CA 119.776 -0.77 . . . . 0.0 110.702 179.082 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 99.7 mm-40 -67.45 -38.49 84.58 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.485 179.53 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.436 ' HA ' HD11 ' A' ' 42' ' ' LEU . . . -59.56 -42.45 92.45 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.282 -0.872 . . . . 0.0 109.909 -178.019 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 88.8 tt0 -64.69 -41.51 95.99 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.268 -0.878 . . . . 0.0 110.27 179.278 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 55.9 tp -68.38 -38.0 80.93 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.56 -0.746 . . . . 0.0 112.156 -179.786 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' TYR . . . . . 0.697 ' HD2' ' HB2' ' A' ' 37' ' ' ALA . 49.2 t80 -67.83 -37.13 81.53 Favored 'General case' 0 CA--C 1.504 -0.812 0 N-CA-C 106.969 -1.493 . . . . 0.0 106.969 179.182 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 91.0 mt-10 -63.51 -37.03 85.75 Favored 'General case' 0 N--CA 1.442 -0.839 0 CA-C-N 115.249 -0.887 . . . . 0.0 108.868 176.525 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 66.5 tp -62.64 -47.81 82.11 Favored 'General case' 0 N--CA 1.438 -1.05 0 N-CA-C 107.06 -1.459 . . . . 0.0 107.06 177.488 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 29.6 tptp -50.48 -50.09 53.54 Favored 'General case' 0 CA--C 1.521 -0.16 0 CA-C-N 115.18 -0.918 . . . . 0.0 109.383 177.66 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 81.7 m-20 -129.26 86.75 2.46 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 114.744 -1.116 . . . . 0.0 110.325 179.571 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 96.3 m -66.36 -39.75 89.34 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 112.323 0.49 . . . . 0.0 112.323 -178.827 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 65.7 t30 -58.35 -39.49 79.68 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.577 -0.283 . . . . 0.0 111.494 -177.862 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -108.63 141.08 41.1 Favored 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 120.598 -0.441 . . . . 0.0 110.073 179.919 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 2.5 mptp? -89.94 121.98 32.54 Favored 'General case' 0 N--CA 1.438 -1.049 0 C-N-CA 119.861 -0.736 . . . . 0.0 109.415 178.839 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' ALA . . . . . 0.697 ' HB2' ' HD2' ' A' ' 28' ' ' TYR . . . -52.46 -173.36 0.0 OUTLIER 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.614 -179.827 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 80.2 p -160.63 168.55 24.69 Favored 'General case' 0 C--N 1.317 -0.838 0 N-CA-C 109.257 -0.646 . . . . 0.0 109.257 178.343 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.609 HD22 ' HA ' ' A' ' 53' ' ' ALA . 54.1 mt -59.99 -40.19 88.31 Favored 'General case' 0 C--N 1.311 -1.07 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 179.15 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 74.8 m -62.82 -40.33 97.07 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 116.059 -0.518 . . . . 0.0 110.549 178.302 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -72.48 -48.85 37.51 Favored 'General case' 0 N--CA 1.464 0.256 0 N-CA-C 113.382 0.882 . . . . 0.0 113.382 -178.842 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.436 HD11 ' HA ' ' A' ' 25' ' ' ALA . 95.3 mt -62.46 -35.53 79.59 Favored 'General case' 0 CA--C 1.484 -1.56 0 N-CA-C 108.948 -0.76 . . . . 0.0 108.948 -175.601 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.423 HG23 ' O ' ' A' ' 48' ' ' ILE . 0.4 OUTLIER -78.78 -34.04 16.99 Favored 'Isoleucine or valine' 0 N--CA 1.409 -2.484 0 CA-C-N 114.385 -1.279 . . . . 0.0 111.217 -176.101 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 44' ' ' SER . . . . . 0.557 ' C ' ' H ' ' A' ' 46' ' ' GLY . 47.9 t -62.84 -49.89 73.11 Favored 'General case' 0 N--CA 1.425 -1.717 0 N-CA-C 104.201 -2.518 . . . . 0.0 104.201 176.363 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 45' ' ' SER . . . . . 0.484 ' O ' ' N ' ' A' ' 47' ' ' ASN . 70.5 m -51.62 9.69 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.044 0 CA-C-N 112.253 -2.249 . . . . 0.0 114.053 172.125 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' GLY . . . . . 0.557 ' H ' ' C ' ' A' ' 44' ' ' SER . . . 29.4 25.28 0.0 OUTLIER Glycine 0 CA--C 1.539 1.588 0 C-N-CA 125.679 1.609 . . . . 0.0 115.711 -172.288 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' ASN . . . . . 0.484 ' N ' ' O ' ' A' ' 45' ' ' SER . 21.6 m120 -63.04 -41.92 99.61 Favored 'General case' 0 CA--C 1.51 -0.573 0 N-CA-C 106.529 -1.656 . . . . 0.0 106.529 174.306 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.423 ' O ' HG23 ' A' ' 43' ' ' VAL . 17.4 pt -131.16 160.98 41.88 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.157 0 CA-C-N 111.71 -2.496 . . . . 0.0 109.5 178.952 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 69.7 m -108.38 157.1 18.7 Favored 'General case' 0 C--N 1.313 -1.019 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.549 -179.02 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.82 ' HA ' ' HB3' ' A' ' 53' ' ' ALA . 24.1 tp60 -47.18 -6.06 0.01 OUTLIER 'General case' 0 CA--C 1.555 1.161 0 N-CA-C 114.758 1.392 . . . . 0.0 114.758 -178.554 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 21.0 ptmt -84.28 -47.17 11.05 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 105.852 -1.907 . . . . 0.0 105.852 175.564 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' GLN . . . . . 0.733 ' HG2' HG21 ' A' ' 20' ' ' VAL . 85.3 mt-30 -71.1 -35.22 71.72 Favored 'General case' 0 N--CA 1.439 -0.981 0 CA-C-N 112.659 -2.064 . . . . 0.0 110.167 174.228 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.82 ' HB3' ' HA ' ' A' ' 50' ' ' GLN . . . -72.62 -51.61 18.87 Favored 'General case' 0 C--O 1.221 -0.436 0 CA-C-N 115.14 -0.936 . . . . 0.0 112.654 -177.805 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 96.4 m-20 -77.71 -17.89 57.15 Favored 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 114.356 1.243 . . . . 0.0 114.356 -178.978 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' SER . . . . . 0.677 ' HB3' HG21 ' A' ' 17' ' ' VAL . 70.9 m -79.67 -39.4 31.45 Favored 'General case' 0 C--N 1.299 -1.61 0 C-N-CA 119.273 -0.971 . . . . 0.0 110.402 179.125 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 56' ' ' TYR . . . . . 0.636 ' HB2' HG21 ' A' ' 21' ' ' VAL . 19.5 t80 -70.64 -35.55 72.97 Favored 'General case' 0 CA--C 1.502 -0.9 0 N-CA-C 107.517 -1.29 . . . . 0.0 107.517 178.253 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.479 ' HB2' HD13 ' A' ' 39' ' ' LEU . 64.2 tttm -57.14 -41.58 79.37 Favored 'General case' 0 CA--C 1.488 -1.415 0 CA-C-N 113.19 -1.823 . . . . 0.0 110.416 -178.308 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -80.27 -5.25 55.94 Favored 'General case' 0 N--CA 1.425 -1.683 0 O-C-N 120.662 -1.274 . . . . 0.0 110.175 179.528 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 65.7 t80 -72.38 -42.19 65.51 Favored 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 119.899 -0.721 . . . . 0.0 109.182 175.402 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.414 ' CD2' ' O ' ' A' ' 57' ' ' LYS . 0.3 OUTLIER -71.34 -35.37 71.17 Favored 'General case' 0 C--N 1.351 0.67 0 N-CA-C 108.093 -1.077 . . . . 0.0 108.093 179.988 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -55.03 -36.41 60.86 Favored Glycine 0 CA--C 1.526 0.724 0 CA-C-N 113.921 -1.49 . . . . 0.0 111.789 179.762 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -57.07 -45.06 83.56 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 112.179 0.437 . . . . 0.0 112.179 -177.879 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 94.0 m-70 -97.72 -74.56 0.57 Allowed 'General case' 0 C--N 1.331 -0.217 0 C-N-CA 119.75 -0.78 . . . . 0.0 111.391 -179.506 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 168.76 39.06 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.258 0 O-C-N 123.549 0.531 . . . . 0.0 109.624 -179.794 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 73.95 22.78 77.6 Favored Glycine 0 CA--C 1.523 0.578 0 N-CA-C 110.001 -1.239 . . . . 0.0 110.001 -178.856 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -84.21 -13.35 52.95 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 111.63 0.233 . . . . 0.0 111.63 -178.653 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 74.7 p -113.8 -38.02 4.37 Favored 'General case' 0 N--CA 1.462 0.157 0 C-N-CA 120.101 -0.639 . . . . 0.0 112.234 -179.204 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -37.16 97.0 0.01 OUTLIER 'General case' 0 C--N 1.343 0.301 0 CA-C-O 122.638 1.209 . . . . 0.0 113.305 -175.024 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 92.7 m -54.76 -21.45 11.07 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 112.451 -2.158 . . . . 0.0 109.369 179.285 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.449 HG22 ' O ' ' A' ' 37' ' ' ALA . 7.2 p -129.46 149.21 33.43 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.8 0 N-CA-C 107.897 -1.149 . . . . 0.0 107.897 179.644 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -52.23 88.03 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.481 0 N-CA-C 112.775 0.657 . . . . 0.0 112.775 -176.348 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' ASN . . . . . 0.42 ' N ' ' O ' ' A' ' 70' ' ' VAL . 77.2 m-20 . . . . . 0 C--N 1.348 0.531 0 CA-C-O 118.237 -0.887 . . . . 0.0 112.221 179.396 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 99.2 m-20 . . . . . 0 N--CA 1.49 1.573 0 N-CA-C 109.556 -0.535 . . . . 0.0 109.556 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 64.6 tp -61.31 -44.97 96.31 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.515 -179.973 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' THR . . . . . 0.458 ' O ' ' HB2' ' A' ' 8' ' ' ALA . 20.9 p 49.71 40.03 19.08 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.885 179.87 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 26.2 pttm -60.96 -22.96 64.96 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.897 -179.893 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 16.2 pm0 -70.79 -179.54 2.25 Favored 'General case' 0 CA--C 1.516 -0.362 0 CA-C-O 121.526 0.679 . . . . 0.0 111.546 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 64.2 mttp 59.29 40.53 21.19 Favored 'General case' 0 N--CA 1.445 -0.695 0 CA-C-N 114.756 -1.111 . . . . 0.0 110.908 179.96 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 52.4 t0 53.52 47.6 23.63 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.032 179.348 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.458 ' HB2' ' O ' ' A' ' 3' ' ' THR . . . -61.33 -40.05 92.79 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.761 179.975 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 10.7 p -138.63 140.28 39.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.651 -179.941 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 66.3 m -127.82 150.24 49.92 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.784 -179.756 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 68.5 t0 -84.35 109.33 17.75 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.082 -0.508 . . . . 0.0 109.664 179.512 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 71.9 p -75.12 162.14 28.78 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.058 0.456 . . . . 0.0 111.279 -179.168 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' GLY . . . . . 0.786 ' O ' HG23 ' A' ' 17' ' ' VAL . . . -125.01 54.58 0.74 Allowed Glycine 0 CA--C 1.503 -0.695 0 N-CA-C 111.284 -0.726 . . . . 0.0 111.284 -179.904 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 70.1 p -65.03 -37.54 87.93 Favored 'General case' 0 N--CA 1.443 -0.787 0 N-CA-C 107.429 -1.323 . . . . 0.0 107.429 178.389 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -67.79 -42.23 81.95 Favored 'General case' 0 CA--C 1.514 -0.426 0 CA-C-N 115.522 -0.763 . . . . 0.0 110.226 177.428 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' ALA . . . . . 0.421 ' O ' HG22 ' A' ' 20' ' ' VAL . . . -62.26 -37.34 85.1 Favored 'General case' 0 CA--C 1.503 -0.833 0 CA-C-N 114.728 -1.124 . . . . 0.0 109.607 179.926 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' VAL . . . . . 0.822 HG22 ' HB3' ' A' ' 55' ' ' SER . 46.7 t -56.4 -46.03 81.87 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.044 0 CA-C-N 114.932 -1.031 . . . . 0.0 109.942 -178.945 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 67.7 t -63.26 -49.32 83.56 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.036 0 CA-C-N 114.315 -1.311 . . . . 0.0 112.222 -177.687 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 64.3 tttm -64.64 -42.87 95.16 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 116.755 2.131 . . . . 0.0 116.755 -176.928 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.476 HG23 ' N ' ' A' ' 21' ' ' VAL . 35.1 m -78.44 -53.78 13.28 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.17 0 C-N-CA 118.391 -1.324 . . . . 0.0 113.708 -176.135 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' VAL . . . . . 0.476 ' N ' HG23 ' A' ' 20' ' ' VAL . 53.1 t -61.64 -43.18 96.65 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.72 0 C-N-CA 118.189 -1.404 . . . . 0.0 111.411 -178.181 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -64.94 -26.39 68.29 Favored 'General case' 0 C--N 1.321 -0.647 0 C-N-CA 119.972 -0.691 . . . . 0.0 112.189 179.954 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 82.3 p -75.96 -52.09 11.02 Favored 'General case' 0 N--CA 1.463 0.202 0 C-N-CA 119.642 -0.823 . . . . 0.0 111.405 179.16 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' GLN . . . . . 0.524 ' HB3' HD22 ' A' ' 42' ' ' LEU . 22.0 mp0 -70.34 -38.49 74.86 Favored 'General case' 0 C--O 1.223 -0.319 0 C-N-CA 120.838 -0.345 . . . . 0.0 111.876 178.627 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -59.74 -41.4 90.87 Favored 'General case' 0 CA--C 1.511 -0.542 0 N-CA-C 109.762 -0.458 . . . . 0.0 109.762 -177.923 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 88.9 tt0 -61.09 -46.23 91.47 Favored 'General case' 0 C--N 1.319 -0.733 0 N-CA-C 108.281 -1.007 . . . . 0.0 108.281 178.925 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 57.8 tp -65.55 -38.57 89.99 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.632 -0.713 . . . . 0.0 112.531 -179.061 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' TYR . . . . . 0.569 ' HD2' ' HB2' ' A' ' 37' ' ' ALA . 65.8 t80 -64.9 -40.2 94.71 Favored 'General case' 0 CA--C 1.506 -0.74 0 N-CA-C 106.594 -1.632 . . . . 0.0 106.594 179.112 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 92.1 mt-10 -62.66 -37.02 84.75 Favored 'General case' 0 N--CA 1.443 -0.799 0 CA-C-N 114.65 -1.159 . . . . 0.0 108.976 177.221 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 66.9 tp -61.99 -47.54 84.35 Favored 'General case' 0 N--CA 1.438 -1.069 0 C-N-CA 117.871 -1.532 . . . . 0.0 107.012 177.656 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 64.7 tttp -50.49 -49.73 54.65 Favored 'General case' 0 CA--C 1.52 -0.184 0 CA-C-N 115.338 -0.847 . . . . 0.0 109.422 177.433 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 98.8 m-20 -129.14 86.82 2.48 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 114.785 -1.098 . . . . 0.0 110.093 179.509 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 96.1 m -66.21 -40.35 90.27 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 112.901 0.704 . . . . 0.0 112.901 -178.209 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 65.5 t30 -58.51 -40.15 82.08 Favored 'General case' 0 C--N 1.325 -0.465 0 C-N-CA 120.823 -0.351 . . . . 0.0 111.254 -177.901 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 96.2 mt-10 -106.45 137.4 44.51 Favored 'General case' 0 C--N 1.325 -0.494 0 C-N-CA 120.53 -0.468 . . . . 0.0 110.008 -179.897 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -88.12 129.57 35.27 Favored 'General case' 0 N--CA 1.433 -1.301 0 C-N-CA 118.614 -1.234 . . . . 0.0 109.943 179.333 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' ALA . . . . . 0.569 ' HB2' ' HD2' ' A' ' 28' ' ' TYR . . . -48.72 -178.72 0.0 OUTLIER 'General case' 0 C--N 1.315 -0.911 0 CA-C-N 114.005 -1.452 . . . . 0.0 111.025 -179.377 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' SER . . . . . 0.404 ' HA ' HG22 ' A' ' 70' ' ' VAL . 81.3 p -153.57 170.31 21.1 Favored 'General case' 0 C--N 1.314 -0.974 0 N-CA-C 108.427 -0.953 . . . . 0.0 108.427 177.917 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.681 HD21 ' HB3' ' A' ' 56' ' ' TYR . 97.5 mt -60.89 -41.78 96.72 Favored 'General case' 0 C--N 1.311 -1.093 0 N-CA-C 108.154 -1.054 . . . . 0.0 108.154 -179.601 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 75.0 m -63.86 -40.11 95.78 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.502 -0.772 . . . . 0.0 111.949 179.198 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -64.13 -46.74 82.79 Favored 'General case' 0 N--CA 1.464 0.231 0 N-CA-C 113.011 0.745 . . . . 0.0 113.011 -178.34 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.524 HD22 ' HB3' ' A' ' 24' ' ' GLN . 77.2 mt -63.29 -34.91 78.71 Favored 'General case' 0 CA--C 1.491 -1.292 0 N-CA-C 108.578 -0.897 . . . . 0.0 108.578 -178.026 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.914 HG21 ' HA ' ' A' ' 50' ' ' GLN . 0.4 OUTLIER -81.53 -28.37 10.27 Favored 'Isoleucine or valine' 0 N--CA 1.416 -2.146 0 CA-C-N 114.666 -1.152 . . . . 0.0 111.718 -176.676 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 44' ' ' SER . . . . . 0.557 ' C ' ' H ' ' A' ' 46' ' ' GLY . 75.8 m -61.88 -50.54 71.81 Favored 'General case' 0 N--CA 1.417 -2.075 0 N-CA-C 104.797 -2.298 . . . . 0.0 104.797 177.617 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 45' ' ' SER . . . . . 0.438 ' O ' ' N ' ' A' ' 47' ' ' ASN . 2.4 p -52.8 1.6 0.01 OUTLIER 'General case' 0 CA--C 1.551 0.985 0 CA-C-N 113.249 -1.796 . . . . 0.0 112.933 170.739 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 46' ' ' GLY . . . . . 0.557 ' H ' ' C ' ' A' ' 44' ' ' SER . . . 28.27 32.33 0.01 OUTLIER Glycine 0 C--N 1.346 1.116 0 C-N-CA 125.757 1.646 . . . . 0.0 114.679 -173.466 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 47' ' ' ASN . . . . . 0.438 ' N ' ' O ' ' A' ' 45' ' ' SER . 54.7 t-20 -63.79 -42.28 97.75 Favored 'General case' 0 CA--C 1.518 -0.272 0 N-CA-C 106.588 -1.634 . . . . 0.0 106.588 175.699 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.735 HD12 HG23 ' A' ' 43' ' ' VAL . 2.4 pp -121.94 166.44 16.57 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.703 0 CA-C-N 112.221 -2.263 . . . . 0.0 109.941 -179.284 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 98.7 p -81.17 166.97 20.16 Favored 'General case' 0 N--CA 1.444 -0.764 0 C-N-CA 120.544 -0.462 . . . . 0.0 110.251 -179.636 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.914 ' HA ' HG21 ' A' ' 43' ' ' VAL . 11.9 tm0? -57.93 -48.86 78.66 Favored 'General case' 0 CA--C 1.493 -1.224 0 CA-C-O 118.531 -0.747 . . . . 0.0 109.212 179.942 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.475 ' O ' ' N ' ' A' ' 55' ' ' SER . 64.3 pttt -60.0 -24.88 64.83 Favored 'General case' 0 CA--C 1.482 -1.672 0 CA-C-N 120.166 1.348 . . . . 0.0 110.953 -177.533 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 52' ' ' GLN . . . . . 0.462 ' HG2' HG21 ' A' ' 20' ' ' VAL . 3.6 tm0? -67.84 -37.5 81.96 Favored 'General case' 0 N--CA 1.434 -1.25 0 N-CA-C 104.978 -2.231 . . . . 0.0 104.978 175.035 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.644 ' O ' HD13 ' A' ' 39' ' ' LEU . . . -63.68 -49.11 74.45 Favored 'General case' 0 C--O 1.218 -0.557 0 C-N-CA 118.608 -1.237 . . . . 0.0 107.935 175.927 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 99.9 m-20 -70.56 -11.29 60.84 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 119.226 -0.99 . . . . 0.0 112.125 177.855 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' SER . . . . . 0.822 ' HB3' HG22 ' A' ' 17' ' ' VAL . 62.5 m -64.65 -41.29 96.23 Favored 'General case' 0 CA--C 1.503 -0.836 0 N-CA-C 109.028 -0.73 . . . . 0.0 109.028 -179.734 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 56' ' ' TYR . . . . . 0.681 ' HB3' HD21 ' A' ' 39' ' ' LEU . 1.1 t80 -79.55 -30.49 41.75 Favored 'General case' 0 C--N 1.321 -0.669 0 C-N-CA 118.548 -1.261 . . . . 0.0 109.469 179.565 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -60.54 -27.5 67.69 Favored 'General case' 0 CA--C 1.54 0.558 0 N-CA-C 106.797 -1.557 . . . . 0.0 106.797 174.425 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.784 ' HB3' ' O ' ' A' ' 55' ' ' SER . . . -68.57 -39.38 81.02 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 112.105 -2.316 . . . . 0.0 109.881 176.255 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 66.5 t80 -71.4 -39.4 71.18 Favored 'General case' 0 C--N 1.344 0.341 0 N-CA-C 108.668 -0.864 . . . . 0.0 108.668 176.687 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.456 ' O ' ' O ' ' A' ' 63' ' ' HIS . 55.0 t80 -59.49 -39.66 84.5 Favored 'General case' 0 CA--C 1.503 -0.832 0 N-CA-C 106.998 -1.482 . . . . 0.0 106.998 177.295 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -52.43 -43.45 58.17 Favored Glycine 0 N--CA 1.436 -1.309 0 CA-C-N 113.798 -1.547 . . . . 0.0 110.463 -179.051 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 39.1 ttpt -58.77 -45.37 89.95 Favored 'General case' 0 CA--C 1.548 0.885 0 N-CA-C 113.611 0.967 . . . . 0.0 113.611 -179.325 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' HIS . . . . . 0.456 ' O ' ' O ' ' A' ' 60' ' ' TYR . 96.3 m-70 -129.76 176.3 8.13 Favored 'General case' 0 N--CA 1.482 1.152 0 CA-C-O 121.513 0.673 . . . . 0.0 112.705 -179.06 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 15.7 m -59.58 -156.87 0.0 OUTLIER 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.998 179.871 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -78.73 8.0 45.7 Favored Glycine 0 CA--C 1.529 0.933 0 N-CA-C 112.235 -0.346 . . . . 0.0 112.235 -179.083 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 24.8 pt-20 -82.32 -6.67 59.41 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 111.689 0.255 . . . . 0.0 111.689 -179.789 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 1.1 p -93.49 -70.25 0.71 Allowed 'General case' 0 CA--C 1.532 0.266 0 N-CA-C 113.228 0.825 . . . . 0.0 113.228 -178.706 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 1.1 mm-40 -36.99 100.7 0.02 OUTLIER 'General case' 0 N--CA 1.45 -0.454 0 CA-C-O 123.105 1.431 . . . . 0.0 113.964 -173.488 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 73.9 p -62.36 -15.12 46.56 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 111.479 -2.6 . . . . 0.0 109.253 179.627 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.404 HG22 ' HA ' ' A' ' 38' ' ' SER . 3.8 p -130.76 139.97 49.87 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.966 0 N-CA-C 105.593 -2.003 . . . . 0.0 105.593 177.723 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -63.2 100.56 0.24 Allowed 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 119.303 -0.959 . . . . 0.0 113.015 -174.547 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 52.2 p30 . . . . . 0 C--O 1.22 -0.498 0 CA-C-O 117.964 -1.017 . . . . 0.0 110.38 178.259 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 23.6 m120 . . . . . 0 N--CA 1.49 1.566 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 65.3 tp -108.11 121.76 45.49 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.515 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 68.0 p -88.76 -12.01 43.37 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.053 179.864 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 64.4 tttm -61.38 -41.74 97.58 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.776 0.322 . . . . 0.0 110.598 -179.909 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 24.8 pt20 -144.78 173.39 11.89 Favored 'General case' 0 CA--C 1.505 -0.785 0 CA-C-O 121.432 0.634 . . . . 0.0 111.695 -179.304 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -61.88 -39.83 93.29 Favored 'General case' 0 N--CA 1.437 -1.096 0 CA-C-N 114.939 -1.028 . . . . 0.0 111.029 -179.149 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 53.4 t0 70.08 -67.06 0.25 Allowed 'General case' 0 N--CA 1.467 0.378 0 O-C-N 123.633 0.583 . . . . 0.0 111.318 179.663 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -146.26 159.48 43.28 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.88 0.371 . . . . 0.0 110.692 -179.419 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 35.9 m -51.2 165.23 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.628 -179.634 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 40.7 t -61.89 137.34 58.24 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.238 -179.146 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 167.99 -81.79 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 115.174 -0.921 . . . . 0.0 109.028 179.595 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 10.8 t -86.02 -25.56 25.89 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.233 178.903 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -77.36 58.26 3.69 Favored Glycine 0 CA--C 1.505 -0.584 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.919 -179.594 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.781 ' O ' HG12 ' A' ' 17' ' ' VAL . 70.0 p -68.02 -38.57 82.71 Favored 'General case' 0 N--CA 1.439 -1.0 0 N-CA-C 106.48 -1.674 . . . . 0.0 106.48 177.051 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -68.13 -41.26 81.95 Favored 'General case' 0 CA--C 1.515 -0.366 0 CA-C-O 122.007 0.908 . . . . 0.0 109.978 176.951 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -61.85 -38.26 87.57 Favored 'General case' 0 N--CA 1.444 -0.728 0 CA-C-N 114.456 -1.247 . . . . 0.0 110.038 -179.807 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' VAL . . . . . 0.826 HG11 ' HB3' ' A' ' 55' ' ' SER . 3.4 p -67.79 -25.65 33.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 C-N-CA 119.39 -0.924 . . . . 0.0 110.888 -178.78 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 60.8 t -63.33 -45.2 98.8 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.709 0 C-N-CA 119.75 -0.78 . . . . 0.0 109.152 179.893 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 15.0 tmtt? -64.56 -39.59 94.03 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 114.57 -1.196 . . . . 0.0 114.057 -178.925 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.467 HG21 ' CG ' ' A' ' 52' ' ' GLN . 34.6 m -69.94 -45.17 77.62 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.126 0 N-CA-C 113.221 0.823 . . . . 0.0 113.221 -176.729 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' VAL . . . . . 0.519 HG21 ' HB2' ' A' ' 56' ' ' TYR . 54.2 t -59.86 -42.36 88.86 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.842 0 C-N-CA 120.223 -0.591 . . . . 0.0 110.342 -179.403 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 98.7 mt-10 -62.35 -38.25 88.82 Favored 'General case' 0 C--N 1.321 -0.656 0 C-N-CA 120.837 -0.345 . . . . 0.0 111.561 179.74 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 73.1 m -64.89 -49.06 71.97 Favored 'General case' 0 N--CA 1.467 0.386 0 C-N-CA 120.379 -0.529 . . . . 0.0 111.431 179.636 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 18.3 mp0 -67.64 -37.42 82.42 Favored 'General case' 0 C--O 1.222 -0.389 0 CA-C-O 121.077 0.465 . . . . 0.0 109.955 178.059 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.406 ' O ' ' HG3' ' A' ' 29' ' ' GLU . . . -60.48 -39.58 88.16 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.309 -0.859 . . . . 0.0 110.265 -179.338 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 54.5 tp10 -68.74 -41.27 79.19 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 123.869 0.73 . . . . 0.0 110.25 178.781 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 58.5 tp -71.04 -38.46 72.56 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.302 -0.863 . . . . 0.0 113.063 -179.525 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' TYR . . . . . 0.43 ' HD2' ' HB2' ' A' ' 37' ' ' ALA . 85.9 t80 -65.11 -46.6 80.4 Favored 'General case' 0 CA--C 1.493 -1.225 0 N-CA-C 107.969 -1.123 . . . . 0.0 107.969 179.906 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.566 ' O ' ' N ' ' A' ' 33' ' ' THR . 2.6 pp20? -71.88 -23.23 61.47 Favored 'General case' 0 N--CA 1.43 -1.43 0 C-N-CA 118.563 -1.255 . . . . 0.0 108.809 176.636 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 67.5 tp -62.91 -48.54 78.49 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 105.979 -1.86 . . . . 0.0 105.979 177.894 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -50.69 -48.27 58.7 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 113.691 -1.595 . . . . 0.0 110.606 176.805 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 28.2 m120 -89.17 -66.71 0.89 Allowed 'General case' 0 N--CA 1.479 0.996 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.935 -178.225 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.566 ' N ' ' O ' ' A' ' 29' ' ' GLU . 4.0 m 81.31 -36.0 0.11 Allowed 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.182 0.926 . . . . 0.0 112.228 178.415 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 99.1 m-20 -61.38 -41.09 96.53 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 119.819 -0.752 . . . . 0.0 109.664 -179.971 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 94.6 mt-10 -115.16 -162.36 0.82 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.07 -0.513 . . . . 0.0 109.708 -179.469 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 1.1 mptp? -129.38 133.56 47.44 Favored 'General case' 0 N--CA 1.437 -1.078 0 N-CA-C 107.241 -1.392 . . . . 0.0 107.241 176.43 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' ALA . . . . . 0.43 ' HB2' ' HD2' ' A' ' 28' ' ' TYR . . . -52.54 178.21 0.02 OUTLIER 'General case' 0 C--N 1.318 -0.772 0 CA-C-O 120.989 0.423 . . . . 0.0 110.086 -179.67 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 38' ' ' SER . . . . . 0.441 ' CB ' ' O ' ' A' ' 71' ' ' ALA . 82.6 p -158.61 157.6 32.23 Favored 'General case' 0 CA--C 1.508 -0.644 0 N-CA-C 109.083 -0.71 . . . . 0.0 109.083 178.352 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.526 HD11 ' HB3' ' A' ' 56' ' ' TYR . 75.6 mt -58.48 -41.65 85.73 Favored 'General case' 0 C--N 1.317 -0.841 0 C-N-CA 117.9 -1.52 . . . . 0.0 109.122 -179.216 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 93.0 p -63.35 -33.97 76.69 Favored 'General case' 0 C--N 1.313 -1.016 0 C-N-CA 119.191 -1.004 . . . . 0.0 109.817 177.805 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 57.7 mtpt -76.14 -54.83 6.24 Favored 'General case' 0 CA--C 1.52 -0.175 0 N-CA-C 114.874 1.435 . . . . 0.0 114.874 -178.211 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 82.6 mt -60.54 -41.16 93.92 Favored 'General case' 0 CA--C 1.49 -1.344 0 CA-C-O 123.023 1.392 . . . . 0.0 107.63 -176.568 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.461 ' HB ' ' O ' ' A' ' 39' ' ' LEU . 0.3 OUTLIER -69.58 -46.15 76.23 Favored 'Isoleucine or valine' 0 N--CA 1.398 -3.054 0 CA-C-N 111.523 -2.58 . . . . 0.0 110.873 -172.788 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 44' ' ' SER . . . . . 0.564 ' C ' ' H ' ' A' ' 46' ' ' GLY . 48.2 t -61.08 -46.7 89.56 Favored 'General case' 0 N--CA 1.42 -1.951 0 C-N-CA 116.359 -2.136 . . . . 0.0 105.508 178.208 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 45' ' ' SER . . . . . 0.4 ' O ' ' N ' ' A' ' 47' ' ' ASN . 59.1 m -50.58 2.53 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.89 0 CA-C-N 113.303 -1.772 . . . . 0.0 113.555 172.483 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 46' ' ' GLY . . . . . 0.564 ' H ' ' C ' ' A' ' 44' ' ' SER . . . 28.46 37.5 0.01 OUTLIER Glycine 0 C--N 1.347 1.187 0 C-N-CA 125.043 1.306 . . . . 0.0 113.42 -173.45 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 47' ' ' ASN . . . . . 0.4 ' N ' ' O ' ' A' ' 45' ' ' SER . 55.6 t-20 -68.01 -39.85 83.11 Favored 'General case' 0 N--CA 1.449 -0.489 0 N-CA-C 106.256 -1.757 . . . . 0.0 106.256 173.126 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 24.1 pt -129.08 161.14 39.04 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.638 0 CA-C-N 112.187 -2.278 . . . . 0.0 108.701 179.645 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' SER . . . . . 0.403 ' O ' ' N ' ' A' ' 52' ' ' GLN . 72.3 m -91.27 136.26 33.22 Favored 'General case' 0 C--O 1.216 -0.704 0 C-N-CA 119.993 -0.683 . . . . 0.0 111.597 -179.315 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.591 ' HA ' ' HB3' ' A' ' 53' ' ' ALA . 65.8 tp60 -48.7 -17.57 0.19 Allowed 'General case' 0 C--O 1.214 -0.79 0 CA-C-N 114.986 -1.007 . . . . 0.0 112.842 -177.392 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 63.5 pttt -71.94 -39.4 69.44 Favored 'General case' 0 C--N 1.31 -1.141 0 N-CA-C 106.35 -1.722 . . . . 0.0 106.35 177.806 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' GLN . . . . . 0.467 ' CG ' HG21 ' A' ' 20' ' ' VAL . 3.9 tt0 -69.69 -52.36 26.38 Favored 'General case' 0 N--CA 1.428 -1.531 0 CA-C-N 112.323 -2.217 . . . . 0.0 106.224 176.791 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.591 ' HB3' ' HA ' ' A' ' 50' ' ' GLN . . . -60.36 -38.51 84.08 Favored 'General case' 0 C--N 1.344 0.347 0 CA-C-N 115.375 -0.829 . . . . 0.0 111.881 -176.086 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 98.8 m-20 -62.03 -39.61 92.9 Favored 'General case' 0 C--N 1.314 -0.949 0 C-N-CA 120.197 -0.601 . . . . 0.0 112.614 179.638 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' SER . . . . . 0.826 ' HB3' HG11 ' A' ' 17' ' ' VAL . 75.4 m -62.87 -41.38 99.36 Favored 'General case' 0 C--N 1.314 -0.97 0 C-N-CA 119.213 -0.995 . . . . 0.0 110.473 -179.318 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 56' ' ' TYR . . . . . 0.526 ' HB3' HD11 ' A' ' 39' ' ' LEU . 0.9 OUTLIER -69.6 -39.0 77.51 Favored 'General case' 0 N--CA 1.464 0.269 0 C-N-CA 118.015 -1.474 . . . . 0.0 108.81 179.942 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.434 ' HB2' HD13 ' A' ' 39' ' ' LEU . 87.9 tttt -55.76 -33.34 64.22 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.173 -0.922 . . . . 0.0 108.753 178.524 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.504 ' HB3' ' O ' ' A' ' 55' ' ' SER . . . -60.5 -37.46 81.19 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-N 115.226 -0.897 . . . . 0.0 109.623 178.519 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 62.4 m-85 -62.28 -39.33 92.58 Favored 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 120.065 -0.654 . . . . 0.0 109.981 178.768 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 80.1 t80 -60.39 -46.72 88.97 Favored 'General case' 0 CA--C 1.511 -0.544 0 N-CA-C 107.583 -1.265 . . . . 0.0 107.583 174.513 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -54.09 -44.02 73.4 Favored Glycine 0 CA--C 1.529 0.942 0 CA-C-N 113.064 -1.88 . . . . 0.0 112.829 -178.685 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 60.6 tptt -58.46 -45.88 87.69 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.933 0.367 . . . . 0.0 111.568 -178.632 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 4.8 m-70 -123.33 -81.59 0.64 Allowed 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 120.695 -0.402 . . . . 0.0 112.016 -179.781 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 9.4 t -167.8 -155.17 0.16 Allowed 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 120.808 -0.357 . . . . 0.0 111.047 -178.607 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -68.95 -5.05 44.96 Favored Glycine 0 CA--C 1.529 0.912 0 N-CA-C 111.626 -0.59 . . . . 0.0 111.626 -179.908 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 24.6 pt-20 -81.57 -10.78 59.36 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 111.795 0.294 . . . . 0.0 111.795 -179.079 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 80.7 p -98.61 -19.17 17.72 Favored 'General case' 0 C--N 1.331 -0.224 0 C-N-CA 119.967 -0.693 . . . . 0.0 111.886 -179.701 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' GLN . . . . . 0.422 ' NE2' ' CG1' ' A' ' 70' ' ' VAL . 0.0 OUTLIER -92.76 102.37 14.77 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-O 121.835 0.826 . . . . 0.0 111.76 -179.113 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 91.4 m -51.0 -23.4 2.9 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 114.058 -1.428 . . . . 0.0 110.945 -179.374 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.422 ' CG1' ' NE2' ' A' ' 68' ' ' GLN . 2.9 p -109.62 150.15 12.39 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.516 0 N-CA-C 108.285 -1.006 . . . . 0.0 108.285 179.249 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 71' ' ' ALA . . . . . 0.441 ' O ' ' CB ' ' A' ' 38' ' ' SER . . . -53.27 115.32 1.84 Allowed 'General case' 0 C--O 1.21 -1.012 0 C-N-CA 119.342 -0.943 . . . . 0.0 110.667 -177.371 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 1.3 m120 . . . . . 0 C--N 1.323 -0.564 0 CA-C-O 117.987 -1.006 . . . . 0.0 111.207 179.254 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 99.1 m-20 . . . . . 0 N--CA 1.49 1.565 0 N-CA-C 109.406 -0.59 . . . . 0.0 109.406 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 86.0 mt 58.27 48.06 13.17 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.677 179.88 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 95.7 m -116.04 129.17 56.24 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.044 -179.724 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -126.92 146.39 50.33 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.356 179.768 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 26.1 pt20 -155.35 159.96 40.34 Favored 'General case' 0 CA--C 1.516 -0.358 0 CA-C-O 121.094 0.473 . . . . 0.0 111.395 -179.985 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 29.5 tptp -134.61 129.29 34.72 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.8 178.528 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -111.66 -80.0 0.58 Allowed 'General case' 0 C--N 1.33 -0.276 0 C-N-CA 120.842 -0.343 . . . . 0.0 111.778 -179.002 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -154.77 -154.86 0.53 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.172 -178.891 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 35.1 m -53.93 -25.66 12.84 Favored 'Isoleucine or valine' 0 C--O 1.231 0.119 0 C-N-CA 120.403 -0.519 . . . . 0.0 109.709 179.869 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 68.5 m -113.98 129.09 56.63 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 178.527 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 18.5 t0 -168.27 179.24 4.57 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.274 -179.247 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 68.7 p -71.42 160.82 32.08 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.346 -0.613 . . . . 0.0 109.346 179.435 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -93.97 7.02 73.29 Favored Glycine 0 CA--C 1.504 -0.633 0 C-N-CA 120.606 -0.807 . . . . 0.0 112.861 -178.805 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.748 ' O ' HG12 ' A' ' 17' ' ' VAL . 71.1 p -59.61 -39.03 82.9 Favored 'General case' 0 N--CA 1.441 -0.904 0 N-CA-C 106.175 -1.787 . . . . 0.0 106.175 179.168 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -69.9 -39.4 76.23 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 122.292 1.044 . . . . 0.0 110.795 175.696 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' ALA . . . . . 0.6 ' O ' HG22 ' A' ' 20' ' ' VAL . . . -59.72 -36.44 76.56 Favored 'General case' 0 N--CA 1.446 -0.671 0 CA-C-N 113.761 -1.563 . . . . 0.0 111.246 -177.46 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' VAL . . . . . 0.748 HG12 ' O ' ' A' ' 14' ' ' THR . 9.8 p -51.79 -36.75 19.52 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 C-N-CA 119.155 -1.018 . . . . 0.0 111.027 -178.199 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 77.3 t -70.44 -45.67 73.87 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 C-N-CA 119.832 -0.747 . . . . 0.0 110.042 179.531 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 64.8 tttp -62.64 -43.85 97.77 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-N 115.302 -0.863 . . . . 0.0 113.263 -178.962 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.747 HG21 ' HG2' ' A' ' 52' ' ' GLN . 30.1 m -70.44 -50.65 44.17 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.18 0 N-CA-C 113.723 1.009 . . . . 0.0 113.723 -177.303 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' VAL . . . . . 0.67 HG11 ' CD2' ' A' ' 56' ' ' TYR . 65.3 t -65.48 -44.89 94.07 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 C-N-CA 120.249 -0.58 . . . . 0.0 112.073 -178.495 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 98.7 mt-10 -65.0 -42.66 94.3 Favored 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 112.763 0.653 . . . . 0.0 112.763 -179.129 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 74.1 m -66.51 -45.08 80.74 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-O 121.518 0.675 . . . . 0.0 110.501 -179.909 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 99.5 mm-40 -66.0 -37.93 87.18 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 114.859 -1.064 . . . . 0.0 109.114 179.065 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.427 ' HB2' ' O ' ' A' ' 21' ' ' VAL . . . -59.3 -40.36 85.93 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 114.725 -1.125 . . . . 0.0 109.516 -179.125 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 88.8 tt0 -66.15 -39.87 90.15 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.304 178.441 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 56.8 tp -64.31 -38.47 91.15 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.563 -179.591 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' TYR . . . . . 0.444 ' HB3' ' HB2' ' A' ' 37' ' ' ALA . 87.5 t80 -66.26 -36.74 83.77 Favored 'General case' 0 CA--C 1.503 -0.856 0 N-CA-C 107.695 -1.224 . . . . 0.0 107.695 177.762 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 95.1 mt-10 -64.94 -35.6 81.7 Favored 'General case' 0 N--CA 1.445 -0.682 0 N-CA-C 108.905 -0.776 . . . . 0.0 108.905 176.638 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 66.7 tp -62.36 -47.92 82.04 Favored 'General case' 0 N--CA 1.436 -1.141 0 N-CA-C 106.619 -1.623 . . . . 0.0 106.619 177.894 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 60.9 tptt -50.82 -50.57 56.14 Favored 'General case' 0 CA--C 1.523 -0.09 0 CA-C-N 115.115 -0.948 . . . . 0.0 109.279 177.371 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 27.5 m120 -129.55 102.17 6.26 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 114.63 -1.168 . . . . 0.0 109.891 179.172 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 11.3 t -87.08 -15.75 37.61 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 112.309 0.485 . . . . 0.0 112.309 -178.241 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 16.9 t-20 -59.92 -43.53 94.85 Favored 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 120.519 -0.472 . . . . 0.0 110.81 -179.079 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 70.9 mm-40 -109.79 -161.03 0.74 Allowed 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 179.791 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 75.8 mmtt -128.69 140.49 51.72 Favored 'General case' 0 N--CA 1.43 -1.466 0 N-CA-C 106.34 -1.726 . . . . 0.0 106.34 175.406 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' ALA . . . . . 0.444 ' HB2' ' HB3' ' A' ' 28' ' ' TYR . . . -51.03 163.81 0.19 Allowed 'General case' 0 C--N 1.315 -0.921 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 -179.535 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' SER . . . . . 0.532 ' HA ' HG22 ' A' ' 70' ' ' VAL . 19.7 m -135.47 144.69 46.55 Favored 'General case' 0 N--CA 1.433 -1.307 0 N-CA-C 107.226 -1.398 . . . . 0.0 107.226 177.97 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.563 HD12 HE22 ' A' ' 68' ' ' GLN . 8.5 tt -53.93 -40.64 66.92 Favored 'General case' 0 C--N 1.315 -0.901 0 N-CA-C 108.697 -0.853 . . . . 0.0 108.697 -178.365 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 92.8 p -65.3 -34.61 78.74 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.452 -0.794 . . . . 0.0 110.171 177.807 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' LYS . . . . . 0.404 ' HG3' ' HB2' ' A' ' 38' ' ' SER . 97.7 mttt -73.17 -49.18 29.54 Favored 'General case' 0 CA--C 1.513 -0.475 0 N-CA-C 114.122 1.156 . . . . 0.0 114.122 -178.883 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.439 HD23 HD22 ' A' ' 47' ' ' ASN . 96.3 mt -60.62 -40.58 92.4 Favored 'General case' 0 CA--C 1.49 -1.352 0 N-CA-C 107.243 -1.391 . . . . 0.0 107.243 -176.116 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.401 HG21 ' HA ' ' A' ' 50' ' ' GLN . 0.3 OUTLIER -70.04 -46.88 71.4 Favored 'Isoleucine or valine' 0 N--CA 1.397 -3.081 0 CA-C-N 111.815 -2.448 . . . . 0.0 111.251 -172.906 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 44' ' ' SER . . . . . 0.543 ' C ' ' H ' ' A' ' 46' ' ' GLY . 74.2 m -61.37 -45.77 93.0 Favored 'General case' 0 N--CA 1.407 -2.604 0 C-N-CA 116.242 -2.183 . . . . 0.0 105.997 178.511 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 45' ' ' SER . . . . . 0.424 ' O ' ' N ' ' A' ' 47' ' ' ASN . 26.4 t -50.6 6.23 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.967 0 CA-C-N 113.724 -1.58 . . . . 0.0 114.082 172.536 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 46' ' ' GLY . . . . . 0.543 ' H ' ' C ' ' A' ' 44' ' ' SER . . . 29.17 36.11 0.01 OUTLIER Glycine 0 C--N 1.351 1.374 0 C-N-CA 124.586 1.088 . . . . 0.0 113.25 -173.013 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 47' ' ' ASN . . . . . 0.439 HD22 HD23 ' A' ' 42' ' ' LEU . 95.5 m-20 -67.98 -39.55 83.27 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-O 122.779 1.275 . . . . 0.0 107.696 172.989 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 11.6 pt -131.7 159.43 43.08 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.858 0 CA-C-N 112.382 -2.19 . . . . 0.0 109.205 179.87 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' SER . . . . . 0.444 ' O ' ' N ' ' A' ' 52' ' ' GLN . 45.3 t -83.08 134.19 35.03 Favored 'General case' 0 C--O 1.211 -0.944 0 C-N-CA 120.494 -0.482 . . . . 0.0 111.14 -179.625 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.456 ' HA ' ' HB3' ' A' ' 53' ' ' ALA . 66.4 tp60 -50.44 -18.48 0.65 Allowed 'General case' 0 C--O 1.212 -0.908 0 CA-C-N 116.279 -0.418 . . . . 0.0 111.61 -179.22 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.407 ' CG ' ' N ' ' A' ' 52' ' ' GLN . 63.3 pttt -72.86 -40.6 65.53 Favored 'General case' 0 C--N 1.317 -0.831 0 N-CA-C 106.018 -1.845 . . . . 0.0 106.018 178.092 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 52' ' ' GLN . . . . . 0.747 ' HG2' HG21 ' A' ' 20' ' ' VAL . 0.0 OUTLIER -67.63 -53.01 31.51 Favored 'General case' 0 N--CA 1.424 -1.759 0 CA-C-N 112.082 -2.326 . . . . 0.0 106.549 176.483 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.456 ' HB3' ' HA ' ' A' ' 50' ' ' GLN . . . -61.63 -38.9 89.36 Favored 'General case' 0 C--O 1.22 -0.46 0 C-N-CA 119.885 -0.726 . . . . 0.0 112.161 -177.579 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 98.0 m-20 -60.62 -39.83 89.66 Favored 'General case' 0 C--N 1.311 -1.092 0 C-N-CA 119.374 -0.93 . . . . 0.0 111.579 -179.718 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' SER . . . . . 0.461 ' CB ' HG21 ' A' ' 17' ' ' VAL . 67.3 m -64.62 -40.68 95.91 Favored 'General case' 0 C--N 1.31 -1.135 0 C-N-CA 119.751 -0.78 . . . . 0.0 111.147 179.147 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 56' ' ' TYR . . . . . 0.67 ' CD2' HG11 ' A' ' 21' ' ' VAL . 10.7 t80 -70.44 -39.98 74.02 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-O 122.069 0.938 . . . . 0.0 109.737 -178.66 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 64.4 tttm -58.48 -33.24 69.56 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 113.886 -1.506 . . . . 0.0 108.879 179.148 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.449 ' HB3' ' O ' ' A' ' 55' ' ' SER . . . -61.4 -37.87 85.0 Favored 'General case' 0 N--CA 1.443 -0.803 0 CA-C-N 114.886 -1.052 . . . . 0.0 110.143 178.14 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 59' ' ' TYR . . . . . 0.567 ' HE1' HG11 ' A' ' 17' ' ' VAL . 73.2 m-85 -63.28 -39.46 94.64 Favored 'General case' 0 C--N 1.342 0.281 0 C-N-CA 119.966 -0.694 . . . . 0.0 109.894 178.666 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.435 ' O ' ' HB3' ' A' ' 63' ' ' HIS . 93.1 t80 -62.22 -44.47 96.5 Favored 'General case' 0 N--CA 1.446 -0.675 0 N-CA-C 106.974 -1.491 . . . . 0.0 106.974 175.324 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -52.43 -49.22 52.62 Favored Glycine 0 CA--C 1.529 0.953 0 CA-C-N 114.749 -1.114 . . . . 0.0 110.567 -179.54 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 14.4 mptt -59.59 -2.92 0.39 Allowed 'General case' 0 CA--C 1.539 0.525 0 N-CA-C 112.812 0.671 . . . . 0.0 112.812 178.075 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' HIS . . . . . 0.435 ' HB3' ' O ' ' A' ' 60' ' ' TYR . 34.3 p80 -44.98 156.55 0.09 Allowed 'General case' 0 N--CA 1.462 0.14 0 CA-C-O 122.567 1.175 . . . . 0.0 113.76 -176.212 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 48.4 t 179.15 75.52 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 112.457 -2.156 . . . . 0.0 105.884 179.486 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 82.85 10.92 82.38 Favored Glycine 0 CA--C 1.537 1.446 0 N-CA-C 109.404 -1.478 . . . . 0.0 109.404 -175.918 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 24.4 pt-20 -143.56 171.12 14.6 Favored 'General case' 0 C--N 1.345 0.397 0 CA-C-O 120.633 0.254 . . . . 0.0 110.359 -179.597 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' THR . . . . . 0.412 ' HG1' ' HE1' ' A' ' 60' ' ' TYR . 12.6 t -148.55 -166.19 2.48 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 116.674 -0.239 . . . . 0.0 111.004 -179.226 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 68' ' ' GLN . . . . . 0.563 HE22 HD12 ' A' ' 39' ' ' LEU . 1.7 pt20 -102.64 158.4 16.27 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-O 121.54 0.686 . . . . 0.0 110.896 177.805 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 94.5 m -56.77 -35.96 69.26 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 114.627 -1.17 . . . . 0.0 113.032 -177.905 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.532 HG22 ' HA ' ' A' ' 38' ' ' SER . 4.0 p -102.09 152.55 5.46 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.57 0 N-CA-C 108.986 -0.746 . . . . 0.0 108.986 -178.271 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -87.63 75.49 9.03 Favored 'General case' 0 C--N 1.348 0.528 0 N-CA-C 113.79 1.033 . . . . 0.0 113.79 -174.901 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 50.0 p30 . . . . . 0 C--O 1.219 -0.508 0 CA-C-O 118.079 -0.962 . . . . 0.0 111.172 178.386 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 56.3 t30 . . . . . 0 N--CA 1.49 1.543 0 N-CA-C 109.587 -0.523 . . . . 0.0 109.587 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 86.5 mt 55.62 35.57 25.48 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.562 179.789 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 66.6 p -68.13 -30.93 70.19 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.365 -0.379 . . . . 0.0 110.358 179.994 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -62.69 -40.0 95.75 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.994 0.426 . . . . 0.0 110.078 179.58 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 62.6 tt0 -88.5 136.36 33.03 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.815 -0.63 . . . . 0.0 109.315 179.566 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 62.7 mttp 65.1 -170.07 0.2 Allowed 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 109.33 -0.619 . . . . 0.0 109.33 -178.363 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 37.0 t70 -139.33 110.46 6.89 Favored 'General case' 0 C--N 1.322 -0.606 0 C-N-CA 120.093 -0.643 . . . . 0.0 111.63 -178.563 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.71 149.89 45.66 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.595 -179.973 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 34.0 m -128.35 161.28 37.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.737 -179.588 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 87.4 p -147.08 163.81 35.07 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.307 -179.36 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 52.6 t0 57.8 47.13 15.93 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.226 0.536 . . . . 0.0 109.685 -179.046 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' THR . . . . . 0.825 HG22 ' H ' ' A' ' 14' ' ' THR . 89.7 m -62.68 133.54 54.98 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.417 -0.811 . . . . 0.0 110.831 -179.715 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -89.99 12.55 67.22 Favored Glycine 0 C--O 1.225 -0.421 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.989 -179.501 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.825 ' H ' HG22 ' A' ' 12' ' ' THR . 98.6 m -59.0 -40.31 84.48 Favored 'General case' 0 N--CA 1.438 -1.028 0 N-CA-C 106.191 -1.781 . . . . 0.0 106.191 178.513 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -67.67 -40.57 84.43 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 114.98 -1.009 . . . . 0.0 110.815 177.864 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -62.03 -39.47 92.43 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.366 -0.834 . . . . 0.0 111.062 -178.837 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' VAL . . . . . 0.593 HG12 ' O ' ' A' ' 14' ' ' THR . 12.9 p -67.65 -28.19 40.92 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 C-N-CA 119.296 -0.962 . . . . 0.0 110.882 -178.994 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 58.3 t -61.13 -45.28 98.88 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.908 0 N-CA-C 108.491 -0.929 . . . . 0.0 108.491 179.402 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 40.2 ttpt -65.32 -39.94 93.08 Favored 'General case' 0 CA--C 1.541 0.606 0 N-CA-C 115.07 1.507 . . . . 0.0 115.07 -179.56 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.755 HG21 ' HG2' ' A' ' 52' ' ' GLN . 27.2 m -76.8 -51.09 19.78 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.298 0 N-CA-C 114.208 1.188 . . . . 0.0 114.208 -177.224 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' VAL . . . . . 0.485 ' N ' HG23 ' A' ' 20' ' ' VAL . 79.6 t -64.22 -44.87 97.5 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.748 0 N-CA-C 112.057 0.391 . . . . 0.0 112.057 -177.887 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 97.3 mt-10 -64.6 -40.18 95.06 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 112.911 0.708 . . . . 0.0 112.911 -179.682 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 47.8 t -65.84 -47.76 73.9 Favored 'General case' 0 N--CA 1.463 0.205 0 C-N-CA 120.209 -0.596 . . . . 0.0 110.212 178.878 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -65.28 -37.51 87.4 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.206 -0.906 . . . . 0.0 110.068 178.598 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.973 ' HB1' HG11 ' A' ' 70' ' ' VAL . . . -58.1 -43.89 87.34 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 -177.845 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 88.9 tt0 -61.63 -43.91 97.98 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 114.657 -1.156 . . . . 0.0 109.596 179.74 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 53.8 tp -65.88 -37.92 87.42 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.676 -0.693 . . . . 0.0 112.389 -179.646 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' TYR . . . . . 0.736 ' HB3' ' HB2' ' A' ' 37' ' ' ALA . 83.7 t80 -67.52 -39.46 85.1 Favored 'General case' 0 CA--C 1.509 -0.609 0 N-CA-C 106.942 -1.503 . . . . 0.0 106.942 178.896 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.422 ' O ' ' N ' ' A' ' 33' ' ' THR . 94.4 mt-10 -61.94 -37.92 86.54 Favored 'General case' 0 N--CA 1.443 -0.803 0 N-CA-C 108.272 -1.01 . . . . 0.0 108.272 176.966 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 65.6 tp -63.49 -46.39 86.36 Favored 'General case' 0 N--CA 1.442 -0.872 0 N-CA-C 107.137 -1.431 . . . . 0.0 107.137 177.303 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 24.7 ttmm -50.46 -49.35 55.37 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-N 114.449 -1.25 . . . . 0.0 111.94 178.987 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 8.9 m120 -108.52 -57.33 2.14 Favored 'General case' 0 N--CA 1.479 1.003 0 N-CA-C 113.515 0.931 . . . . 0.0 113.515 -177.824 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.422 ' N ' ' O ' ' A' ' 29' ' ' GLU . 0.4 OUTLIER 80.79 -41.41 0.18 Allowed 'General case' 0 N--CA 1.471 0.616 0 O-C-N 123.793 0.683 . . . . 0.0 111.999 179.859 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 65.2 t30 -60.75 -39.26 88.07 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.558 -0.457 . . . . 0.0 109.961 179.666 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 16.8 pm0 -117.51 162.32 18.17 Favored 'General case' 0 CA--C 1.513 -0.464 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.62 178.847 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.511 ' HB2' ' HB2' ' A' ' 71' ' ' ALA . 99.2 mttt -99.73 136.27 39.9 Favored 'General case' 0 N--CA 1.431 -1.397 0 N-CA-C 108.43 -0.952 . . . . 0.0 108.43 177.613 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 37' ' ' ALA . . . . . 0.736 ' HB2' ' HB3' ' A' ' 28' ' ' TYR . . . -49.44 160.53 0.25 Allowed 'General case' 0 C--N 1.311 -1.107 0 CA-C-N 115.265 -0.879 . . . . 0.0 109.183 -179.687 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' SER . . . . . 0.412 ' H ' ' HB2' ' A' ' 41' ' ' LYS . 84.7 p -146.84 169.14 19.73 Favored 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 108.735 -0.839 . . . . 0.0 108.735 179.678 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.61 HD22 ' HA ' ' A' ' 53' ' ' ALA . 86.5 mt -60.53 -39.78 89.1 Favored 'General case' 0 C--N 1.314 -0.946 0 C-N-CA 118.508 -1.277 . . . . 0.0 108.414 179.672 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 75.4 m -64.6 -40.72 96.01 Favored 'General case' 0 C--N 1.319 -0.734 0 C-N-CA 120.459 -0.497 . . . . 0.0 111.948 178.621 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' LYS . . . . . 0.412 ' HB2' ' H ' ' A' ' 38' ' ' SER . 99.3 mttt -74.86 -54.16 7.78 Favored 'General case' 0 N--CA 1.472 0.67 0 N-CA-C 114.232 1.197 . . . . 0.0 114.232 -177.389 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.495 ' HG ' ' HB1' ' A' ' 37' ' ' ALA . 87.6 mt -59.79 -34.83 73.54 Favored 'General case' 0 CA--C 1.485 -1.533 0 N-CA-C 108.549 -0.908 . . . . 0.0 108.549 -175.853 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.539 HG23 ' O ' ' A' ' 48' ' ' ILE . 0.3 OUTLIER -80.99 -28.8 11.19 Favored 'Isoleucine or valine' 0 N--CA 1.405 -2.679 0 CA-C-N 114.051 -1.431 . . . . 0.0 112.136 -176.852 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 44' ' ' SER . . . . . 0.563 ' C ' ' H ' ' A' ' 46' ' ' GLY . 48.0 t -63.11 -49.93 72.5 Favored 'General case' 0 N--CA 1.428 -1.546 0 N-CA-C 103.922 -2.622 . . . . 0.0 103.922 176.337 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 45' ' ' SER . . . . . 0.455 ' O ' ' N ' ' A' ' 47' ' ' ASN . 63.0 m -51.49 -1.16 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.914 0 CA-C-N 112.278 -2.237 . . . . 0.0 112.744 171.362 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 46' ' ' GLY . . . . . 0.563 ' H ' ' C ' ' A' ' 44' ' ' SER . . . 29.27 28.36 0.01 OUTLIER Glycine 0 C--N 1.343 0.969 0 C-N-CA 126.082 1.801 . . . . 0.0 115.174 -172.834 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 47' ' ' ASN . . . . . 0.455 ' N ' ' O ' ' A' ' 45' ' ' SER . 39.7 t-20 -61.62 -42.52 98.99 Favored 'General case' 0 CA--C 1.512 -0.491 0 N-CA-C 104.225 -2.509 . . . . 0.0 104.225 175.571 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.539 ' O ' HG23 ' A' ' 43' ' ' VAL . 16.3 pt -118.22 136.02 56.73 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.023 0 CA-C-N 111.695 -2.502 . . . . 0.0 107.791 176.443 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 84.6 p -79.94 159.87 26.17 Favored 'General case' 0 C--N 1.317 -0.829 0 C-N-CA 119.666 -0.814 . . . . 0.0 110.45 -179.337 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.515 ' HA ' ' HB3' ' A' ' 53' ' ' ALA . 60.7 tp60 -57.86 -8.16 0.9 Allowed 'General case' 0 CA--C 1.546 0.79 0 CA-C-N 115.95 -0.568 . . . . 0.0 112.023 -179.69 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 10.9 ptmt -78.83 -43.87 24.26 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 103.956 -2.609 . . . . 0.0 103.956 176.491 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' GLN . . . . . 0.755 ' HG2' HG21 ' A' ' 20' ' ' VAL . 1.4 mt-30 -68.37 -47.6 66.98 Favored 'General case' 0 N--CA 1.429 -1.49 0 CA-C-N 112.724 -2.034 . . . . 0.0 108.411 176.315 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.61 ' HA ' HD22 ' A' ' 39' ' ' LEU . . . -63.78 -43.7 95.56 Favored 'General case' 0 C--N 1.343 0.284 0 C-N-CA 119.412 -0.915 . . . . 0.0 111.309 -178.384 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 98.0 m-20 -62.37 -29.31 70.38 Favored 'General case' 0 C--N 1.319 -0.756 0 C-N-CA 120.22 -0.592 . . . . 0.0 110.641 178.906 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' SER . . . . . 0.769 ' O ' ' HB3' ' A' ' 58' ' ' ALA . 47.5 t -64.47 -39.22 93.4 Favored 'General case' 0 N--CA 1.44 -0.939 0 CA-C-N 115.452 -0.795 . . . . 0.0 110.659 178.211 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 56' ' ' TYR . . . . . 0.564 ' HB3' HD21 ' A' ' 39' ' ' LEU . 0.4 OUTLIER -72.62 -40.22 66.62 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 118.886 -1.126 . . . . 0.0 111.606 -178.515 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -57.68 -28.83 64.13 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 107.275 -1.38 . . . . 0.0 107.275 176.334 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.769 ' HB3' ' O ' ' A' ' 55' ' ' SER . . . -66.63 -39.67 88.4 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 112.606 -2.088 . . . . 0.0 109.694 175.937 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 89.9 t80 -66.35 -45.66 79.42 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-O 121.113 0.482 . . . . 0.0 110.754 177.211 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.609 ' CE1' HG22 ' A' ' 67' ' ' THR . 1.4 t80 -59.95 -46.54 89.09 Favored 'General case' 0 CA--C 1.511 -0.542 0 N-CA-C 106.944 -1.502 . . . . 0.0 106.944 176.466 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -54.53 -41.72 74.0 Favored Glycine 0 C--N 1.309 -0.936 0 CA-C-N 112.05 -2.341 . . . . 0.0 112.105 179.585 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 41.0 ttmt -58.27 -45.88 87.05 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 112.429 0.529 . . . . 0.0 112.429 -178.386 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 79.4 m-70 -114.75 118.12 32.7 Favored 'General case' 0 N--CA 1.465 0.303 0 C-N-CA 120.511 -0.476 . . . . 0.0 111.721 -179.143 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 47.5 t -64.64 -50.22 67.97 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.289 0.566 . . . . 0.0 111.236 179.042 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -63.42 -39.72 98.06 Favored Glycine 0 N--CA 1.46 0.288 0 CA-C-N 115.042 -0.981 . . . . 0.0 111.639 -179.202 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 46.6 tp10 -97.06 121.66 39.2 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.444 -0.378 . . . . 0.0 110.7 -178.961 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' THR . . . . . 0.609 HG22 ' CE1' ' A' ' 60' ' ' TYR . 78.2 p -123.42 142.9 50.52 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 120.446 -0.501 . . . . 0.0 111.203 -179.277 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 68' ' ' GLN . . . . . 0.453 ' CD ' ' H ' ' A' ' 70' ' ' VAL . 10.2 tm0? -117.62 -86.93 0.63 Allowed 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 115.279 1.585 . . . . 0.0 115.279 -176.261 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.488 ' CB ' ' HB3' ' A' ' 72' ' ' ASN . 0.3 OUTLIER 30.96 34.47 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.595 0 C-N-CA 123.867 0.867 . . . . 0.0 111.718 -176.121 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.973 HG11 ' HB1' ' A' ' 25' ' ' ALA . 0.0 OUTLIER 56.21 -80.8 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.426 0 C-N-CA 125.018 1.327 . . . . 0.0 108.621 -177.488 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 71' ' ' ALA . . . . . 0.511 ' HB2' ' HB2' ' A' ' 36' ' ' LYS . . . -63.71 -16.7 61.77 Favored 'General case' 0 N--CA 1.431 -1.382 0 C-N-CA 120.646 -0.422 . . . . 0.0 110.478 177.977 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 72' ' ' ASN . . . . . 0.488 ' HB3' ' CB ' ' A' ' 69' ' ' THR . 20.2 t30 . . . . . 0 N--CA 1.478 0.95 0 CA-C-O 118.367 -0.825 . . . . 0.0 110.362 -179.122 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 56.3 t30 . . . . . 0 N--CA 1.491 1.613 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 86.9 mt -113.36 136.6 52.58 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.189 179.669 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 65.7 p -131.68 159.64 37.78 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.749 179.952 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 30.3 mtpp -73.38 144.01 46.6 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.264 179.644 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 72.2 tp60 -123.63 128.56 49.85 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.729 179.946 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 68.7 mttm -128.25 145.96 50.89 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.418 179.725 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 67.8 t0 -133.69 -70.83 0.52 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.427 179.957 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -153.15 158.76 42.29 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.531 -179.655 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 8.4 p -57.09 -30.16 33.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.143 179.907 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 42.0 t -123.23 132.96 54.23 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.902 -0.59 . . . . 0.0 109.883 179.403 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 53.8 p-10 -82.42 -179.71 7.51 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.91 0.386 . . . . 0.0 111.53 -179.354 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 94.0 m -119.26 130.03 55.22 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.247 179.906 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' GLY . . . . . 0.705 ' HA3' ' HB3' ' A' ' 16' ' ' ALA . . . -92.63 124.2 7.62 Favored Glycine 0 CA--C 1.509 -0.336 0 C-N-CA 120.771 -0.728 . . . . 0.0 111.785 -179.635 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.676 ' O ' HG12 ' A' ' 17' ' ' VAL . 6.1 t -75.38 -53.51 8.59 Favored 'General case' 0 N--CA 1.444 -0.745 0 N-CA-C 107.133 -1.432 . . . . 0.0 107.133 177.43 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.471 ' N ' HG23 ' A' ' 14' ' ' THR . . . -68.02 -40.63 82.92 Favored 'General case' 0 N--CA 1.446 -0.643 0 CA-C-O 121.739 0.78 . . . . 0.0 109.641 176.404 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' ALA . . . . . 0.705 ' HB3' ' HA3' ' A' ' 13' ' ' GLY . . . -62.14 -39.8 93.83 Favored 'General case' 0 N--CA 1.444 -0.73 0 CA-C-N 114.846 -1.07 . . . . 0.0 110.535 -179.274 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' VAL . . . . . 0.676 HG12 ' O ' ' A' ' 14' ' ' THR . 11.8 p -62.66 -31.99 54.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 C-N-CA 117.873 -1.531 . . . . 0.0 110.646 -178.879 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 62.9 t -60.08 -46.4 94.39 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.743 0 N-CA-C 108.764 -0.828 . . . . 0.0 108.764 -179.084 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 40.2 ttpt -63.66 -38.38 90.91 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 115.043 1.497 . . . . 0.0 115.043 -179.612 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.491 HG23 ' N ' ' A' ' 21' ' ' VAL . 27.0 m -78.25 -54.38 12.31 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.306 0 N-CA-C 113.835 1.05 . . . . 0.0 113.835 -177.214 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' VAL . . . . . 0.491 ' N ' HG23 ' A' ' 20' ' ' VAL . 62.3 t -62.13 -43.75 98.18 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.764 0 C-N-CA 119.705 -0.798 . . . . 0.0 111.163 -178.274 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -65.27 -32.25 73.82 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 112.821 0.674 . . . . 0.0 112.821 -179.417 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 87.5 p -75.88 -47.64 24.63 Favored 'General case' 0 C--O 1.231 0.107 0 C-N-CA 119.671 -0.811 . . . . 0.0 111.744 179.306 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' GLN . . . . . 0.513 ' HB3' HD22 ' A' ' 42' ' ' LEU . 17.4 mp0 -72.07 -39.38 69.05 Favored 'General case' 0 C--O 1.22 -0.467 0 N-CA-C 112.183 0.438 . . . . 0.0 112.183 178.597 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -58.7 -41.46 86.36 Favored 'General case' 0 CA--C 1.512 -0.501 0 CA-C-O 121.422 0.629 . . . . 0.0 109.359 -177.321 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 54.0 tp10 -60.5 -46.66 89.29 Favored 'General case' 0 C--N 1.318 -0.775 0 N-CA-C 107.595 -1.261 . . . . 0.0 107.595 178.837 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 57.7 tp -64.23 -39.58 94.26 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.444 -0.798 . . . . 0.0 112.539 -179.086 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' TYR . . . . . 0.562 ' HD2' ' HB2' ' A' ' 37' ' ' ALA . 73.2 t80 -62.44 -44.08 97.28 Favored 'General case' 0 CA--C 1.505 -0.77 0 N-CA-C 106.4 -1.704 . . . . 0.0 106.4 179.305 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 93.3 mt-10 -60.25 -37.74 81.31 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 114.818 -1.083 . . . . 0.0 108.939 178.627 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 66.5 tp -61.88 -47.98 82.56 Favored 'General case' 0 N--CA 1.435 -1.175 0 C-N-CA 117.975 -1.49 . . . . 0.0 107.153 177.908 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -50.54 -50.75 52.52 Favored 'General case' 0 CA--C 1.519 -0.229 0 CA-C-N 115.543 -0.753 . . . . 0.0 109.473 177.529 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 82.2 m-20 -129.41 109.08 10.78 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 114.621 -1.172 . . . . 0.0 110.116 179.256 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 10.2 t -94.16 -15.64 24.45 Favored 'General case' 0 C--N 1.324 -0.529 0 C-N-CA 120.645 -0.422 . . . . 0.0 111.864 -179.149 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 28.6 m120 -60.81 -39.67 89.81 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.116 0.484 . . . . 0.0 109.831 -179.598 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 95.0 mt-10 -124.22 150.66 45.02 Favored 'General case' 0 CA--C 1.507 -0.699 0 N-CA-C 108.581 -0.896 . . . . 0.0 108.581 179.189 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 49.4 mmtm -89.03 137.82 31.97 Favored 'General case' 0 N--CA 1.43 -1.457 0 C-N-CA 118.567 -1.253 . . . . 0.0 108.906 178.122 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' ALA . . . . . 0.562 ' HB2' ' HD2' ' A' ' 28' ' ' TYR . . . -49.46 179.77 0.01 OUTLIER 'General case' 0 C--N 1.314 -0.964 0 CA-C-N 114.873 -1.058 . . . . 0.0 110.643 -179.949 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 38' ' ' SER . . . . . 0.41 ' H ' ' HB2' ' A' ' 41' ' ' LYS . 76.4 p -153.04 170.66 19.91 Favored 'General case' 0 C--N 1.315 -0.929 0 N-CA-C 108.546 -0.909 . . . . 0.0 108.546 178.419 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.725 HD21 ' HB3' ' A' ' 56' ' ' TYR . 87.7 mt -60.84 -43.08 98.77 Favored 'General case' 0 C--N 1.312 -1.047 0 N-CA-C 107.748 -1.204 . . . . 0.0 107.748 179.689 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 74.7 m -63.08 -40.44 97.68 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.488 -0.778 . . . . 0.0 112.298 179.562 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' LYS . . . . . 0.41 ' HB2' ' H ' ' A' ' 38' ' ' SER . 68.4 mttm -63.55 -48.72 76.34 Favored 'General case' 0 N--CA 1.47 0.567 0 N-CA-C 113.43 0.9 . . . . 0.0 113.43 -177.988 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.513 HD22 ' HB3' ' A' ' 24' ' ' GLN . 92.3 mt -60.98 -35.32 76.49 Favored 'General case' 0 CA--C 1.494 -1.186 0 N-CA-C 107.405 -1.331 . . . . 0.0 107.405 -177.757 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.654 ' CG2' ' HB2' ' A' ' 53' ' ' ALA . 1.7 t -76.25 -31.73 21.47 Favored 'Isoleucine or valine' 0 N--CA 1.419 -2.017 0 CA-C-N 113.997 -1.456 . . . . 0.0 111.302 -178.952 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 44' ' ' SER . . . . . 0.562 ' C ' ' H ' ' A' ' 46' ' ' GLY . 75.0 m -62.34 -51.28 68.26 Favored 'General case' 0 N--CA 1.431 -1.402 0 N-CA-C 104.905 -2.258 . . . . 0.0 104.905 177.398 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 45' ' ' SER . . . . . 0.414 ' O ' ' N ' ' A' ' 47' ' ' ASN . 69.9 m -51.75 -4.36 0.02 OUTLIER 'General case' 0 CA--C 1.549 0.929 0 CA-C-N 113.23 -1.804 . . . . 0.0 112.151 170.644 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 46' ' ' GLY . . . . . 0.562 ' H ' ' C ' ' A' ' 44' ' ' SER . . . 28.75 34.64 0.01 OUTLIER Glycine 0 C--N 1.346 1.106 0 C-N-CA 126.034 1.778 . . . . 0.0 113.6 -172.68 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 47' ' ' ASN . . . . . 0.414 ' N ' ' O ' ' A' ' 45' ' ' SER . 57.0 t-20 -63.85 -44.7 92.38 Favored 'General case' 0 CA--C 1.513 -0.462 0 N-CA-C 106.113 -1.81 . . . . 0.0 106.113 176.152 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.644 ' O ' HD12 ' A' ' 48' ' ' ILE . 1.2 pp -117.47 160.8 16.75 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.936 0 CA-C-N 111.329 -2.669 . . . . 0.0 108.649 179.829 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 88.6 p -77.73 170.99 15.64 Favored 'General case' 0 N--CA 1.446 -0.65 0 CA-C-O 121.583 0.706 . . . . 0.0 112.089 -178.401 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.405 ' HA ' HG21 ' A' ' 43' ' ' VAL . 1.0 OUTLIER -57.24 -50.1 73.94 Favored 'General case' 0 N--CA 1.437 -1.121 0 CA-C-N 115.084 -0.962 . . . . 0.0 110.347 -179.782 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.438 ' O ' ' N ' ' A' ' 55' ' ' SER . 64.1 pttt -61.13 -25.9 67.31 Favored 'General case' 0 CA--C 1.479 -1.779 0 O-C-N 120.836 -1.165 . . . . 0.0 110.09 -178.218 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 52' ' ' GLN . . . . . 0.415 ' HG2' HG21 ' A' ' 20' ' ' VAL . 3.2 tm0? -64.96 -38.14 89.98 Favored 'General case' 0 N--CA 1.423 -1.806 0 N-CA-C 105.146 -2.168 . . . . 0.0 105.146 176.186 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.654 ' HB2' ' CG2' ' A' ' 43' ' ' VAL . . . -66.07 -49.04 69.02 Favored 'General case' 0 C--N 1.349 0.559 0 C-N-CA 118.09 -1.444 . . . . 0.0 110.786 176.522 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 96.2 m-20 -76.0 -13.97 60.23 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 118.986 -1.085 . . . . 0.0 113.628 -178.782 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' SER . . . . . 0.772 ' O ' ' HB3' ' A' ' 58' ' ' ALA . 48.8 m -68.27 -38.77 82.07 Favored 'General case' 0 C--N 1.31 -1.13 0 N-CA-C 109.736 -0.468 . . . . 0.0 109.736 179.162 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 56' ' ' TYR . . . . . 0.725 ' HB3' HD21 ' A' ' 39' ' ' LEU . 1.6 t80 -73.63 -37.22 65.42 Favored 'General case' 0 N--CA 1.465 0.295 0 C-N-CA 117.654 -1.618 . . . . 0.0 108.372 179.603 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -57.96 -30.34 65.93 Favored 'General case' 0 C--O 1.221 -0.439 0 N-CA-C 107.021 -1.474 . . . . 0.0 107.021 175.894 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.772 ' HB3' ' O ' ' A' ' 55' ' ' SER . . . -65.48 -38.79 90.79 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 112.431 -2.168 . . . . 0.0 109.37 176.506 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 83.8 t80 -68.49 -41.46 80.03 Favored 'General case' 0 C--N 1.344 0.33 0 CA-C-O 121.564 0.697 . . . . 0.0 109.325 176.699 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 82.0 t80 -59.23 -40.76 86.88 Favored 'General case' 0 CA--C 1.511 -0.552 0 N-CA-C 106.954 -1.499 . . . . 0.0 106.954 177.196 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -53.24 -39.92 59.33 Favored Glycine 0 N--CA 1.44 -1.08 0 CA-C-N 113.007 -1.906 . . . . 0.0 110.766 -179.731 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 24.6 tptm -57.82 -46.48 84.63 Favored 'General case' 0 C--N 1.33 -0.241 0 C-N-CA 120.916 -0.313 . . . . 0.0 110.547 179.73 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 97.4 m-70 -125.26 107.77 11.06 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-O 121.163 0.506 . . . . 0.0 110.779 179.649 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 47.1 t -62.67 -45.57 92.2 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.598 179.823 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -60.32 -37.54 93.24 Favored Glycine 0 N--CA 1.454 -0.112 0 CA-C-N 115.157 -0.929 . . . . 0.0 110.81 -178.641 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -83.97 139.89 32.26 Favored 'General case' 0 C--N 1.32 -0.716 0 C-N-CA 120.458 -0.497 . . . . 0.0 110.627 -179.267 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 94.3 m -115.4 122.9 47.24 Favored 'General case' 0 C--N 1.332 -0.194 0 C-N-CA 120.884 -0.326 . . . . 0.0 110.57 179.755 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' GLN . . . . . 0.435 ' OE1' ' O ' ' A' ' 70' ' ' VAL . 0.8 OUTLIER -38.89 166.75 0.0 OUTLIER 'General case' 0 N--CA 1.453 -0.295 0 CA-C-O 123.348 1.547 . . . . 0.0 114.887 -175.464 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 96.9 m -56.25 -35.51 67.5 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 111.628 -2.533 . . . . 0.0 111.706 -178.128 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.435 ' O ' ' OE1' ' A' ' 68' ' ' GLN . 2.5 p -115.01 162.91 12.77 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.608 0 N-CA-C 108.708 -0.849 . . . . 0.0 108.708 -178.845 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -85.04 99.57 11.11 Favored 'General case' 0 N--CA 1.466 0.342 0 C-N-CA 119.455 -0.898 . . . . 0.0 113.42 -176.216 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 45.1 p30 . . . . . 0 C--O 1.22 -0.492 0 CA-C-O 117.942 -1.027 . . . . 0.0 110.281 177.073 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 17.2 p30 . . . . . 0 N--CA 1.491 1.576 0 N-CA-C 109.399 -0.593 . . . . 0.0 109.399 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' LEU . . . . . 0.441 ' C ' HG23 ' A' ' 3' ' ' THR . 88.5 mt -113.84 142.06 46.56 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.548 -179.977 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 3' ' ' THR . . . . . 0.441 HG23 ' C ' ' A' ' 2' ' ' LEU . 1.3 p 60.22 163.26 0.06 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.172 179.62 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 60.8 tptt -116.84 128.18 55.01 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.279 179.874 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 2.7 mp0 -120.77 177.71 4.98 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.147 0.499 . . . . 0.0 111.713 -179.671 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 98.1 mttt 59.61 51.49 6.35 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.319 -0.855 . . . . 0.0 111.358 179.571 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -61.26 -44.76 96.71 Favored 'General case' 0 C--N 1.319 -0.76 0 C-N-CA 120.592 -0.443 . . . . 0.0 111.314 179.907 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.02 -40.91 97.32 Favored 'General case' 0 N--CA 1.467 0.399 0 N-CA-C 112.363 0.505 . . . . 0.0 112.363 -178.87 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 97.5 t -119.23 128.17 75.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 C-N-CA 121.04 -0.264 . . . . 0.0 110.36 -179.505 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 83.2 p -65.23 157.98 27.42 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.297 0.57 . . . . 0.0 111.129 -178.772 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 53.9 p-10 -83.73 -173.48 4.74 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.292 -0.867 . . . . 0.0 111.217 -179.415 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 99.1 m -60.34 -44.74 95.24 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.107 179.991 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 166.62 -98.31 0.15 Allowed Glycine 0 C--N 1.331 0.259 0 C-N-CA 120.412 -0.899 . . . . 0.0 112.518 179.588 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.613 ' O ' HG12 ' A' ' 17' ' ' VAL . 4.0 m 72.18 -75.11 0.08 Allowed 'General case' 0 N--CA 1.452 -0.375 0 N-CA-C 107.008 -1.479 . . . . 0.0 107.008 -176.706 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -66.97 -39.97 87.36 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 122.57 1.176 . . . . 0.0 108.549 176.078 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -60.61 -36.09 77.73 Favored 'General case' 0 N--CA 1.443 -0.809 0 CA-C-N 113.48 -1.691 . . . . 0.0 109.838 179.515 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' VAL . . . . . 0.682 HG21 ' HB2' ' A' ' 55' ' ' SER . 0.3 OUTLIER -53.24 -29.72 16.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 C-N-CA 119.827 -0.749 . . . . 0.0 110.195 -178.119 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 18' ' ' VAL . . . . . 0.401 HG13 ' HE1' ' A' ' 56' ' ' TYR . 53.1 t -70.03 -44.0 78.73 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 N-CA-C 108.745 -0.835 . . . . 0.0 108.745 177.134 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 29.5 tptp -63.57 -44.38 94.24 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 114.58 -1.191 . . . . 0.0 113.551 -179.389 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.725 HG21 ' HG2' ' A' ' 52' ' ' GLN . 34.0 m -66.99 -43.02 89.38 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.181 0 N-CA-C 112.756 0.65 . . . . 0.0 112.756 -176.993 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' VAL . . . . . 0.569 HG21 ' HB2' ' A' ' 56' ' ' TYR . 53.2 t -62.46 -47.2 94.14 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 C-N-CA 118.82 -1.152 . . . . 0.0 110.999 -179.293 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 79.7 mm-40 -66.02 -39.85 90.56 Favored 'General case' 0 C--N 1.332 -0.192 0 N-CA-C 112.091 0.404 . . . . 0.0 112.091 -179.935 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 48.4 t -63.93 -48.35 76.9 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-O 121.95 0.881 . . . . 0.0 108.887 178.553 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' GLN . . . . . 0.45 ' HG3' HD22 ' A' ' 42' ' ' LEU . 12.5 tp-100 -61.87 -39.28 91.35 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 113.962 -1.472 . . . . 0.0 109.78 179.653 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.843 ' CB ' HG11 ' A' ' 70' ' ' VAL . . . -57.78 -49.98 74.79 Favored 'General case' 0 N--CA 1.447 -0.61 0 N-CA-C 108.277 -1.009 . . . . 0.0 108.277 -178.133 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 88.8 tt0 -65.35 -39.25 92.12 Favored 'General case' 0 CA--C 1.51 -0.565 0 CA-C-N 115.903 -0.59 . . . . 0.0 111.359 179.687 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 61.8 tp -61.39 -42.19 98.32 Favored 'General case' 0 N--CA 1.447 -0.588 0 C-N-CA 119.332 -0.947 . . . . 0.0 108.778 -179.789 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' TYR . . . . . 0.448 ' HB3' ' HB2' ' A' ' 37' ' ' ALA . 89.8 t80 -60.99 -43.7 98.47 Favored 'General case' 0 N--CA 1.44 -0.946 0 N-CA-C 107.043 -1.466 . . . . 0.0 107.043 178.47 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -61.18 -31.21 70.96 Favored 'General case' 0 N--CA 1.446 -0.649 0 N-CA-C 109.875 -0.417 . . . . 0.0 109.875 178.618 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 67.0 tp -64.63 -48.72 73.81 Favored 'General case' 0 N--CA 1.44 -0.963 0 N-CA-C 106.302 -1.74 . . . . 0.0 106.302 176.91 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 64.5 tttp -51.58 -50.77 59.5 Favored 'General case' 0 CA--C 1.52 -0.185 0 CA-C-N 115.046 -0.979 . . . . 0.0 109.263 177.396 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 98.6 m-20 -129.78 98.96 4.96 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 114.499 -1.228 . . . . 0.0 110.055 179.444 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 12.7 t -76.9 -14.74 59.84 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 112.258 0.466 . . . . 0.0 112.258 -178.926 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 98.9 m-20 -61.3 -43.09 99.46 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 120.559 -0.456 . . . . 0.0 111.836 -178.175 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 99.2 mt-10 -108.1 -173.59 2.32 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.685 0.279 . . . . 0.0 111.112 -178.574 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 14.4 mptt -121.03 120.82 36.5 Favored 'General case' 0 N--CA 1.444 -0.752 0 N-CA-C 107.575 -1.268 . . . . 0.0 107.575 177.332 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' ALA . . . . . 0.448 ' HB2' ' HB3' ' A' ' 28' ' ' TYR . . . -54.9 149.8 11.0 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-O 121.073 0.464 . . . . 0.0 111.42 -177.729 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 38' ' ' SER . . . . . 0.637 ' HB3' ' HB3' ' A' ' 71' ' ' ALA . 89.1 p -137.03 159.18 42.64 Favored 'General case' 0 N--CA 1.444 -0.763 0 CA-C-N 115.079 -0.964 . . . . 0.0 109.766 -179.645 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.543 ' CD2' ' HB1' ' A' ' 53' ' ' ALA . 2.0 tt -52.3 -48.32 65.43 Favored 'General case' 0 C--N 1.311 -1.082 0 CA-C-N 115.248 -0.887 . . . . 0.0 110.296 -178.38 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 47.9 t -62.54 -42.92 99.84 Favored 'General case' 0 C--N 1.313 -0.981 0 CA-C-N 115.243 -0.89 . . . . 0.0 110.61 179.456 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 29.1 mtpp -65.52 -49.91 67.21 Favored 'General case' 0 CA--C 1.513 -0.473 0 N-CA-C 114.052 1.13 . . . . 0.0 114.052 -177.777 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.521 HD11 ' HA ' ' A' ' 25' ' ' ALA . 98.0 mt -61.1 -40.03 92.2 Favored 'General case' 0 CA--C 1.485 -1.549 0 CA-C-O 122.499 1.142 . . . . 0.0 108.08 -176.298 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -72.27 -45.37 61.54 Favored 'Isoleucine or valine' 0 N--CA 1.402 -2.862 0 CA-C-N 112.302 -2.226 . . . . 0.0 111.038 -172.48 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 44' ' ' SER . . . . . 0.531 ' C ' ' H ' ' A' ' 46' ' ' GLY . 46.7 t -61.25 -47.83 84.22 Favored 'General case' 0 N--CA 1.419 -2.023 0 C-N-CA 116.101 -2.239 . . . . 0.0 105.993 177.574 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 45' ' ' SER . . . . . 0.416 ' O ' ' N ' ' A' ' 47' ' ' ASN . 33.4 t -49.91 6.75 0.0 OUTLIER 'General case' 0 N--CA 1.479 1.023 0 CA-C-N 113.844 -1.526 . . . . 0.0 114.47 173.148 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 46' ' ' GLY . . . . . 0.531 ' H ' ' C ' ' A' ' 44' ' ' SER . . . 28.83 37.4 0.01 OUTLIER Glycine 0 C--N 1.346 1.136 0 C-N-CA 124.479 1.037 . . . . 0.0 113.428 -173.437 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 47' ' ' ASN . . . . . 0.416 ' N ' ' O ' ' A' ' 45' ' ' SER . 21.6 m120 -66.72 -38.78 87.39 Favored 'General case' 0 CA--C 1.512 -0.493 0 N-CA-C 106.724 -1.584 . . . . 0.0 106.724 173.339 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.416 HG23 ' HG2' ' A' ' 24' ' ' GLN . 11.2 pt -137.09 -166.5 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.44 -0.967 0 CA-C-N 112.259 -2.246 . . . . 0.0 107.251 179.302 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 84.8 p -127.99 148.73 50.54 Favored 'General case' 0 C--N 1.321 -0.631 0 C-N-CA 119.986 -0.686 . . . . 0.0 110.639 178.938 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.734 ' HA ' ' HB3' ' A' ' 53' ' ' ALA . 2.7 mt-30 -54.11 0.47 0.02 OUTLIER 'General case' 0 C--O 1.214 -0.768 0 N-CA-C 114.577 1.325 . . . . 0.0 114.577 -177.133 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.413 ' CG ' ' N ' ' A' ' 52' ' ' GLN . 62.8 pttt -77.06 -41.74 41.13 Favored 'General case' 0 C--N 1.313 -1.008 0 N-CA-C 103.679 -2.712 . . . . 0.0 103.679 175.934 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 52' ' ' GLN . . . . . 0.725 ' HG2' HG21 ' A' ' 20' ' ' VAL . 11.0 mt-30 -71.2 -53.43 14.44 Favored 'General case' 0 N--CA 1.423 -1.823 0 CA-C-N 111.891 -2.413 . . . . 0.0 107.829 176.312 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.734 ' HB3' ' HA ' ' A' ' 50' ' ' GLN . . . -62.66 -40.73 97.99 Favored 'General case' 0 C--O 1.216 -0.678 0 N-CA-C 112.962 0.727 . . . . 0.0 112.962 -177.088 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -62.54 -39.53 93.92 Favored 'General case' 0 C--N 1.311 -1.106 0 C-N-CA 118.709 -1.197 . . . . 0.0 113.319 -178.651 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' SER . . . . . 0.682 ' HB2' HG21 ' A' ' 17' ' ' VAL . 75.8 m -65.44 -42.04 92.81 Favored 'General case' 0 C--N 1.316 -0.888 0 C-N-CA 118.987 -1.085 . . . . 0.0 110.555 179.575 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 56' ' ' TYR . . . . . 0.569 ' HB2' HG21 ' A' ' 21' ' ' VAL . 3.1 t80 -72.65 -30.41 64.26 Favored 'General case' 0 C--N 1.334 -0.102 0 C-N-CA 118.988 -1.085 . . . . 0.0 109.405 -179.058 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -61.21 -37.24 82.3 Favored 'General case' 0 CA--C 1.501 -0.925 0 N-CA-C 108.186 -1.042 . . . . 0.0 108.186 177.59 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -65.86 -20.27 66.17 Favored 'General case' 0 N--CA 1.434 -1.24 0 CA-C-N 114.558 -1.201 . . . . 0.0 109.714 178.463 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 88.4 t80 -64.47 -46.51 82.76 Favored 'General case' 0 CA--C 1.531 0.22 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 176.083 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.418 ' HD1' ' HG1' ' A' ' 67' ' ' THR . 61.3 t80 -62.14 -50.0 73.6 Favored 'General case' 0 C--N 1.348 0.502 0 CA-C-O 122.253 1.025 . . . . 0.0 109.873 176.187 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -55.06 -50.17 60.05 Favored Glycine 0 CA--C 1.529 0.955 0 CA-C-N 113.404 -1.726 . . . . 0.0 114.338 -178.114 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 27.4 ttpp -59.09 -43.02 91.79 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 112.736 0.643 . . . . 0.0 112.736 -177.586 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 76.2 m80 -99.37 155.36 17.57 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.173 0.511 . . . . 0.0 111.894 -178.13 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 68.8 m -119.87 147.81 44.25 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.46 -0.791 . . . . 0.0 109.368 177.848 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 80.63 2.08 89.54 Favored Glycine 0 CA--C 1.528 0.895 0 N-CA-C 110.07 -1.212 . . . . 0.0 110.07 -179.064 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -146.81 167.85 22.86 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-O 120.681 0.277 . . . . 0.0 110.352 -179.913 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' THR . . . . . 0.418 ' HG1' ' HD1' ' A' ' 60' ' ' TYR . 14.7 t -143.9 -150.33 0.31 Allowed 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.714 -178.055 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 68' ' ' GLN . . . . . 0.407 ' N ' HG23 ' A' ' 67' ' ' THR . 0.0 OUTLIER -95.41 158.27 15.53 Favored 'General case' 0 CA--C 1.534 0.333 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 177.699 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 98.9 m -57.38 -40.06 77.35 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 113.195 0.813 . . . . 0.0 113.195 -176.936 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.843 HG11 ' CB ' ' A' ' 25' ' ' ALA . 13.4 m -84.1 -156.61 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.517 0 C-N-CA 118.59 -1.244 . . . . 0.0 111.212 -179.339 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 71' ' ' ALA . . . . . 0.637 ' HB3' ' HB3' ' A' ' 38' ' ' SER . . . -61.48 -38.35 86.95 Favored 'General case' 0 N--CA 1.437 -1.088 0 C-N-CA 119.108 -1.037 . . . . 0.0 112.444 -176.438 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 15.0 t-20 . . . . . 0 C--O 1.219 -0.521 0 CA-C-O 117.895 -1.05 . . . . 0.0 111.335 179.97 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 14.6 t-20 . . . . . 0 N--CA 1.491 1.585 0 N-CA-C 109.286 -0.635 . . . . 0.0 109.286 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 86.2 mt -109.81 137.1 48.09 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.464 -0.334 . . . . 0.0 110.48 -179.854 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 70.5 p -69.51 -33.5 72.92 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.402 179.693 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -138.63 127.79 24.15 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 109.349 -0.612 . . . . 0.0 109.349 179.444 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 54.1 tt0 -147.36 142.49 27.15 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.983 0.42 . . . . 0.0 111.447 -178.778 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 68.7 mttm -116.65 138.54 51.37 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 109.021 -0.733 . . . . 0.0 109.021 178.836 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' ASP . . . . . 0.482 ' OD1' HG22 ' A' ' 9' ' ' VAL . 68.2 t0 -119.28 111.17 17.86 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.155 0.502 . . . . 0.0 111.161 -178.535 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.53 -39.18 90.12 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.328 179.886 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.482 HG22 ' OD1' ' A' ' 7' ' ' ASP . 35.1 m -87.87 29.83 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.261 0 N-CA-C 112.023 0.379 . . . . 0.0 112.023 -178.593 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 65.9 m -60.73 -39.04 87.15 Favored 'General case' 0 C--N 1.331 -0.222 0 C-N-CA 120.908 -0.317 . . . . 0.0 110.34 179.4 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 98.9 m-20 -59.06 143.51 48.29 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.003 0.43 . . . . 0.0 110.456 -179.461 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 67.5 p -100.14 10.56 41.08 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.756 -0.656 . . . . 0.0 111.365 -179.085 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -77.46 -133.76 0.66 Allowed Glycine 0 C--N 1.331 0.304 0 C-N-CA 120.593 -0.813 . . . . 0.0 111.358 -179.607 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.647 ' O ' HG12 ' A' ' 17' ' ' VAL . 3.0 m 75.16 -67.85 0.23 Allowed 'General case' 0 CA--C 1.515 -0.389 0 N-CA-C 106.676 -1.601 . . . . 0.0 106.676 -177.094 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -66.29 -38.9 88.84 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 122.044 0.926 . . . . 0.0 108.744 176.355 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -60.32 -37.3 80.17 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-N 114.32 -1.309 . . . . 0.0 110.036 179.894 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' VAL . . . . . 0.856 HG21 ' HB2' ' A' ' 55' ' ' SER . 0.8 OUTLIER -54.09 -31.75 21.99 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 C-N-CA 119.296 -0.962 . . . . 0.0 109.599 -178.275 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 66.1 t -64.11 -46.88 92.42 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 N-CA-C 107.699 -1.222 . . . . 0.0 107.699 177.641 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 41.0 ttmt -60.37 -44.39 95.64 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-N 114.064 -1.426 . . . . 0.0 113.482 -177.997 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.613 HG21 ' CG ' ' A' ' 52' ' ' GLN . 28.5 m -68.14 -49.7 65.16 Favored 'Isoleucine or valine' 0 N--CA 1.46 0.055 0 CA-C-N 118.833 0.742 . . . . 0.0 111.827 -178.59 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' VAL . . . . . 0.682 HG21 ' HB2' ' A' ' 56' ' ' TYR . 54.0 t -61.23 -47.78 91.94 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.851 0 C-N-CA 119.846 -0.742 . . . . 0.0 111.529 -177.954 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -68.46 -29.83 68.56 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 112.605 0.595 . . . . 0.0 112.605 -179.247 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 70.9 m -73.45 -50.79 19.82 Favored 'General case' 0 N--CA 1.464 0.249 0 C-N-CA 119.771 -0.771 . . . . 0.0 109.351 177.732 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 99.8 mm-40 -65.04 -37.7 88.43 Favored 'General case' 0 C--O 1.217 -0.649 0 CA-C-N 114.648 -1.16 . . . . 0.0 109.595 179.953 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.7 ' HB1' ' HB ' ' A' ' 70' ' ' VAL . . . -55.37 -44.95 76.52 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 108.126 -1.064 . . . . 0.0 108.126 -177.872 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 88.9 tt0 -66.61 -38.45 87.0 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.451 -0.795 . . . . 0.0 110.803 178.364 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 66.5 tp -63.75 -45.82 88.14 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.17 -0.923 . . . . 0.0 109.937 179.392 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' TYR . . . . . 0.582 ' CD2' ' HB2' ' A' ' 37' ' ' ALA . 38.8 t80 -65.94 -40.05 91.01 Favored 'General case' 0 N--CA 1.441 -0.917 0 N-CA-C 107.261 -1.385 . . . . 0.0 107.261 -178.919 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 95.6 mt-10 -72.91 -10.85 60.25 Favored 'General case' 0 N--CA 1.441 -0.884 0 CA-C-N 115.083 -0.962 . . . . 0.0 110.287 177.432 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.404 ' HA ' HD12 ' A' ' 30' ' ' LEU . 62.7 tp -69.15 -48.22 62.92 Favored 'General case' 0 N--CA 1.437 -1.103 0 N-CA-C 104.25 -2.5 . . . . 0.0 104.25 174.843 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 64.9 tttp -51.5 -48.44 62.91 Favored 'General case' 0 CA--C 1.509 -0.629 0 CA-C-N 113.519 -1.673 . . . . 0.0 108.164 176.174 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 98.7 m-20 -128.6 94.56 3.9 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-N 114.492 -1.231 . . . . 0.0 110.738 -179.969 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 68.8 p -83.51 -15.37 49.62 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 120.882 -0.327 . . . . 0.0 111.429 -179.308 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 98.5 m-20 -95.01 4.03 54.24 Favored 'General case' 0 C--N 1.33 -0.248 0 C-N-CA 120.83 -0.348 . . . . 0.0 110.746 179.499 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 94.1 mt-10 -134.33 157.89 45.21 Favored 'General case' 0 CA--C 1.509 -0.599 0 N-CA-C 109.329 -0.619 . . . . 0.0 109.329 179.925 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 14.7 mptt -100.09 137.82 38.0 Favored 'General case' 0 N--CA 1.437 -1.104 0 N-CA-C 106.859 -1.534 . . . . 0.0 106.859 176.129 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' ALA . . . . . 0.582 ' HB2' ' CD2' ' A' ' 28' ' ' TYR . . . -85.98 -156.06 0.27 Allowed 'General case' 0 C--N 1.316 -0.85 0 N-CA-C 107.724 -1.213 . . . . 0.0 107.724 177.73 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 38' ' ' SER . . . . . 0.465 ' H ' ' HB2' ' A' ' 41' ' ' LYS . 79.0 p -160.91 168.92 23.66 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 175.96 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.554 ' HB3' ' HB1' ' A' ' 53' ' ' ALA . 72.7 mt -59.88 -46.8 88.18 Favored 'General case' 0 C--N 1.316 -0.885 0 C-N-CA 119.374 -0.93 . . . . 0.0 109.541 179.727 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 91.9 p -60.38 -34.42 73.87 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 120.431 -0.507 . . . . 0.0 109.682 179.858 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' LYS . . . . . 0.465 ' HB2' ' H ' ' A' ' 38' ' ' SER . 98.0 mttt -69.33 -36.77 77.26 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-O 121.078 0.465 . . . . 0.0 111.014 178.274 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.445 HD23 ' HA ' ' A' ' 42' ' ' LEU . 87.2 mt -69.25 -35.86 76.55 Favored 'General case' 0 CA--C 1.496 -1.102 0 CA-C-N 115.47 -0.787 . . . . 0.0 109.267 179.896 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.778 HG21 ' HA ' ' A' ' 50' ' ' GLN . 0.3 OUTLIER -80.27 -34.96 15.18 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.713 0 C-N-CA 119.264 -0.974 . . . . 0.0 110.908 -176.641 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 44' ' ' SER . . . . . 0.548 ' C ' ' H ' ' A' ' 46' ' ' GLY . 47.9 t -59.24 -51.15 71.22 Favored 'General case' 0 N--CA 1.431 -1.39 0 N-CA-C 104.635 -2.357 . . . . 0.0 104.635 179.691 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 45' ' ' SER . . . . . 0.433 ' O ' ' N ' ' A' ' 47' ' ' ASN . 24.7 p -54.41 12.65 0.0 OUTLIER 'General case' 0 CA--C 1.558 1.264 0 CA-C-N 113.926 -1.488 . . . . 0.0 113.677 170.429 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 46' ' ' GLY . . . . . 0.548 ' H ' ' C ' ' A' ' 44' ' ' SER . . . 28.59 33.78 0.01 OUTLIER Glycine 0 C--N 1.347 1.171 0 C-N-CA 125.201 1.382 . . . . 0.0 114.486 -173.161 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 47' ' ' ASN . . . . . 0.433 ' N ' ' O ' ' A' ' 45' ' ' SER . 19.1 m120 -66.95 -40.82 87.62 Favored 'General case' 0 CA--C 1.52 -0.186 0 CA-C-O 122.329 1.062 . . . . 0.0 109.138 174.519 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.594 ' O ' HG23 ' A' ' 43' ' ' VAL . 23.4 pt -137.37 164.76 28.63 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-N 113.098 -1.865 . . . . 0.0 111.716 -177.447 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 67.6 m -76.48 155.75 33.57 Favored 'General case' 0 N--CA 1.439 -0.983 0 N-CA-C 107.524 -1.287 . . . . 0.0 107.524 178.192 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.778 ' HA ' HG21 ' A' ' 43' ' ' VAL . 71.5 tp60 -56.88 -46.4 81.91 Favored 'General case' 0 C--O 1.202 -1.401 0 C-N-CA 119.697 -0.801 . . . . 0.0 109.801 -179.163 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 21.9 pttp -64.11 -30.93 71.96 Favored 'General case' 0 CA--C 1.501 -0.939 0 CA-C-N 119.089 0.858 . . . . 0.0 110.709 -179.248 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' GLN . . . . . 0.613 ' CG ' HG21 ' A' ' 20' ' ' VAL . 12.0 tt0 -66.5 -38.14 86.59 Favored 'General case' 0 N--CA 1.421 -1.875 0 N-CA-C 103.639 -2.726 . . . . 0.0 103.639 177.437 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.603 ' HB3' ' O ' ' A' ' 50' ' ' GLN . . . -65.96 -51.84 54.91 Favored 'General case' 0 N--CA 1.443 -0.777 0 CA-C-N 114.413 -1.267 . . . . 0.0 110.315 177.822 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 98.2 m-20 -58.11 -47.0 84.59 Favored 'General case' 0 CA--C 1.504 -0.805 0 C-N-CA 120.291 -0.563 . . . . 0.0 112.119 -177.172 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' SER . . . . . 0.856 ' HB2' HG21 ' A' ' 17' ' ' VAL . 74.2 m -53.8 -36.06 62.06 Favored 'General case' 0 N--CA 1.436 -1.172 0 C-N-CA 119.312 -0.955 . . . . 0.0 110.724 -177.282 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 56' ' ' TYR . . . . . 0.682 ' HB2' HG21 ' A' ' 21' ' ' VAL . 8.3 t80 -70.16 -41.51 73.73 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 116.996 -1.882 . . . . 0.0 109.052 176.984 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -47.92 -44.39 29.81 Favored 'General case' 0 CA--C 1.498 -1.042 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.22 -175.912 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -59.64 -51.28 70.5 Favored 'General case' 0 N--CA 1.434 -1.234 0 N-CA-C 106.959 -1.497 . . . . 0.0 106.959 179.432 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 91.9 t80 -48.92 -45.66 41.82 Favored 'General case' 0 N--CA 1.466 0.356 0 N-CA-C 109.583 -0.525 . . . . 0.0 109.583 -177.236 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -58.53 -43.33 89.19 Favored 'General case' 0 CA--C 1.508 -0.663 0 N-CA-C 108.208 -1.034 . . . . 0.0 108.208 175.791 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -53.63 -43.81 68.47 Favored Glycine 0 CA--C 1.535 1.321 0 CA-C-N 114.159 -1.382 . . . . 0.0 111.93 -179.889 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -58.48 -38.88 78.52 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 112.33 0.493 . . . . 0.0 112.33 -179.857 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' HIS . . . . . 0.419 ' HB2' ' O ' ' A' ' 66' ' ' GLU . 0.6 OUTLIER -37.78 165.0 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.44 0 N-CA-C 114.229 1.196 . . . . 0.0 114.229 -176.668 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 30.1 t -118.72 -76.03 0.58 Allowed 'General case' 0 CA--C 1.537 0.448 0 CA-C-N 114.453 -1.248 . . . . 0.0 111.506 179.182 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -101.14 4.19 55.41 Favored Glycine 0 CA--C 1.537 1.456 0 C-N-CA 121.173 -0.537 . . . . 0.0 114.127 -178.098 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' GLU . . . . . 0.419 ' O ' ' HB2' ' A' ' 63' ' ' HIS . 24.7 pt-20 -150.06 161.81 41.63 Favored 'General case' 0 C--O 1.216 -0.708 0 CA-C-N 118.39 1.095 . . . . 0.0 111.245 -179.425 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 67' ' ' THR . . . . . 0.435 ' O ' ' O ' ' A' ' 68' ' ' GLN . 69.6 p -125.94 153.85 43.67 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 120.574 -0.45 . . . . 0.0 109.808 179.96 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 68' ' ' GLN . . . . . 0.472 ' HB3' ' HE2' ' A' ' 56' ' ' TYR . 21.6 pt20 -42.95 -178.97 0.0 OUTLIER 'General case' 0 C--N 1.344 0.361 0 CA-C-O 122.715 1.245 . . . . 0.0 114.187 -178.266 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 98.0 m -61.52 -39.3 90.51 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 113.772 -1.558 . . . . 0.0 111.778 178.771 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.7 ' HB ' ' HB1' ' A' ' 25' ' ' ALA . 7.4 p -109.23 144.88 16.75 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.642 0 CA-C-O 121.404 0.621 . . . . 0.0 111.68 -177.512 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -70.05 76.26 0.49 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.532 -178.446 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.469 0.505 0 CA-C-O 117.962 -1.018 . . . . 0.0 111.482 179.707 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 99.1 m-20 . . . . . 0 N--CA 1.491 1.605 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 66.8 tp -108.21 124.06 49.71 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.353 179.99 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 2.6 m 75.55 -49.9 0.63 Allowed 'General case' 0 N--CA 1.468 0.433 0 O-C-N 123.702 0.626 . . . . 0.0 111.538 179.93 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 64.0 tttm -60.42 -44.85 95.35 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.909 -0.316 . . . . 0.0 110.725 -179.706 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 64.7 tt0 -129.71 127.11 39.79 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.935 0.398 . . . . 0.0 111.006 179.88 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 74.1 mmtt -63.58 -39.23 93.86 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.454 179.563 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 52.8 t0 56.24 43.89 25.8 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.547 -179.734 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . 62.2 151.37 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.211 179.526 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 7.9 p -63.89 -28.76 45.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.328 179.587 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 5.2 t 67.54 47.15 1.25 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.127 179.815 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 99.1 m-20 -65.56 146.41 54.88 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.387 179.354 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 12.0 t -147.45 151.36 36.29 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.969 0.414 . . . . 0.0 110.877 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' GLY . . . . . 0.468 ' HA3' ' HB3' ' A' ' 16' ' ' ALA . . . -103.72 57.88 0.54 Allowed Glycine 0 CA--C 1.502 -0.731 0 N-CA-C 111.619 -0.593 . . . . 0.0 111.619 179.894 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.709 ' O ' HG12 ' A' ' 17' ' ' VAL . 99.1 m -61.0 -46.19 91.78 Favored 'General case' 0 N--CA 1.438 -1.068 0 N-CA-C 106.28 -1.748 . . . . 0.0 106.28 177.407 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -68.35 -39.87 81.71 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.057 -0.974 . . . . 0.0 110.97 177.282 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' ALA . . . . . 0.468 ' HB3' ' HA3' ' A' ' 13' ' ' GLY . . . -59.93 -37.18 78.76 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 114.305 -1.316 . . . . 0.0 110.28 -178.419 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' VAL . . . . . 0.709 HG12 ' O ' ' A' ' 14' ' ' THR . 2.6 p -53.28 -35.64 24.46 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 C-N-CA 119.34 -0.944 . . . . 0.0 109.919 -178.076 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 61.4 t -63.63 -48.48 86.57 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-O 121.635 0.731 . . . . 0.0 109.207 178.936 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -61.93 -43.77 98.16 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 114.637 -1.165 . . . . 0.0 113.587 -178.7 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.673 HG21 ' HG2' ' A' ' 52' ' ' GLN . 28.5 m -71.95 -54.11 17.87 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.186 0 C-N-CA 119.949 -0.7 . . . . 0.0 112.621 -178.321 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' VAL . . . . . 0.596 HG21 ' HB2' ' A' ' 56' ' ' TYR . 53.2 t -61.1 -45.32 98.8 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.666 0 C-N-CA 119.398 -0.921 . . . . 0.0 111.975 -177.38 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -61.72 -51.64 67.57 Favored 'General case' 0 C--N 1.331 -0.207 0 C-N-CA 118.557 -1.257 . . . . 0.0 109.973 -179.892 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 48.4 t -58.54 -48.73 79.9 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 120.26 -0.576 . . . . 0.0 110.801 -176.771 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 74.5 mm-40 -63.97 -40.38 96.26 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.647 0.737 . . . . 0.0 109.186 179.536 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.483 ' HB1' ' HB ' ' A' ' 70' ' ' VAL . . . -57.47 -42.76 83.24 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 114.608 -1.178 . . . . 0.0 110.484 -177.133 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 54.0 tp10 -65.24 -39.12 92.28 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.935 0.874 . . . . 0.0 109.18 178.394 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 53.6 tp -62.2 -44.22 97.08 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 114.316 -1.311 . . . . 0.0 109.622 -179.844 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 55.3 t80 -62.26 -38.85 90.87 Favored 'General case' 0 CA--C 1.504 -0.81 0 N-CA-C 107.475 -1.306 . . . . 0.0 107.475 -179.142 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.44 ' O ' ' N ' ' A' ' 33' ' ' THR . 96.4 mt-10 -59.43 -43.79 93.01 Favored 'General case' 0 N--CA 1.44 -0.926 0 N-CA-C 106.72 -1.585 . . . . 0.0 106.72 178.694 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 64.3 tp -62.46 -43.58 98.47 Favored 'General case' 0 N--CA 1.443 -0.805 0 C-N-CA 118.513 -1.275 . . . . 0.0 108.743 178.387 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -49.03 -49.11 42.75 Favored 'General case' 0 CA--C 1.519 -0.224 0 CA-C-N 115.345 -0.843 . . . . 0.0 110.513 179.759 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 32.5 m120 -109.44 -66.11 1.09 Allowed 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 120.066 -0.654 . . . . 0.0 112.396 -179.356 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.44 ' N ' ' O ' ' A' ' 29' ' ' GLU . 0.2 OUTLIER 79.28 -34.75 0.15 Allowed 'General case' 0 N--CA 1.471 0.582 0 O-C-N 123.653 0.595 . . . . 0.0 112.53 179.067 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 99.2 m-20 -61.07 -39.28 89.3 Favored 'General case' 0 C--N 1.332 -0.162 0 N-CA-C 108.636 -0.876 . . . . 0.0 108.636 179.41 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 9.6 mm-40 -117.84 153.94 32.65 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 114.748 -1.115 . . . . 0.0 108.122 178.579 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -87.61 129.76 35.0 Favored 'General case' 0 N--CA 1.435 -1.215 0 C-N-CA 118.57 -1.252 . . . . 0.0 109.802 179.962 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' ALA . . . . . 0.666 ' C ' HG23 ' A' ' 70' ' ' VAL . . . -45.59 143.02 2.08 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 114.02 -1.446 . . . . 0.0 109.083 -178.522 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' SER . . . . . 0.556 ' CA ' HG23 ' A' ' 70' ' ' VAL . 14.2 m -122.92 147.91 46.06 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 107.198 -1.408 . . . . 0.0 107.198 179.818 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.675 HD21 ' HB1' ' A' ' 53' ' ' ALA . 7.7 tt -54.72 -50.24 68.82 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 108.448 -0.945 . . . . 0.0 108.448 -177.708 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 74.1 m -59.42 -38.66 81.2 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 179.586 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' LYS . . . . . 0.425 ' HB2' ' H ' ' A' ' 38' ' ' SER . 61.7 mtpt -65.85 -38.24 88.33 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 120.781 0.324 . . . . 0.0 111.864 178.714 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.575 ' CD1' HG21 ' A' ' 70' ' ' VAL . 88.5 mt -64.51 -38.73 92.02 Favored 'General case' 0 CA--C 1.485 -1.542 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 -178.025 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -81.93 -35.29 13.27 Favored 'Isoleucine or valine' 0 N--CA 1.417 -2.105 0 C-N-CA 118.956 -1.098 . . . . 0.0 110.92 -176.762 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 44' ' ' SER . . . . . 0.585 ' C ' ' H ' ' A' ' 46' ' ' GLY . 47.9 t -60.85 -50.87 71.69 Favored 'General case' 0 N--CA 1.43 -1.442 0 N-CA-C 105.353 -2.091 . . . . 0.0 105.353 178.583 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 45' ' ' SER . . . . . 0.452 ' O ' ' N ' ' A' ' 47' ' ' ASN . 89.6 p -54.08 9.5 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.125 0 CA-C-N 113.727 -1.579 . . . . 0.0 113.055 171.579 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 46' ' ' GLY . . . . . 0.585 ' H ' ' C ' ' A' ' 44' ' ' SER . . . 29.04 30.45 0.01 OUTLIER Glycine 0 C--N 1.343 0.964 0 C-N-CA 125.531 1.539 . . . . 0.0 114.613 -172.702 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 47' ' ' ASN . . . . . 0.452 ' N ' ' O ' ' A' ' 45' ' ' SER . 56.1 t30 -66.16 -42.66 88.67 Favored 'General case' 0 CA--C 1.517 -0.29 0 N-CA-C 104.874 -2.269 . . . . 0.0 104.874 175.193 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 36.2 pt -129.14 166.83 25.75 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.766 0 CA-C-N 111.619 -2.537 . . . . 0.0 107.902 177.922 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' SER . . . . . 0.537 ' C ' ' H ' ' A' ' 51' ' ' LYS . 67.6 m -119.5 156.5 30.14 Favored 'General case' 0 C--N 1.32 -0.702 0 C-N-CA 120.534 -0.466 . . . . 0.0 110.815 -179.151 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.838 ' HA ' ' HB3' ' A' ' 53' ' ' ALA . 12.6 tp60 -50.84 6.14 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.348 0 N-CA-C 114.743 1.386 . . . . 0.0 114.743 -179.536 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.537 ' H ' ' C ' ' A' ' 49' ' ' SER . 71.9 mmtt -83.43 -52.99 6.04 Favored 'General case' 0 C--N 1.309 -1.183 0 N-CA-C 104.757 -2.312 . . . . 0.0 104.757 176.147 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 52' ' ' GLN . . . . . 0.673 ' HG2' HG21 ' A' ' 20' ' ' VAL . 3.8 mt-30 -85.28 -29.22 24.76 Favored 'General case' 0 N--CA 1.431 -1.425 0 CA-C-N 110.989 -2.823 . . . . 0.0 110.333 178.105 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.838 ' HB3' ' HA ' ' A' ' 50' ' ' GLN . . . -65.17 -49.99 67.66 Favored 'General case' 0 N--CA 1.443 -0.801 0 C-N-CA 118.304 -1.358 . . . . 0.0 109.606 179.8 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 99.2 m-20 -60.9 -51.84 67.58 Favored 'General case' 0 CA--C 1.498 -1.038 0 C-N-CA 117.932 -1.507 . . . . 0.0 112.13 -178.152 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' SER . . . . . 0.606 ' HB2' HG21 ' A' ' 17' ' ' VAL . 67.2 m -56.67 -38.27 71.99 Favored 'General case' 0 N--CA 1.434 -1.269 0 C-N-CA 118.534 -1.267 . . . . 0.0 112.122 -175.62 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 56' ' ' TYR . . . . . 0.596 ' HB2' HG21 ' A' ' 21' ' ' VAL . 22.9 t80 -72.21 -39.5 68.51 Favored 'General case' 0 CA--C 1.516 -0.355 0 C-N-CA 117.488 -1.685 . . . . 0.0 109.627 178.806 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 64.8 tttp -50.71 -40.27 53.66 Favored 'General case' 0 CA--C 1.493 -1.221 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.453 -176.348 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.41 ' O ' ' N ' ' A' ' 61' ' ' GLY . . . -59.13 -50.86 72.43 Favored 'General case' 0 N--CA 1.431 -1.391 0 N-CA-C 106.459 -1.682 . . . . 0.0 106.459 178.783 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 90.1 t80 -45.37 -44.51 11.91 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 120.02 -0.672 . . . . 0.0 110.14 -176.345 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.446 ' CE1' HG23 ' A' ' 67' ' ' THR . 35.7 t80 -60.0 -47.34 86.22 Favored 'General case' 0 CA--C 1.514 -0.436 0 CA-C-O 122.184 0.992 . . . . 0.0 108.952 175.092 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 61' ' ' GLY . . . . . 0.41 ' N ' ' O ' ' A' ' 58' ' ' ALA . . . -53.69 -47.08 65.5 Favored Glycine 0 CA--C 1.536 1.391 0 CA-C-N 113.491 -1.686 . . . . 0.0 113.251 -179.196 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 63.9 tttm -58.5 -46.46 86.65 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.971 0.386 . . . . 0.0 111.962 -179.028 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 98.7 m-70 -81.85 144.91 30.68 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.199 0.523 . . . . 0.0 111.53 -179.104 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 69.0 m -127.65 152.39 47.75 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.245 179.31 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 81.48 0.94 89.85 Favored Glycine 0 CA--C 1.525 0.668 0 N-CA-C 110.116 -1.194 . . . . 0.0 110.116 -178.895 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 24.7 pt-20 -151.63 153.24 34.07 Favored 'General case' 0 C--O 1.231 0.112 0 CA-C-O 120.893 0.378 . . . . 0.0 110.458 179.599 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' THR . . . . . 0.473 ' O ' ' O ' ' A' ' 68' ' ' GLN . 91.9 m -128.74 133.33 48.09 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.756 -179.546 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 68' ' ' GLN . . . . . 0.521 ' OE1' HG13 ' A' ' 70' ' ' VAL . 23.5 pt20 -42.06 -178.73 0.0 OUTLIER 'General case' 0 CA--C 1.557 1.242 0 CA-C-O 121.984 0.897 . . . . 0.0 113.049 179.776 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 77.8 p -65.92 -17.08 64.42 Favored 'General case' 0 N--CA 1.48 1.034 0 N-CA-C 112.458 0.54 . . . . 0.0 112.458 -179.78 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.666 HG23 ' C ' ' A' ' 37' ' ' ALA . 0.1 OUTLIER -123.43 115.03 44.22 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.718 0 N-CA-C 107.269 -1.382 . . . . 0.0 107.269 -179.778 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -87.71 114.1 24.01 Favored 'General case' 0 C--O 1.22 -0.463 0 O-C-N 121.014 -1.053 . . . . 0.0 113.327 -175.777 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 53.9 m-20 . . . . . 0 C--O 1.22 -0.462 0 CA-C-O 118.019 -0.991 . . . . 0.0 111.23 178.797 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 75.3 m-20 . . . . . 0 N--CA 1.493 1.682 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -69.17 144.44 53.8 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.17 -179.659 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 80.6 p -128.23 160.0 33.48 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.155 179.786 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -62.55 -39.55 93.99 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.914 -179.422 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 65.0 tt0 -76.1 128.47 35.05 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.475 -0.33 . . . . 0.0 110.978 -179.654 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 23.1 pttp -175.93 38.64 0.01 OUTLIER 'General case' 0 C--O 1.233 0.199 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.256 179.7 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 55.3 p-10 -138.4 13.62 2.78 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 113.212 0.819 . . . . 0.0 113.212 -178.655 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -140.62 135.93 32.23 Favored 'General case' 0 C--N 1.331 -0.222 0 C-N-CA 120.363 -0.535 . . . . 0.0 110.84 179.561 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 60.8 t -62.87 -45.93 97.61 Favored 'Isoleucine or valine' 0 C--O 1.232 0.164 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.333 179.633 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 77.3 p -160.66 -34.22 0.05 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.782 179.543 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -115.53 148.75 39.16 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.883 -179.795 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 76.7 p -106.2 -9.37 16.92 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.198 179.663 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 74.34 19.32 79.86 Favored Glycine 0 CA--C 1.505 -0.587 0 N-CA-C 111.271 -0.732 . . . . 0.0 111.271 -179.918 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.617 ' O ' HG12 ' A' ' 17' ' ' VAL . 98.5 m -59.91 -41.71 92.31 Favored 'General case' 0 N--CA 1.434 -1.236 0 N-CA-C 106.335 -1.728 . . . . 0.0 106.335 178.175 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -67.62 -40.98 84.66 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.025 -0.989 . . . . 0.0 111.517 178.451 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -61.92 -39.42 91.97 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 115.481 -0.782 . . . . 0.0 110.826 -178.87 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' VAL . . . . . 0.617 HG12 ' O ' ' A' ' 14' ' ' THR . 14.1 p -67.8 -28.96 43.42 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 C-N-CA 118.98 -1.088 . . . . 0.0 111.113 -179.046 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' VAL . . . . . 0.444 HG23 ' O ' ' A' ' 14' ' ' THR . 55.8 t -60.55 -44.61 97.0 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.821 0 N-CA-C 108.955 -0.758 . . . . 0.0 108.955 -179.236 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.1 tmmt? -65.44 -36.01 82.64 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 114.99 -1.005 . . . . 0.0 113.631 -179.685 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.533 HG22 ' HA ' ' A' ' 17' ' ' VAL . 33.0 m -82.96 -49.9 16.3 Favored 'Isoleucine or valine' 0 C--N 1.342 0.263 0 O-C-N 121.449 -0.782 . . . . 0.0 113.086 -178.527 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' VAL . . . . . 0.509 ' N ' HG23 ' A' ' 20' ' ' VAL . 59.3 t -63.1 -44.75 99.65 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 C-N-CA 120.309 -0.556 . . . . 0.0 111.258 -178.861 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 96.3 mt-10 -60.72 -42.48 97.35 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 119.884 -0.727 . . . . 0.0 111.467 -178.988 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 74.6 m -64.9 -42.74 94.49 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 119.542 -0.863 . . . . 0.0 110.816 179.349 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 28.3 mm100 -68.97 -40.19 79.0 Favored 'General case' 0 CA--C 1.53 0.177 0 C-N-CA 120.467 -0.493 . . . . 0.0 110.757 -178.948 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.431 ' O ' ' HG3' ' A' ' 29' ' ' GLU . . . -58.04 -41.49 83.39 Favored 'General case' 0 CA--C 1.502 -0.889 0 N-CA-C 108.61 -0.885 . . . . 0.0 108.61 -177.9 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 89.0 tt0 -59.79 -43.48 94.38 Favored 'General case' 0 C--N 1.31 -1.144 0 CA-C-N 114.084 -1.416 . . . . 0.0 108.354 179.088 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 60.2 tp -68.41 -39.15 81.72 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 113.162 0.801 . . . . 0.0 113.162 -179.651 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' TYR . . . . . 0.515 ' HD2' ' HB2' ' A' ' 37' ' ' ALA . 94.1 t80 -63.51 -49.36 73.84 Favored 'General case' 0 CA--C 1.494 -1.21 0 N-CA-C 108.465 -0.939 . . . . 0.0 108.465 -179.561 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.431 ' HG3' ' O ' ' A' ' 25' ' ' ALA . 2.6 pp20? -69.18 -23.21 63.9 Favored 'General case' 0 N--CA 1.428 -1.558 0 C-N-CA 118.997 -1.081 . . . . 0.0 109.022 178.235 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 64.3 tp -63.9 -49.05 74.22 Favored 'General case' 0 N--CA 1.44 -0.948 0 N-CA-C 105.828 -1.916 . . . . 0.0 105.828 177.803 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -51.01 -49.21 60.89 Favored 'General case' 0 CA--C 1.519 -0.239 0 CA-C-N 114.275 -1.33 . . . . 0.0 108.805 176.159 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 98.7 m-20 -127.24 106.96 9.59 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-N 114.828 -1.078 . . . . 0.0 109.967 179.507 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 76.6 p -90.3 -2.44 58.01 Favored 'General case' 0 C--N 1.324 -0.524 0 C-N-CA 120.287 -0.565 . . . . 0.0 112.307 -177.948 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 66.5 t30 -60.26 -38.22 82.84 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 108.451 -0.944 . . . . 0.0 108.451 179.385 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 21.0 pt-20 -139.88 157.56 45.51 Favored 'General case' 0 CA--C 1.506 -0.742 0 CA-C-N 114.664 -1.153 . . . . 0.0 111.259 179.053 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 30.4 mtpp -89.36 145.37 25.39 Favored 'General case' 0 N--CA 1.425 -1.696 0 C-N-CA 119.625 -0.83 . . . . 0.0 108.86 177.459 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' ALA . . . . . 0.515 ' HB2' ' HD2' ' A' ' 28' ' ' TYR . . . -57.41 -178.97 0.04 OUTLIER 'General case' 0 C--N 1.297 -1.682 0 CA-C-N 114.202 -1.363 . . . . 0.0 109.157 179.354 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' SER . . . . . 0.442 ' OG ' ' HG3' ' A' ' 41' ' ' LYS . 59.7 p -154.41 168.31 27.08 Favored 'General case' 0 C--N 1.315 -0.892 0 C-N-CA 120.048 -0.661 . . . . 0.0 109.464 178.018 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.432 HD11 ' HB2' ' A' ' 57' ' ' LYS . 6.3 tt -57.62 -44.62 85.66 Favored 'General case' 0 C--N 1.31 -1.136 0 N-CA-C 107.658 -1.238 . . . . 0.0 107.658 -179.361 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 94.0 p -70.81 -37.08 73.22 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 115.187 -0.915 . . . . 0.0 113.033 178.616 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' LYS . . . . . 0.442 ' HG3' ' OG ' ' A' ' 38' ' ' SER . 97.9 mttt -69.69 -50.92 39.21 Favored 'General case' 0 N--CA 1.471 0.582 0 N-CA-C 113.278 0.844 . . . . 0.0 113.278 -177.914 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.604 ' HB3' HG12 ' A' ' 48' ' ' ILE . 89.9 mt -61.73 -38.05 86.5 Favored 'General case' 0 CA--C 1.482 -1.635 0 CA-C-O 122.225 1.012 . . . . 0.0 108.665 -176.129 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.41 HG21 ' CB ' ' A' ' 53' ' ' ALA . 0.4 OUTLIER -81.44 -26.55 10.19 Favored 'Isoleucine or valine' 0 N--CA 1.404 -2.757 0 CA-C-N 113.316 -1.765 . . . . 0.0 112.285 -177.056 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 44' ' ' SER . . . . . 0.583 ' C ' ' H ' ' A' ' 46' ' ' GLY . 48.0 t -65.81 -50.42 64.71 Favored 'General case' 0 N--CA 1.422 -1.874 0 N-CA-C 102.963 -2.977 . . . . 0.0 102.963 175.294 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 45' ' ' SER . . . . . 0.496 ' O ' ' N ' ' A' ' 47' ' ' ASN . 60.3 m -51.97 2.53 0.01 OUTLIER 'General case' 0 CA--C 1.547 0.846 0 CA-C-N 111.443 -2.617 . . . . 0.0 113.214 170.902 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 46' ' ' GLY . . . . . 0.583 ' H ' ' C ' ' A' ' 44' ' ' SER . . . 28.89 21.21 0.0 OUTLIER Glycine 0 CA--C 1.536 1.346 0 C-N-CA 126.478 1.989 . . . . 0.0 116.389 -172.771 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 47' ' ' ASN . . . . . 0.496 ' N ' ' O ' ' A' ' 45' ' ' SER . 1.0 OUTLIER -59.8 -55.25 36.52 Favored 'General case' 0 CA--C 1.507 -0.693 0 N-CA-C 104.602 -2.37 . . . . 0.0 104.602 177.74 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.604 HG12 ' HB3' ' A' ' 42' ' ' LEU . 29.5 pt -92.95 146.72 6.04 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.242 0 N-CA-C 104.1 -2.555 . . . . 0.0 104.1 174.47 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 49' ' ' SER . . . . . 0.401 ' O ' ' N ' ' A' ' 52' ' ' GLN . 68.2 m -98.82 163.22 12.71 Favored 'General case' 0 C--N 1.311 -1.091 0 C-N-CA 119.309 -0.956 . . . . 0.0 110.903 -178.177 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 63.3 tp60 -50.22 -15.24 0.21 Allowed 'General case' 0 C--N 1.308 -1.21 0 CA-C-N 114.569 -1.196 . . . . 0.0 112.041 -177.479 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 26.0 pttm -81.62 -36.17 29.21 Favored 'General case' 0 CA--C 1.516 -0.351 0 N-CA-C 107.201 -1.407 . . . . 0.0 107.201 177.618 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' GLN . . . . . 0.521 ' HG2' HG21 ' A' ' 20' ' ' VAL . 7.8 mt-30 -79.14 -23.34 44.06 Favored 'General case' 0 N--CA 1.439 -0.979 0 CA-C-N 113.047 -1.888 . . . . 0.0 109.603 176.559 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.41 ' CB ' HG21 ' A' ' 43' ' ' VAL . . . -84.7 -44.67 13.17 Favored 'General case' 0 C--O 1.219 -0.529 0 C-N-CA 118.785 -1.166 . . . . 0.0 108.279 175.151 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 99.8 m-20 -63.68 -38.99 93.19 Favored 'General case' 0 CA--C 1.506 -0.714 0 CA-C-N 114.966 -1.016 . . . . 0.0 111.265 179.015 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' SER . . . . . 0.726 ' O ' ' HB3' ' A' ' 58' ' ' ALA . 67.6 m -65.7 -40.99 92.86 Favored 'General case' 0 N--CA 1.437 -1.085 0 C-N-CA 119.563 -0.855 . . . . 0.0 110.109 178.866 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 56' ' ' TYR . . . . . 0.422 ' HB2' HG21 ' A' ' 21' ' ' VAL . 3.5 t80 -71.48 -40.61 70.12 Favored 'General case' 0 C--N 1.342 0.263 0 C-N-CA 118.333 -1.347 . . . . 0.0 109.916 -179.109 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.432 ' HB2' HD11 ' A' ' 39' ' ' LEU . 88.7 tttt -58.23 -24.1 58.11 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.112 -0.949 . . . . 0.0 108.495 177.806 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.726 ' HB3' ' O ' ' A' ' 55' ' ' SER . . . -66.34 -40.21 89.71 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-N 113.595 -1.639 . . . . 0.0 109.233 175.99 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 91.5 t80 -63.92 -47.18 81.57 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-O 121.304 0.573 . . . . 0.0 111.022 177.178 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 91.3 t80 -61.28 -40.8 95.48 Favored 'General case' 0 CA--C 1.512 -0.488 0 N-CA-C 107.325 -1.361 . . . . 0.0 107.325 177.47 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -53.32 -43.27 64.95 Favored Glycine 0 N--CA 1.444 -0.794 0 CA-C-N 113.054 -1.885 . . . . 0.0 111.391 -179.379 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 56.2 mtmt -59.01 -41.05 86.76 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 112.362 0.504 . . . . 0.0 112.362 179.946 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 78.8 m80 -126.37 107.77 10.61 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-O 121.221 0.534 . . . . 0.0 112.079 -179.197 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 47.8 t -63.43 -46.52 85.97 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.664 -0.698 . . . . 0.0 111.47 178.929 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -60.33 -36.45 90.99 Favored Glycine 0 C--O 1.229 -0.171 0 CA-C-N 115.001 -0.999 . . . . 0.0 110.892 -178.799 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -83.34 150.27 26.21 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.529 -0.336 . . . . 0.0 110.762 -178.743 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' THR . . . . . 0.466 ' O ' HG23 ' A' ' 67' ' ' THR . 9.4 t -124.71 119.46 29.03 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.257 0.551 . . . . 0.0 110.903 -179.965 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 1.2 pt20 -36.85 155.4 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 115.906 1.817 . . . . 0.0 115.906 -175.274 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 89.9 m -46.94 -27.26 1.21 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 110.676 -2.965 . . . . 0.0 112.35 -178.027 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 2.9 p -116.92 155.16 18.5 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.294 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 179.288 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -65.66 78.03 0.07 Allowed 'General case' 0 C--O 1.224 -0.261 0 N-CA-C 114.569 1.322 . . . . 0.0 114.569 -174.892 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 . . . . . 0 C--O 1.22 -0.463 0 CA-C-O 118.006 -0.997 . . . . 0.0 111.336 177.963 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.457 0 N-CA-C 109.19 -0.67 . . . . 0.0 109.19 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . 0.646 ' O ' HG22 ' A' ' 20' ' ' VAL . . . -63.03 -37.64 88.01 Favored 'General case' 0 CA--C 1.506 -0.719 0 CA-C-N 114.856 -1.065 . . . . 0.0 109.71 178.934 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . 0.677 HG21 ' HB3' ' A' ' 55' ' ' SER . 54.6 t -60.03 -42.95 91.49 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.834 0 CA-C-N 115.162 -0.926 . . . . 0.0 109.969 -179.966 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 67.9 t -65.45 -44.3 94.34 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.104 0 CA-C-N 115.268 -0.878 . . . . 0.0 110.257 -179.444 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 60.7 tptt -64.78 -42.93 94.7 Favored 'General case' 0 CA--C 1.538 0.502 0 N-CA-C 113.638 0.977 . . . . 0.0 113.638 -179.798 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.733 HG21 ' HG2' ' A' ' 52' ' ' GLN . 28.3 m -74.09 -51.53 23.54 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.296 0 N-CA-C 113.822 1.045 . . . . 0.0 113.822 -176.962 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . 0.636 HG21 ' HB2' ' A' ' 56' ' ' TYR . 75.4 t -62.97 -45.22 99.44 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 C-N-CA 120.341 -0.544 . . . . 0.0 111.057 -178.079 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -63.3 -37.85 88.87 Favored 'General case' 0 C--N 1.323 -0.587 0 N-CA-C 113.294 0.85 . . . . 0.0 113.294 -178.829 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 48.0 t -65.35 -49.83 67.9 Favored 'General case' 0 N--CA 1.463 0.212 0 C-N-CA 119.776 -0.77 . . . . 0.0 110.702 179.082 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 99.7 mm-40 -67.45 -38.49 84.58 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.485 179.53 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.436 ' HA ' HD11 ' A' ' 42' ' ' LEU . . . -59.56 -42.45 92.45 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.282 -0.872 . . . . 0.0 109.909 -178.019 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 88.8 tt0 -64.69 -41.51 95.99 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.268 -0.878 . . . . 0.0 110.27 179.278 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 55.9 tp -68.38 -38.0 80.93 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.56 -0.746 . . . . 0.0 112.156 -179.786 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . 0.697 ' HD2' ' HB2' ' A' ' 37' ' ' ALA . 49.2 t80 -67.83 -37.13 81.53 Favored 'General case' 0 CA--C 1.504 -0.812 0 N-CA-C 106.969 -1.493 . . . . 0.0 106.969 179.182 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 91.0 mt-10 -63.51 -37.03 85.75 Favored 'General case' 0 N--CA 1.442 -0.839 0 CA-C-N 115.249 -0.887 . . . . 0.0 108.868 176.525 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 66.5 tp -62.64 -47.81 82.11 Favored 'General case' 0 N--CA 1.438 -1.05 0 N-CA-C 107.06 -1.459 . . . . 0.0 107.06 177.488 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 29.6 tptp -50.48 -50.09 53.54 Favored 'General case' 0 CA--C 1.521 -0.16 0 CA-C-N 115.18 -0.918 . . . . 0.0 109.383 177.66 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 81.7 m-20 -129.26 86.75 2.46 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 114.744 -1.116 . . . . 0.0 110.325 179.571 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 96.3 m -66.36 -39.75 89.34 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 112.323 0.49 . . . . 0.0 112.323 -178.827 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 65.7 t30 -58.35 -39.49 79.68 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.577 -0.283 . . . . 0.0 111.494 -177.862 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -108.63 141.08 41.1 Favored 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 120.598 -0.441 . . . . 0.0 110.073 179.919 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 2.5 mptp? -89.94 121.98 32.54 Favored 'General case' 0 N--CA 1.438 -1.049 0 C-N-CA 119.861 -0.736 . . . . 0.0 109.415 178.839 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . 0.697 ' HB2' ' HD2' ' A' ' 28' ' ' TYR . . . -52.46 -173.36 0.0 OUTLIER 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.614 -179.827 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 80.2 p -160.63 168.55 24.69 Favored 'General case' 0 C--N 1.317 -0.838 0 N-CA-C 109.257 -0.646 . . . . 0.0 109.257 178.343 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.609 HD22 ' HA ' ' A' ' 53' ' ' ALA . 54.1 mt -59.99 -40.19 88.31 Favored 'General case' 0 C--N 1.311 -1.07 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 179.15 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 74.8 m -62.82 -40.33 97.07 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 116.059 -0.518 . . . . 0.0 110.549 178.302 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -72.48 -48.85 37.51 Favored 'General case' 0 N--CA 1.464 0.256 0 N-CA-C 113.382 0.882 . . . . 0.0 113.382 -178.842 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.436 HD11 ' HA ' ' A' ' 25' ' ' ALA . 95.3 mt -62.46 -35.53 79.59 Favored 'General case' 0 CA--C 1.484 -1.56 0 N-CA-C 108.948 -0.76 . . . . 0.0 108.948 -175.601 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.423 HG23 ' O ' ' A' ' 48' ' ' ILE . 0.4 OUTLIER -78.78 -34.04 16.99 Favored 'Isoleucine or valine' 0 N--CA 1.409 -2.484 0 CA-C-N 114.385 -1.279 . . . . 0.0 111.217 -176.101 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . 0.557 ' C ' ' H ' ' A' ' 46' ' ' GLY . 47.9 t -62.84 -49.89 73.11 Favored 'General case' 0 N--CA 1.425 -1.717 0 N-CA-C 104.201 -2.518 . . . . 0.0 104.201 176.363 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . 0.484 ' O ' ' N ' ' A' ' 47' ' ' ASN . 70.5 m -51.62 9.69 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.044 0 CA-C-N 112.253 -2.249 . . . . 0.0 114.053 172.125 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . 0.557 ' H ' ' C ' ' A' ' 44' ' ' SER . . . 29.4 25.28 0.0 OUTLIER Glycine 0 CA--C 1.539 1.588 0 C-N-CA 125.679 1.609 . . . . 0.0 115.711 -172.288 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . 0.484 ' N ' ' O ' ' A' ' 45' ' ' SER . 21.6 m120 -63.04 -41.92 99.61 Favored 'General case' 0 CA--C 1.51 -0.573 0 N-CA-C 106.529 -1.656 . . . . 0.0 106.529 174.306 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 0.423 ' O ' HG23 ' A' ' 43' ' ' VAL . 17.4 pt -131.16 160.98 41.88 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.157 0 CA-C-N 111.71 -2.496 . . . . 0.0 109.5 178.952 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 69.7 m -108.38 157.1 18.7 Favored 'General case' 0 C--N 1.313 -1.019 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.549 -179.02 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.82 ' HA ' ' HB3' ' A' ' 53' ' ' ALA . 24.1 tp60 -47.18 -6.06 0.01 OUTLIER 'General case' 0 CA--C 1.555 1.161 0 N-CA-C 114.758 1.392 . . . . 0.0 114.758 -178.554 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 21.0 ptmt -84.28 -47.17 11.05 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 105.852 -1.907 . . . . 0.0 105.852 175.564 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . 0.733 ' HG2' HG21 ' A' ' 20' ' ' VAL . 85.3 mt-30 -71.1 -35.22 71.72 Favored 'General case' 0 N--CA 1.439 -0.981 0 CA-C-N 112.659 -2.064 . . . . 0.0 110.167 174.228 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . 0.82 ' HB3' ' HA ' ' A' ' 50' ' ' GLN . . . -72.62 -51.61 18.87 Favored 'General case' 0 C--O 1.221 -0.436 0 CA-C-N 115.14 -0.936 . . . . 0.0 112.654 -177.805 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 96.4 m-20 -77.71 -17.89 57.15 Favored 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 114.356 1.243 . . . . 0.0 114.356 -178.978 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . 0.677 ' HB3' HG21 ' A' ' 17' ' ' VAL . 70.9 m -79.67 -39.4 31.45 Favored 'General case' 0 C--N 1.299 -1.61 0 C-N-CA 119.273 -0.971 . . . . 0.0 110.402 179.125 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' TYR . . . . . 0.636 ' HB2' HG21 ' A' ' 21' ' ' VAL . 19.5 t80 -70.64 -35.55 72.97 Favored 'General case' 0 CA--C 1.502 -0.9 0 N-CA-C 107.517 -1.29 . . . . 0.0 107.517 178.253 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . 0.479 ' HB2' HD13 ' A' ' 39' ' ' LEU . 64.2 tttm -57.14 -41.58 79.37 Favored 'General case' 0 CA--C 1.488 -1.415 0 CA-C-N 113.19 -1.823 . . . . 0.0 110.416 -178.308 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -80.27 -5.25 55.94 Favored 'General case' 0 N--CA 1.425 -1.683 0 O-C-N 120.662 -1.274 . . . . 0.0 110.175 179.528 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 65.7 t80 . . . . . 0 N--CA 1.45 -0.461 0 C-N-CA 119.899 -0.721 . . . . 0.0 109.182 175.402 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.449 HG22 ' O ' ' A' ' 37' ' ' ALA . 7.2 p . . . . . 0 N--CA 1.443 -0.8 0 N-CA-C 107.897 -1.149 . . . . 0.0 107.897 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.469 0.481 0 N-CA-C 112.775 0.657 . . . . 0.0 112.775 -176.348 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.514 -0.426 0 CA-C-O 121.537 0.684 . . . . 0.0 110.226 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . 0.421 ' O ' HG22 ' A' ' 20' ' ' VAL . . . -62.26 -37.34 85.1 Favored 'General case' 0 CA--C 1.503 -0.833 0 CA-C-N 114.728 -1.124 . . . . 0.0 109.607 179.926 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . 0.822 HG22 ' HB3' ' A' ' 55' ' ' SER . 46.7 t -56.4 -46.03 81.87 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.044 0 CA-C-N 114.932 -1.031 . . . . 0.0 109.942 -178.945 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 67.7 t -63.26 -49.32 83.56 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.036 0 CA-C-N 114.315 -1.311 . . . . 0.0 112.222 -177.687 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 64.3 tttm -64.64 -42.87 95.16 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 116.755 2.131 . . . . 0.0 116.755 -176.928 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.476 HG23 ' N ' ' A' ' 21' ' ' VAL . 35.1 m -78.44 -53.78 13.28 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.17 0 C-N-CA 118.391 -1.324 . . . . 0.0 113.708 -176.135 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . 0.476 ' N ' HG23 ' A' ' 20' ' ' VAL . 53.1 t -61.64 -43.18 96.65 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.72 0 C-N-CA 118.189 -1.404 . . . . 0.0 111.411 -178.181 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -64.94 -26.39 68.29 Favored 'General case' 0 C--N 1.321 -0.647 0 C-N-CA 119.972 -0.691 . . . . 0.0 112.189 179.954 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 82.3 p -75.96 -52.09 11.02 Favored 'General case' 0 N--CA 1.463 0.202 0 C-N-CA 119.642 -0.823 . . . . 0.0 111.405 179.16 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . 0.524 ' HB3' HD22 ' A' ' 42' ' ' LEU . 22.0 mp0 -70.34 -38.49 74.86 Favored 'General case' 0 C--O 1.223 -0.319 0 C-N-CA 120.838 -0.345 . . . . 0.0 111.876 178.627 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -59.74 -41.4 90.87 Favored 'General case' 0 CA--C 1.511 -0.542 0 N-CA-C 109.762 -0.458 . . . . 0.0 109.762 -177.923 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 88.9 tt0 -61.09 -46.23 91.47 Favored 'General case' 0 C--N 1.319 -0.733 0 N-CA-C 108.281 -1.007 . . . . 0.0 108.281 178.925 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 57.8 tp -65.55 -38.57 89.99 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.632 -0.713 . . . . 0.0 112.531 -179.061 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . 0.569 ' HD2' ' HB2' ' A' ' 37' ' ' ALA . 65.8 t80 -64.9 -40.2 94.71 Favored 'General case' 0 CA--C 1.506 -0.74 0 N-CA-C 106.594 -1.632 . . . . 0.0 106.594 179.112 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 92.1 mt-10 -62.66 -37.02 84.75 Favored 'General case' 0 N--CA 1.443 -0.799 0 CA-C-N 114.65 -1.159 . . . . 0.0 108.976 177.221 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 66.9 tp -61.99 -47.54 84.35 Favored 'General case' 0 N--CA 1.438 -1.069 0 C-N-CA 117.871 -1.532 . . . . 0.0 107.012 177.656 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 64.7 tttp -50.49 -49.73 54.65 Favored 'General case' 0 CA--C 1.52 -0.184 0 CA-C-N 115.338 -0.847 . . . . 0.0 109.422 177.433 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 98.8 m-20 -129.14 86.82 2.48 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 114.785 -1.098 . . . . 0.0 110.093 179.509 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 96.1 m -66.21 -40.35 90.27 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 112.901 0.704 . . . . 0.0 112.901 -178.209 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 65.5 t30 -58.51 -40.15 82.08 Favored 'General case' 0 C--N 1.325 -0.465 0 C-N-CA 120.823 -0.351 . . . . 0.0 111.254 -177.901 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 96.2 mt-10 -106.45 137.4 44.51 Favored 'General case' 0 C--N 1.325 -0.494 0 C-N-CA 120.53 -0.468 . . . . 0.0 110.008 -179.897 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -88.12 129.57 35.27 Favored 'General case' 0 N--CA 1.433 -1.301 0 C-N-CA 118.614 -1.234 . . . . 0.0 109.943 179.333 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . 0.569 ' HB2' ' HD2' ' A' ' 28' ' ' TYR . . . -48.72 -178.72 0.0 OUTLIER 'General case' 0 C--N 1.315 -0.911 0 CA-C-N 114.005 -1.452 . . . . 0.0 111.025 -179.377 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . 0.404 ' HA ' HG22 ' A' ' 70' ' ' VAL . 81.3 p -153.57 170.31 21.1 Favored 'General case' 0 C--N 1.314 -0.974 0 N-CA-C 108.427 -0.953 . . . . 0.0 108.427 177.917 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.681 HD21 ' HB3' ' A' ' 56' ' ' TYR . 97.5 mt -60.89 -41.78 96.72 Favored 'General case' 0 C--N 1.311 -1.093 0 N-CA-C 108.154 -1.054 . . . . 0.0 108.154 -179.601 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 75.0 m -63.86 -40.11 95.78 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.502 -0.772 . . . . 0.0 111.949 179.198 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -64.13 -46.74 82.79 Favored 'General case' 0 N--CA 1.464 0.231 0 N-CA-C 113.011 0.745 . . . . 0.0 113.011 -178.34 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.524 HD22 ' HB3' ' A' ' 24' ' ' GLN . 77.2 mt -63.29 -34.91 78.71 Favored 'General case' 0 CA--C 1.491 -1.292 0 N-CA-C 108.578 -0.897 . . . . 0.0 108.578 -178.026 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.914 HG21 ' HA ' ' A' ' 50' ' ' GLN . 0.4 OUTLIER -81.53 -28.37 10.27 Favored 'Isoleucine or valine' 0 N--CA 1.416 -2.146 0 CA-C-N 114.666 -1.152 . . . . 0.0 111.718 -176.676 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . 0.557 ' C ' ' H ' ' A' ' 46' ' ' GLY . 75.8 m -61.88 -50.54 71.81 Favored 'General case' 0 N--CA 1.417 -2.075 0 N-CA-C 104.797 -2.298 . . . . 0.0 104.797 177.617 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . 0.438 ' O ' ' N ' ' A' ' 47' ' ' ASN . 2.4 p -52.8 1.6 0.01 OUTLIER 'General case' 0 CA--C 1.551 0.985 0 CA-C-N 113.249 -1.796 . . . . 0.0 112.933 170.739 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . 0.557 ' H ' ' C ' ' A' ' 44' ' ' SER . . . 28.27 32.33 0.01 OUTLIER Glycine 0 C--N 1.346 1.116 0 C-N-CA 125.757 1.646 . . . . 0.0 114.679 -173.466 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . 0.438 ' N ' ' O ' ' A' ' 45' ' ' SER . 54.7 t-20 -63.79 -42.28 97.75 Favored 'General case' 0 CA--C 1.518 -0.272 0 N-CA-C 106.588 -1.634 . . . . 0.0 106.588 175.699 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 0.735 HD12 HG23 ' A' ' 43' ' ' VAL . 2.4 pp -121.94 166.44 16.57 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.703 0 CA-C-N 112.221 -2.263 . . . . 0.0 109.941 -179.284 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 98.7 p -81.17 166.97 20.16 Favored 'General case' 0 N--CA 1.444 -0.764 0 C-N-CA 120.544 -0.462 . . . . 0.0 110.251 -179.636 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.914 ' HA ' HG21 ' A' ' 43' ' ' VAL . 11.9 tm0? -57.93 -48.86 78.66 Favored 'General case' 0 CA--C 1.493 -1.224 0 CA-C-O 118.531 -0.747 . . . . 0.0 109.212 179.942 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . 0.475 ' O ' ' N ' ' A' ' 55' ' ' SER . 64.3 pttt -60.0 -24.88 64.83 Favored 'General case' 0 CA--C 1.482 -1.672 0 CA-C-N 120.166 1.348 . . . . 0.0 110.953 -177.533 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . 0.462 ' HG2' HG21 ' A' ' 20' ' ' VAL . 3.6 tm0? -67.84 -37.5 81.96 Favored 'General case' 0 N--CA 1.434 -1.25 0 N-CA-C 104.978 -2.231 . . . . 0.0 104.978 175.035 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . 0.644 ' O ' HD13 ' A' ' 39' ' ' LEU . . . -63.68 -49.11 74.45 Favored 'General case' 0 C--O 1.218 -0.557 0 C-N-CA 118.608 -1.237 . . . . 0.0 107.935 175.927 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 99.9 m-20 -70.56 -11.29 60.84 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 119.226 -0.99 . . . . 0.0 112.125 177.855 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . 0.822 ' HB3' HG22 ' A' ' 17' ' ' VAL . 62.5 m -64.65 -41.29 96.23 Favored 'General case' 0 CA--C 1.503 -0.836 0 N-CA-C 109.028 -0.73 . . . . 0.0 109.028 -179.734 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' TYR . . . . . 0.681 ' HB3' HD21 ' A' ' 39' ' ' LEU . 1.1 t80 -79.55 -30.49 41.75 Favored 'General case' 0 C--N 1.321 -0.669 0 C-N-CA 118.548 -1.261 . . . . 0.0 109.469 179.565 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -60.54 -27.5 67.69 Favored 'General case' 0 CA--C 1.54 0.558 0 N-CA-C 106.797 -1.557 . . . . 0.0 106.797 174.425 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . 0.784 ' HB3' ' O ' ' A' ' 55' ' ' SER . . . -68.57 -39.38 81.02 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 112.105 -2.316 . . . . 0.0 109.881 176.255 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 66.5 t80 . . . . . 0 C--N 1.344 0.341 0 N-CA-C 108.668 -0.864 . . . . 0.0 108.668 176.687 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.404 HG22 ' HA ' ' A' ' 38' ' ' SER . 3.8 p . . . . . 0 N--CA 1.44 -0.966 0 N-CA-C 105.593 -2.003 . . . . 0.0 105.593 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.334 0 C-N-CA 119.303 -0.959 . . . . 0.0 113.015 -174.547 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.515 -0.366 0 CA-C-O 122.007 0.908 . . . . 0.0 109.978 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -61.85 -38.26 87.57 Favored 'General case' 0 N--CA 1.444 -0.728 0 CA-C-N 114.456 -1.247 . . . . 0.0 110.038 -179.807 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . 0.826 HG11 ' HB3' ' A' ' 55' ' ' SER . 3.4 p -67.79 -25.65 33.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 C-N-CA 119.39 -0.924 . . . . 0.0 110.888 -178.78 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 60.8 t -63.33 -45.2 98.8 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.709 0 C-N-CA 119.75 -0.78 . . . . 0.0 109.152 179.893 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 15.0 tmtt? -64.56 -39.59 94.03 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 114.57 -1.196 . . . . 0.0 114.057 -178.925 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.467 HG21 ' CG ' ' A' ' 52' ' ' GLN . 34.6 m -69.94 -45.17 77.62 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.126 0 N-CA-C 113.221 0.823 . . . . 0.0 113.221 -176.729 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . 0.519 HG21 ' HB2' ' A' ' 56' ' ' TYR . 54.2 t -59.86 -42.36 88.86 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.842 0 C-N-CA 120.223 -0.591 . . . . 0.0 110.342 -179.403 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 98.7 mt-10 -62.35 -38.25 88.82 Favored 'General case' 0 C--N 1.321 -0.656 0 C-N-CA 120.837 -0.345 . . . . 0.0 111.561 179.74 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 73.1 m -64.89 -49.06 71.97 Favored 'General case' 0 N--CA 1.467 0.386 0 C-N-CA 120.379 -0.529 . . . . 0.0 111.431 179.636 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 18.3 mp0 -67.64 -37.42 82.42 Favored 'General case' 0 C--O 1.222 -0.389 0 CA-C-O 121.077 0.465 . . . . 0.0 109.955 178.059 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.406 ' O ' ' HG3' ' A' ' 29' ' ' GLU . . . -60.48 -39.58 88.16 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.309 -0.859 . . . . 0.0 110.265 -179.338 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 54.5 tp10 -68.74 -41.27 79.19 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 123.869 0.73 . . . . 0.0 110.25 178.781 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 58.5 tp -71.04 -38.46 72.56 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.302 -0.863 . . . . 0.0 113.063 -179.525 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . 0.43 ' HD2' ' HB2' ' A' ' 37' ' ' ALA . 85.9 t80 -65.11 -46.6 80.4 Favored 'General case' 0 CA--C 1.493 -1.225 0 N-CA-C 107.969 -1.123 . . . . 0.0 107.969 179.906 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . 0.566 ' O ' ' N ' ' A' ' 33' ' ' THR . 2.6 pp20? -71.88 -23.23 61.47 Favored 'General case' 0 N--CA 1.43 -1.43 0 C-N-CA 118.563 -1.255 . . . . 0.0 108.809 176.636 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 67.5 tp -62.91 -48.54 78.49 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 105.979 -1.86 . . . . 0.0 105.979 177.894 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -50.69 -48.27 58.7 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 113.691 -1.595 . . . . 0.0 110.606 176.805 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 28.2 m120 -89.17 -66.71 0.89 Allowed 'General case' 0 N--CA 1.479 0.996 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.935 -178.225 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.566 ' N ' ' O ' ' A' ' 29' ' ' GLU . 4.0 m 81.31 -36.0 0.11 Allowed 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.182 0.926 . . . . 0.0 112.228 178.415 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 99.1 m-20 -61.38 -41.09 96.53 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 119.819 -0.752 . . . . 0.0 109.664 -179.971 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 94.6 mt-10 -115.16 -162.36 0.82 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.07 -0.513 . . . . 0.0 109.708 -179.469 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 1.1 mptp? -129.38 133.56 47.44 Favored 'General case' 0 N--CA 1.437 -1.078 0 N-CA-C 107.241 -1.392 . . . . 0.0 107.241 176.43 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . 0.43 ' HB2' ' HD2' ' A' ' 28' ' ' TYR . . . -52.54 178.21 0.02 OUTLIER 'General case' 0 C--N 1.318 -0.772 0 CA-C-O 120.989 0.423 . . . . 0.0 110.086 -179.67 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . 0.441 ' CB ' ' O ' ' A' ' 71' ' ' ALA . 82.6 p -158.61 157.6 32.23 Favored 'General case' 0 CA--C 1.508 -0.644 0 N-CA-C 109.083 -0.71 . . . . 0.0 109.083 178.352 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.526 HD11 ' HB3' ' A' ' 56' ' ' TYR . 75.6 mt -58.48 -41.65 85.73 Favored 'General case' 0 C--N 1.317 -0.841 0 C-N-CA 117.9 -1.52 . . . . 0.0 109.122 -179.216 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 93.0 p -63.35 -33.97 76.69 Favored 'General case' 0 C--N 1.313 -1.016 0 C-N-CA 119.191 -1.004 . . . . 0.0 109.817 177.805 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 57.7 mtpt -76.14 -54.83 6.24 Favored 'General case' 0 CA--C 1.52 -0.175 0 N-CA-C 114.874 1.435 . . . . 0.0 114.874 -178.211 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 82.6 mt -60.54 -41.16 93.92 Favored 'General case' 0 CA--C 1.49 -1.344 0 CA-C-O 123.023 1.392 . . . . 0.0 107.63 -176.568 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.461 ' HB ' ' O ' ' A' ' 39' ' ' LEU . 0.3 OUTLIER -69.58 -46.15 76.23 Favored 'Isoleucine or valine' 0 N--CA 1.398 -3.054 0 CA-C-N 111.523 -2.58 . . . . 0.0 110.873 -172.788 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . 0.564 ' C ' ' H ' ' A' ' 46' ' ' GLY . 48.2 t -61.08 -46.7 89.56 Favored 'General case' 0 N--CA 1.42 -1.951 0 C-N-CA 116.359 -2.136 . . . . 0.0 105.508 178.208 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . 0.4 ' O ' ' N ' ' A' ' 47' ' ' ASN . 59.1 m -50.58 2.53 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.89 0 CA-C-N 113.303 -1.772 . . . . 0.0 113.555 172.483 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . 0.564 ' H ' ' C ' ' A' ' 44' ' ' SER . . . 28.46 37.5 0.01 OUTLIER Glycine 0 C--N 1.347 1.187 0 C-N-CA 125.043 1.306 . . . . 0.0 113.42 -173.45 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . 0.4 ' N ' ' O ' ' A' ' 45' ' ' SER . 55.6 t-20 -68.01 -39.85 83.11 Favored 'General case' 0 N--CA 1.449 -0.489 0 N-CA-C 106.256 -1.757 . . . . 0.0 106.256 173.126 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 24.1 pt -129.08 161.14 39.04 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.638 0 CA-C-N 112.187 -2.278 . . . . 0.0 108.701 179.645 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . 0.403 ' O ' ' N ' ' A' ' 52' ' ' GLN . 72.3 m -91.27 136.26 33.22 Favored 'General case' 0 C--O 1.216 -0.704 0 C-N-CA 119.993 -0.683 . . . . 0.0 111.597 -179.315 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.591 ' HA ' ' HB3' ' A' ' 53' ' ' ALA . 65.8 tp60 -48.7 -17.57 0.19 Allowed 'General case' 0 C--O 1.214 -0.79 0 CA-C-N 114.986 -1.007 . . . . 0.0 112.842 -177.392 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 63.5 pttt -71.94 -39.4 69.44 Favored 'General case' 0 C--N 1.31 -1.141 0 N-CA-C 106.35 -1.722 . . . . 0.0 106.35 177.806 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . 0.467 ' CG ' HG21 ' A' ' 20' ' ' VAL . 5.8 tt0 -69.69 -52.36 26.38 Favored 'General case' 0 N--CA 1.428 -1.531 0 CA-C-N 112.323 -2.217 . . . . 0.0 106.224 176.791 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . 0.591 ' HB3' ' HA ' ' A' ' 50' ' ' GLN . . . -60.36 -38.51 84.08 Favored 'General case' 0 C--N 1.344 0.347 0 CA-C-N 115.375 -0.829 . . . . 0.0 111.881 -176.086 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 98.8 m-20 -62.03 -39.61 92.9 Favored 'General case' 0 C--N 1.314 -0.949 0 C-N-CA 120.197 -0.601 . . . . 0.0 112.614 179.638 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . 0.826 ' HB3' HG11 ' A' ' 17' ' ' VAL . 75.4 m -62.87 -41.38 99.36 Favored 'General case' 0 C--N 1.314 -0.97 0 C-N-CA 119.213 -0.995 . . . . 0.0 110.473 -179.318 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' TYR . . . . . 0.526 ' HB3' HD11 ' A' ' 39' ' ' LEU . 0.9 OUTLIER -69.6 -39.0 77.51 Favored 'General case' 0 N--CA 1.464 0.269 0 C-N-CA 118.015 -1.474 . . . . 0.0 108.81 179.942 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . 0.434 ' HB2' HD13 ' A' ' 39' ' ' LEU . 87.9 tttt -55.76 -33.34 64.22 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.173 -0.922 . . . . 0.0 108.753 178.524 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . 0.504 ' HB3' ' O ' ' A' ' 55' ' ' SER . . . -60.5 -37.46 81.19 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-N 115.226 -0.897 . . . . 0.0 109.623 178.519 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 62.4 m-85 . . . . . 0 N--CA 1.465 0.317 0 C-N-CA 120.065 -0.654 . . . . 0.0 109.981 178.768 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.406 ' CG2' ' O ' ' A' ' 37' ' ' ALA . 2.9 p . . . . . 0 N--CA 1.449 -0.516 0 N-CA-C 108.285 -1.006 . . . . 0.0 108.285 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . 0.441 ' O ' ' CB ' ' A' ' 38' ' ' SER . . . . . . . . 0 C--O 1.21 -1.012 0 C-N-CA 119.342 -0.943 . . . . 0.0 110.667 -177.371 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.235 0.297 0 CA-C-O 122.292 1.044 . . . . 0.0 110.795 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . 0.6 ' O ' HG22 ' A' ' 20' ' ' VAL . . . -59.72 -36.44 76.56 Favored 'General case' 0 N--CA 1.446 -0.671 0 CA-C-N 113.761 -1.563 . . . . 0.0 111.246 -177.46 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . 0.567 HG11 ' HE1' ' A' ' 59' ' ' TYR . 9.8 p -51.79 -36.75 19.52 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 C-N-CA 119.155 -1.018 . . . . 0.0 111.027 -178.199 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 77.3 t -70.44 -45.67 73.87 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 C-N-CA 119.832 -0.747 . . . . 0.0 110.042 179.531 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 64.8 tttp -62.64 -43.85 97.77 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-N 115.302 -0.863 . . . . 0.0 113.263 -178.962 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.747 HG21 ' HG2' ' A' ' 52' ' ' GLN . 30.1 m -70.44 -50.65 44.17 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.18 0 N-CA-C 113.723 1.009 . . . . 0.0 113.723 -177.303 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . 0.67 HG11 ' CD2' ' A' ' 56' ' ' TYR . 65.3 t -65.48 -44.89 94.07 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 C-N-CA 120.249 -0.58 . . . . 0.0 112.073 -178.495 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 98.7 mt-10 -65.0 -42.66 94.3 Favored 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 112.763 0.653 . . . . 0.0 112.763 -179.129 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 74.1 m -66.51 -45.08 80.74 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-O 121.518 0.675 . . . . 0.0 110.501 -179.909 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 99.5 mm-40 -66.0 -37.93 87.18 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 114.859 -1.064 . . . . 0.0 109.114 179.065 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.427 ' HB2' ' O ' ' A' ' 21' ' ' VAL . . . -59.3 -40.36 85.93 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 114.725 -1.125 . . . . 0.0 109.516 -179.125 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 88.8 tt0 -66.15 -39.87 90.15 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.304 178.441 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 56.8 tp -64.31 -38.47 91.15 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.563 -179.591 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . 0.444 ' HB3' ' HB2' ' A' ' 37' ' ' ALA . 87.5 t80 -66.26 -36.74 83.77 Favored 'General case' 0 CA--C 1.503 -0.856 0 N-CA-C 107.695 -1.224 . . . . 0.0 107.695 177.762 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 95.1 mt-10 -64.94 -35.6 81.7 Favored 'General case' 0 N--CA 1.445 -0.682 0 N-CA-C 108.905 -0.776 . . . . 0.0 108.905 176.638 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 66.7 tp -62.36 -47.92 82.04 Favored 'General case' 0 N--CA 1.436 -1.141 0 N-CA-C 106.619 -1.623 . . . . 0.0 106.619 177.894 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 60.9 tptt -50.82 -50.57 56.14 Favored 'General case' 0 CA--C 1.523 -0.09 0 CA-C-N 115.115 -0.948 . . . . 0.0 109.279 177.371 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 27.5 m120 -129.55 102.17 6.26 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 114.63 -1.168 . . . . 0.0 109.891 179.172 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 11.3 t -87.08 -15.75 37.61 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 112.309 0.485 . . . . 0.0 112.309 -178.241 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 48.3 t30 -59.92 -43.53 94.85 Favored 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 120.519 -0.472 . . . . 0.0 110.81 -179.079 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 70.9 mm-40 -109.79 -161.03 0.74 Allowed 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 179.791 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 75.8 mmtt -128.69 140.49 51.72 Favored 'General case' 0 N--CA 1.43 -1.466 0 N-CA-C 106.34 -1.726 . . . . 0.0 106.34 175.406 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . 0.444 ' HB2' ' HB3' ' A' ' 28' ' ' TYR . . . -51.03 163.81 0.19 Allowed 'General case' 0 C--N 1.315 -0.921 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 -179.535 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . 0.532 ' HA ' HG22 ' A' ' 70' ' ' VAL . 19.7 m -135.47 144.69 46.55 Favored 'General case' 0 N--CA 1.433 -1.307 0 N-CA-C 107.226 -1.398 . . . . 0.0 107.226 177.97 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.431 HD21 ' HB1' ' A' ' 53' ' ' ALA . 8.5 tt -53.93 -40.64 66.92 Favored 'General case' 0 C--N 1.315 -0.901 0 N-CA-C 108.697 -0.853 . . . . 0.0 108.697 -178.365 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 92.8 p -65.3 -34.61 78.74 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.452 -0.794 . . . . 0.0 110.171 177.807 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . 0.404 ' HG3' ' HB2' ' A' ' 38' ' ' SER . 97.7 mttt -73.17 -49.18 29.54 Favored 'General case' 0 CA--C 1.513 -0.475 0 N-CA-C 114.122 1.156 . . . . 0.0 114.122 -178.883 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.439 HD23 HD22 ' A' ' 47' ' ' ASN . 96.3 mt -60.62 -40.58 92.4 Favored 'General case' 0 CA--C 1.49 -1.352 0 N-CA-C 107.243 -1.391 . . . . 0.0 107.243 -176.116 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.401 HG21 ' HA ' ' A' ' 50' ' ' GLN . 0.3 OUTLIER -70.04 -46.88 71.4 Favored 'Isoleucine or valine' 0 N--CA 1.397 -3.081 0 CA-C-N 111.815 -2.448 . . . . 0.0 111.251 -172.906 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . 0.543 ' C ' ' H ' ' A' ' 46' ' ' GLY . 74.2 m -61.37 -45.77 93.0 Favored 'General case' 0 N--CA 1.407 -2.604 0 C-N-CA 116.242 -2.183 . . . . 0.0 105.997 178.511 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . 0.424 ' O ' ' N ' ' A' ' 47' ' ' ASN . 26.4 t -50.6 6.23 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.967 0 CA-C-N 113.724 -1.58 . . . . 0.0 114.082 172.536 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . 0.543 ' H ' ' C ' ' A' ' 44' ' ' SER . . . 29.17 36.11 0.01 OUTLIER Glycine 0 C--N 1.351 1.374 0 C-N-CA 124.586 1.088 . . . . 0.0 113.25 -173.013 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . 0.439 HD22 HD23 ' A' ' 42' ' ' LEU . 95.5 m-20 -67.98 -39.55 83.27 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-O 122.779 1.275 . . . . 0.0 107.696 172.989 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 11.6 pt -131.7 159.43 43.08 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.858 0 CA-C-N 112.382 -2.19 . . . . 0.0 109.205 179.87 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . 0.444 ' O ' ' N ' ' A' ' 52' ' ' GLN . 45.3 t -83.08 134.19 35.03 Favored 'General case' 0 C--O 1.211 -0.944 0 C-N-CA 120.494 -0.482 . . . . 0.0 111.14 -179.625 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.456 ' HA ' ' HB3' ' A' ' 53' ' ' ALA . 66.4 tp60 -50.44 -18.48 0.65 Allowed 'General case' 0 C--O 1.212 -0.908 0 CA-C-N 116.279 -0.418 . . . . 0.0 111.61 -179.22 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . 0.407 ' CG ' ' N ' ' A' ' 52' ' ' GLN . 63.3 pttt -72.86 -40.6 65.53 Favored 'General case' 0 C--N 1.317 -0.831 0 N-CA-C 106.018 -1.845 . . . . 0.0 106.018 178.092 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . 0.747 ' HG2' HG21 ' A' ' 20' ' ' VAL . 0.5 OUTLIER -67.63 -53.01 31.51 Favored 'General case' 0 N--CA 1.424 -1.759 0 CA-C-N 112.082 -2.326 . . . . 0.0 106.549 176.483 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . 0.456 ' HB3' ' HA ' ' A' ' 50' ' ' GLN . . . -61.63 -38.9 89.36 Favored 'General case' 0 C--O 1.22 -0.46 0 C-N-CA 119.885 -0.726 . . . . 0.0 112.161 -177.579 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 98.0 m-20 -60.62 -39.83 89.66 Favored 'General case' 0 C--N 1.311 -1.092 0 C-N-CA 119.374 -0.93 . . . . 0.0 111.579 -179.718 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . 0.461 ' CB ' HG21 ' A' ' 17' ' ' VAL . 67.3 m -64.62 -40.68 95.91 Favored 'General case' 0 C--N 1.31 -1.135 0 C-N-CA 119.751 -0.78 . . . . 0.0 111.147 179.147 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' TYR . . . . . 0.67 ' CD2' HG11 ' A' ' 21' ' ' VAL . 10.7 t80 -70.44 -39.98 74.02 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-O 122.069 0.938 . . . . 0.0 109.737 -178.66 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 64.4 tttm -58.48 -33.24 69.56 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 113.886 -1.506 . . . . 0.0 108.879 179.148 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . 0.449 ' HB3' ' O ' ' A' ' 55' ' ' SER . . . -61.4 -37.87 85.0 Favored 'General case' 0 N--CA 1.443 -0.803 0 CA-C-N 114.886 -1.052 . . . . 0.0 110.143 178.14 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . 0.567 ' HE1' HG11 ' A' ' 17' ' ' VAL . 73.2 m-85 . . . . . 0 C--N 1.342 0.281 0 C-N-CA 119.966 -0.694 . . . . 0.0 109.894 178.666 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.532 HG22 ' HA ' ' A' ' 38' ' ' SER . 4.0 p . . . . . 0 CA--C 1.54 0.57 0 N-CA-C 108.986 -0.746 . . . . 0.0 108.986 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.348 0.528 0 N-CA-C 113.79 1.033 . . . . 0.0 113.79 -174.901 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.365 0 CA-C-O 121.302 0.573 . . . . 0.0 110.815 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -62.03 -39.47 92.43 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.366 -0.834 . . . . 0.0 111.062 -178.837 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . 0.562 ' HA ' HG22 ' A' ' 20' ' ' VAL . 12.9 p -67.65 -28.19 40.92 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 C-N-CA 119.296 -0.962 . . . . 0.0 110.882 -178.994 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 58.3 t -61.13 -45.28 98.88 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.908 0 N-CA-C 108.491 -0.929 . . . . 0.0 108.491 179.402 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 40.2 ttpt -65.32 -39.94 93.08 Favored 'General case' 0 CA--C 1.541 0.606 0 N-CA-C 115.07 1.507 . . . . 0.0 115.07 -179.56 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.755 HG21 ' HG2' ' A' ' 52' ' ' GLN . 27.2 m -76.8 -51.09 19.78 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.298 0 N-CA-C 114.208 1.188 . . . . 0.0 114.208 -177.224 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . 0.485 ' N ' HG23 ' A' ' 20' ' ' VAL . 79.6 t -64.22 -44.87 97.5 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.748 0 N-CA-C 112.057 0.391 . . . . 0.0 112.057 -177.887 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 97.3 mt-10 -64.6 -40.18 95.06 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 112.911 0.708 . . . . 0.0 112.911 -179.682 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 47.8 t -65.84 -47.76 73.9 Favored 'General case' 0 N--CA 1.463 0.205 0 C-N-CA 120.209 -0.596 . . . . 0.0 110.212 178.878 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -65.28 -37.51 87.4 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.206 -0.906 . . . . 0.0 110.068 178.598 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.973 ' HB1' HG11 ' A' ' 70' ' ' VAL . . . -58.1 -43.89 87.34 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 -177.845 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 88.9 tt0 -61.63 -43.91 97.98 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 114.657 -1.156 . . . . 0.0 109.596 179.74 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 53.8 tp -65.88 -37.92 87.42 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.676 -0.693 . . . . 0.0 112.389 -179.646 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . 0.736 ' HB3' ' HB2' ' A' ' 37' ' ' ALA . 83.7 t80 -67.52 -39.46 85.1 Favored 'General case' 0 CA--C 1.509 -0.609 0 N-CA-C 106.942 -1.503 . . . . 0.0 106.942 178.896 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . 0.422 ' O ' ' N ' ' A' ' 33' ' ' THR . 94.4 mt-10 -61.94 -37.92 86.54 Favored 'General case' 0 N--CA 1.443 -0.803 0 N-CA-C 108.272 -1.01 . . . . 0.0 108.272 176.966 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 65.6 tp -63.49 -46.39 86.36 Favored 'General case' 0 N--CA 1.442 -0.872 0 N-CA-C 107.137 -1.431 . . . . 0.0 107.137 177.303 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 24.7 ttmm -50.46 -49.35 55.37 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-N 114.449 -1.25 . . . . 0.0 111.94 178.987 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 99.2 m-20 -108.52 -57.33 2.14 Favored 'General case' 0 N--CA 1.479 1.003 0 N-CA-C 113.515 0.931 . . . . 0.0 113.515 -177.824 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.422 ' N ' ' O ' ' A' ' 29' ' ' GLU . 0.4 OUTLIER 80.79 -41.41 0.18 Allowed 'General case' 0 N--CA 1.471 0.616 0 O-C-N 123.793 0.683 . . . . 0.0 111.999 179.859 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 65.2 t30 -60.75 -39.26 88.07 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.558 -0.457 . . . . 0.0 109.961 179.666 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 16.8 pm0 -117.51 162.32 18.17 Favored 'General case' 0 CA--C 1.513 -0.464 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.62 178.847 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.511 ' HB2' ' HB2' ' A' ' 71' ' ' ALA . 99.2 mttt -99.73 136.27 39.9 Favored 'General case' 0 N--CA 1.431 -1.397 0 N-CA-C 108.43 -0.952 . . . . 0.0 108.43 177.613 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . 0.736 ' HB2' ' HB3' ' A' ' 28' ' ' TYR . . . -49.44 160.53 0.25 Allowed 'General case' 0 C--N 1.311 -1.107 0 CA-C-N 115.265 -0.879 . . . . 0.0 109.183 -179.687 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . 0.412 ' H ' ' HB2' ' A' ' 41' ' ' LYS . 84.7 p -146.84 169.14 19.73 Favored 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 108.735 -0.839 . . . . 0.0 108.735 179.678 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.61 HD22 ' HA ' ' A' ' 53' ' ' ALA . 86.5 mt -60.53 -39.78 89.1 Favored 'General case' 0 C--N 1.314 -0.946 0 C-N-CA 118.508 -1.277 . . . . 0.0 108.414 179.672 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 75.4 m -64.6 -40.72 96.01 Favored 'General case' 0 C--N 1.319 -0.734 0 C-N-CA 120.459 -0.497 . . . . 0.0 111.948 178.621 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . 0.412 ' HB2' ' H ' ' A' ' 38' ' ' SER . 99.3 mttt -74.86 -54.16 7.78 Favored 'General case' 0 N--CA 1.472 0.67 0 N-CA-C 114.232 1.197 . . . . 0.0 114.232 -177.389 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.495 ' HG ' ' HB1' ' A' ' 37' ' ' ALA . 87.6 mt -59.79 -34.83 73.54 Favored 'General case' 0 CA--C 1.485 -1.533 0 N-CA-C 108.549 -0.908 . . . . 0.0 108.549 -175.853 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.539 HG23 ' O ' ' A' ' 48' ' ' ILE . 0.3 OUTLIER -80.99 -28.8 11.19 Favored 'Isoleucine or valine' 0 N--CA 1.405 -2.679 0 CA-C-N 114.051 -1.431 . . . . 0.0 112.136 -176.852 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . 0.563 ' C ' ' H ' ' A' ' 46' ' ' GLY . 48.0 t -63.11 -49.93 72.5 Favored 'General case' 0 N--CA 1.428 -1.546 0 N-CA-C 103.922 -2.622 . . . . 0.0 103.922 176.337 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . 0.455 ' O ' ' N ' ' A' ' 47' ' ' ASN . 63.0 m -51.49 -1.16 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.914 0 CA-C-N 112.278 -2.237 . . . . 0.0 112.744 171.362 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . 0.563 ' H ' ' C ' ' A' ' 44' ' ' SER . . . 29.27 28.36 0.01 OUTLIER Glycine 0 C--N 1.343 0.969 0 C-N-CA 126.082 1.801 . . . . 0.0 115.174 -172.834 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . 0.455 ' N ' ' O ' ' A' ' 45' ' ' SER . 39.7 t-20 -61.62 -42.52 98.99 Favored 'General case' 0 CA--C 1.512 -0.491 0 N-CA-C 104.225 -2.509 . . . . 0.0 104.225 175.571 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 0.539 ' O ' HG23 ' A' ' 43' ' ' VAL . 16.3 pt -118.22 136.02 56.73 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.023 0 CA-C-N 111.695 -2.502 . . . . 0.0 107.791 176.443 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 84.6 p -79.94 159.87 26.17 Favored 'General case' 0 C--N 1.317 -0.829 0 C-N-CA 119.666 -0.814 . . . . 0.0 110.45 -179.337 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.515 ' HA ' ' HB3' ' A' ' 53' ' ' ALA . 60.7 tp60 -57.86 -8.16 0.9 Allowed 'General case' 0 CA--C 1.546 0.79 0 CA-C-N 115.95 -0.568 . . . . 0.0 112.023 -179.69 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 10.9 ptmt -78.83 -43.87 24.26 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 103.956 -2.609 . . . . 0.0 103.956 176.491 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . 0.755 ' HG2' HG21 ' A' ' 20' ' ' VAL . 3.7 mt-30 -68.37 -47.6 66.98 Favored 'General case' 0 N--CA 1.429 -1.49 0 CA-C-N 112.724 -2.034 . . . . 0.0 108.411 176.315 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . 0.61 ' HA ' HD22 ' A' ' 39' ' ' LEU . . . -63.78 -43.7 95.56 Favored 'General case' 0 C--N 1.343 0.284 0 C-N-CA 119.412 -0.915 . . . . 0.0 111.309 -178.384 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 98.0 m-20 -62.37 -29.31 70.38 Favored 'General case' 0 C--N 1.319 -0.756 0 C-N-CA 120.22 -0.592 . . . . 0.0 110.641 178.906 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . 0.769 ' O ' ' HB3' ' A' ' 58' ' ' ALA . 47.5 t -64.47 -39.22 93.4 Favored 'General case' 0 N--CA 1.44 -0.939 0 CA-C-N 115.452 -0.795 . . . . 0.0 110.659 178.211 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' TYR . . . . . 0.564 ' HB3' HD21 ' A' ' 39' ' ' LEU . 0.4 OUTLIER -72.62 -40.22 66.62 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 118.886 -1.126 . . . . 0.0 111.606 -178.515 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -57.68 -28.83 64.13 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 107.275 -1.38 . . . . 0.0 107.275 176.334 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . 0.769 ' HB3' ' O ' ' A' ' 55' ' ' SER . . . -66.63 -39.67 88.4 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 112.606 -2.088 . . . . 0.0 109.694 175.937 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 89.9 t80 . . . . . 0 N--CA 1.47 0.575 0 CA-C-O 121.113 0.482 . . . . 0.0 110.754 177.211 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.973 HG11 ' HB1' ' A' ' 25' ' ' ALA . 0.0 OUTLIER . . . . . 0 N--CA 1.468 0.426 0 N-CA-C 108.621 -0.881 . . . . 0.0 108.621 . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . 0.511 ' HB2' ' HB2' ' A' ' 36' ' ' LYS . . . . . . . . 0 N--CA 1.431 -1.382 0 C-N-CA 120.646 -0.422 . . . . 0.0 110.478 177.977 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.446 -0.643 0 CA-C-O 121.739 0.78 . . . . 0.0 109.641 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -62.14 -39.8 93.83 Favored 'General case' 0 N--CA 1.444 -0.73 0 CA-C-N 114.846 -1.07 . . . . 0.0 110.535 -179.274 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . 0.506 HG21 ' CB ' ' A' ' 55' ' ' SER . 11.8 p -62.66 -31.99 54.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 C-N-CA 117.873 -1.531 . . . . 0.0 110.646 -178.879 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 62.9 t -60.08 -46.4 94.39 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.743 0 N-CA-C 108.764 -0.828 . . . . 0.0 108.764 -179.084 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 40.2 ttpt -63.66 -38.38 90.91 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 115.043 1.497 . . . . 0.0 115.043 -179.612 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.491 HG23 ' N ' ' A' ' 21' ' ' VAL . 27.0 m -78.25 -54.38 12.31 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.306 0 N-CA-C 113.835 1.05 . . . . 0.0 113.835 -177.214 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . 0.491 ' N ' HG23 ' A' ' 20' ' ' VAL . 62.3 t -62.13 -43.75 98.18 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.764 0 C-N-CA 119.705 -0.798 . . . . 0.0 111.163 -178.274 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -65.27 -32.25 73.82 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 112.821 0.674 . . . . 0.0 112.821 -179.417 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 87.5 p -75.88 -47.64 24.63 Favored 'General case' 0 C--O 1.231 0.107 0 C-N-CA 119.671 -0.811 . . . . 0.0 111.744 179.306 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . 0.513 ' HB3' HD22 ' A' ' 42' ' ' LEU . 17.4 mp0 -72.07 -39.38 69.05 Favored 'General case' 0 C--O 1.22 -0.467 0 N-CA-C 112.183 0.438 . . . . 0.0 112.183 178.597 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -58.7 -41.46 86.36 Favored 'General case' 0 CA--C 1.512 -0.501 0 CA-C-O 121.422 0.629 . . . . 0.0 109.359 -177.321 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 54.0 tp10 -60.5 -46.66 89.29 Favored 'General case' 0 C--N 1.318 -0.775 0 N-CA-C 107.595 -1.261 . . . . 0.0 107.595 178.837 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 57.7 tp -64.23 -39.58 94.26 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.444 -0.798 . . . . 0.0 112.539 -179.086 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . 0.562 ' HD2' ' HB2' ' A' ' 37' ' ' ALA . 73.2 t80 -62.44 -44.08 97.28 Favored 'General case' 0 CA--C 1.505 -0.77 0 N-CA-C 106.4 -1.704 . . . . 0.0 106.4 179.305 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 93.3 mt-10 -60.25 -37.74 81.31 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 114.818 -1.083 . . . . 0.0 108.939 178.627 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 66.5 tp -61.88 -47.98 82.56 Favored 'General case' 0 N--CA 1.435 -1.175 0 C-N-CA 117.975 -1.49 . . . . 0.0 107.153 177.908 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -50.54 -50.75 52.52 Favored 'General case' 0 CA--C 1.519 -0.229 0 CA-C-N 115.543 -0.753 . . . . 0.0 109.473 177.529 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 82.2 m-20 -129.41 109.08 10.78 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 114.621 -1.172 . . . . 0.0 110.116 179.256 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 10.2 t -94.16 -15.64 24.45 Favored 'General case' 0 C--N 1.324 -0.529 0 C-N-CA 120.645 -0.422 . . . . 0.0 111.864 -179.149 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 28.6 m120 -60.81 -39.67 89.81 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.116 0.484 . . . . 0.0 109.831 -179.598 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 95.0 mt-10 -124.22 150.66 45.02 Favored 'General case' 0 CA--C 1.507 -0.699 0 N-CA-C 108.581 -0.896 . . . . 0.0 108.581 179.189 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 49.4 mmtm -89.03 137.82 31.97 Favored 'General case' 0 N--CA 1.43 -1.457 0 C-N-CA 118.567 -1.253 . . . . 0.0 108.906 178.122 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . 0.562 ' HB2' ' HD2' ' A' ' 28' ' ' TYR . . . -49.46 179.77 0.01 OUTLIER 'General case' 0 C--N 1.314 -0.964 0 CA-C-N 114.873 -1.058 . . . . 0.0 110.643 -179.949 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . 0.41 ' H ' ' HB2' ' A' ' 41' ' ' LYS . 76.4 p -153.04 170.66 19.91 Favored 'General case' 0 C--N 1.315 -0.929 0 N-CA-C 108.546 -0.909 . . . . 0.0 108.546 178.419 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.725 HD21 ' HB3' ' A' ' 56' ' ' TYR . 87.7 mt -60.84 -43.08 98.77 Favored 'General case' 0 C--N 1.312 -1.047 0 N-CA-C 107.748 -1.204 . . . . 0.0 107.748 179.689 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 74.7 m -63.08 -40.44 97.68 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.488 -0.778 . . . . 0.0 112.298 179.562 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . 0.41 ' HB2' ' H ' ' A' ' 38' ' ' SER . 68.4 mttm -63.55 -48.72 76.34 Favored 'General case' 0 N--CA 1.47 0.567 0 N-CA-C 113.43 0.9 . . . . 0.0 113.43 -177.988 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.513 HD22 ' HB3' ' A' ' 24' ' ' GLN . 92.3 mt -60.98 -35.32 76.49 Favored 'General case' 0 CA--C 1.494 -1.186 0 N-CA-C 107.405 -1.331 . . . . 0.0 107.405 -177.757 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.654 ' CG2' ' HB2' ' A' ' 53' ' ' ALA . 1.7 t -76.25 -31.73 21.47 Favored 'Isoleucine or valine' 0 N--CA 1.419 -2.017 0 CA-C-N 113.997 -1.456 . . . . 0.0 111.302 -178.952 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . 0.562 ' C ' ' H ' ' A' ' 46' ' ' GLY . 75.0 m -62.34 -51.28 68.26 Favored 'General case' 0 N--CA 1.431 -1.402 0 N-CA-C 104.905 -2.258 . . . . 0.0 104.905 177.398 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . 0.414 ' O ' ' N ' ' A' ' 47' ' ' ASN . 69.9 m -51.75 -4.36 0.02 OUTLIER 'General case' 0 CA--C 1.549 0.929 0 CA-C-N 113.23 -1.804 . . . . 0.0 112.151 170.644 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . 0.562 ' H ' ' C ' ' A' ' 44' ' ' SER . . . 28.75 34.64 0.01 OUTLIER Glycine 0 C--N 1.346 1.106 0 C-N-CA 126.034 1.778 . . . . 0.0 113.6 -172.68 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . 0.414 ' N ' ' O ' ' A' ' 45' ' ' SER . 57.0 t-20 -63.85 -44.7 92.38 Favored 'General case' 0 CA--C 1.513 -0.462 0 N-CA-C 106.113 -1.81 . . . . 0.0 106.113 176.152 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 0.644 ' O ' HD12 ' A' ' 48' ' ' ILE . 1.2 pp -117.47 160.8 16.75 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.936 0 CA-C-N 111.329 -2.669 . . . . 0.0 108.649 179.829 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 88.6 p -77.73 170.99 15.64 Favored 'General case' 0 N--CA 1.446 -0.65 0 CA-C-O 121.583 0.706 . . . . 0.0 112.089 -178.401 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.405 ' HA ' HG21 ' A' ' 43' ' ' VAL . 3.9 tm0? -57.24 -50.1 73.94 Favored 'General case' 0 N--CA 1.437 -1.121 0 CA-C-N 115.084 -0.962 . . . . 0.0 110.347 -179.782 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . 0.438 ' O ' ' N ' ' A' ' 55' ' ' SER . 64.1 pttt -61.13 -25.9 67.31 Favored 'General case' 0 CA--C 1.479 -1.779 0 O-C-N 120.836 -1.165 . . . . 0.0 110.09 -178.218 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . 0.415 ' HG2' HG21 ' A' ' 20' ' ' VAL . 3.2 tm0? -64.96 -38.14 89.98 Favored 'General case' 0 N--CA 1.423 -1.806 0 N-CA-C 105.146 -2.168 . . . . 0.0 105.146 176.186 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . 0.654 ' HB2' ' CG2' ' A' ' 43' ' ' VAL . . . -66.07 -49.04 69.02 Favored 'General case' 0 C--N 1.349 0.559 0 C-N-CA 118.09 -1.444 . . . . 0.0 110.786 176.522 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 96.2 m-20 -76.0 -13.97 60.23 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 118.986 -1.085 . . . . 0.0 113.628 -178.782 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . 0.772 ' O ' ' HB3' ' A' ' 58' ' ' ALA . 48.8 m -68.27 -38.77 82.07 Favored 'General case' 0 C--N 1.31 -1.13 0 N-CA-C 109.736 -0.468 . . . . 0.0 109.736 179.162 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' TYR . . . . . 0.725 ' HB3' HD21 ' A' ' 39' ' ' LEU . 1.6 t80 -73.63 -37.22 65.42 Favored 'General case' 0 N--CA 1.465 0.295 0 C-N-CA 117.654 -1.618 . . . . 0.0 108.372 179.603 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -57.96 -30.34 65.93 Favored 'General case' 0 C--O 1.221 -0.439 0 N-CA-C 107.021 -1.474 . . . . 0.0 107.021 175.894 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . 0.772 ' HB3' ' O ' ' A' ' 55' ' ' SER . . . -65.48 -38.79 90.79 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 112.431 -2.168 . . . . 0.0 109.37 176.506 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 83.8 t80 . . . . . 0 C--N 1.344 0.33 0 CA-C-O 121.564 0.697 . . . . 0.0 109.325 176.699 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 2.5 p . . . . . 0 C--O 1.217 -0.608 0 N-CA-C 108.708 -0.849 . . . . 0.0 108.708 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.342 0 C-N-CA 119.455 -0.898 . . . . 0.0 113.42 -176.216 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.236 0.372 0 CA-C-O 122.57 1.176 . . . . 0.0 108.549 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -60.61 -36.09 77.73 Favored 'General case' 0 N--CA 1.443 -0.809 0 CA-C-N 113.48 -1.691 . . . . 0.0 109.838 179.515 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . 0.682 HG21 ' HB2' ' A' ' 55' ' ' SER . 0.3 OUTLIER -53.24 -29.72 16.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 C-N-CA 119.827 -0.749 . . . . 0.0 110.195 -178.119 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . 0.401 HG13 ' HE1' ' A' ' 56' ' ' TYR . 53.1 t -70.03 -44.0 78.73 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 N-CA-C 108.745 -0.835 . . . . 0.0 108.745 177.134 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 29.5 tptp -63.57 -44.38 94.24 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 114.58 -1.191 . . . . 0.0 113.551 -179.389 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.725 HG21 ' HG2' ' A' ' 52' ' ' GLN . 34.0 m -66.99 -43.02 89.38 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.181 0 N-CA-C 112.756 0.65 . . . . 0.0 112.756 -176.993 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . 0.569 HG21 ' HB2' ' A' ' 56' ' ' TYR . 53.2 t -62.46 -47.2 94.14 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 C-N-CA 118.82 -1.152 . . . . 0.0 110.999 -179.293 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 79.7 mm-40 -66.02 -39.85 90.56 Favored 'General case' 0 C--N 1.332 -0.192 0 N-CA-C 112.091 0.404 . . . . 0.0 112.091 -179.935 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 48.4 t -63.93 -48.35 76.9 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-O 121.95 0.881 . . . . 0.0 108.887 178.553 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . 0.45 ' HG3' HD22 ' A' ' 42' ' ' LEU . 72.0 tp60 -61.87 -39.28 91.35 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 113.962 -1.472 . . . . 0.0 109.78 179.653 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.843 ' CB ' HG11 ' A' ' 70' ' ' VAL . . . -57.78 -49.98 74.79 Favored 'General case' 0 N--CA 1.447 -0.61 0 N-CA-C 108.277 -1.009 . . . . 0.0 108.277 -178.133 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 88.8 tt0 -65.35 -39.25 92.12 Favored 'General case' 0 CA--C 1.51 -0.565 0 CA-C-N 115.903 -0.59 . . . . 0.0 111.359 179.687 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 61.8 tp -61.39 -42.19 98.32 Favored 'General case' 0 N--CA 1.447 -0.588 0 C-N-CA 119.332 -0.947 . . . . 0.0 108.778 -179.789 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . 0.448 ' HB3' ' HB2' ' A' ' 37' ' ' ALA . 89.8 t80 -60.99 -43.7 98.47 Favored 'General case' 0 N--CA 1.44 -0.946 0 N-CA-C 107.043 -1.466 . . . . 0.0 107.043 178.47 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -61.18 -31.21 70.96 Favored 'General case' 0 N--CA 1.446 -0.649 0 N-CA-C 109.875 -0.417 . . . . 0.0 109.875 178.618 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 67.0 tp -64.63 -48.72 73.81 Favored 'General case' 0 N--CA 1.44 -0.963 0 N-CA-C 106.302 -1.74 . . . . 0.0 106.302 176.91 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 64.5 tttp -51.58 -50.77 59.5 Favored 'General case' 0 CA--C 1.52 -0.185 0 CA-C-N 115.046 -0.979 . . . . 0.0 109.263 177.396 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 98.6 m-20 -129.78 98.96 4.96 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 114.499 -1.228 . . . . 0.0 110.055 179.444 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 12.7 t -76.9 -14.74 59.84 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 112.258 0.466 . . . . 0.0 112.258 -178.926 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 98.9 m-20 -61.3 -43.09 99.46 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 120.559 -0.456 . . . . 0.0 111.836 -178.175 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 99.2 mt-10 -108.1 -173.59 2.32 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.685 0.279 . . . . 0.0 111.112 -178.574 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 14.4 mptt -121.03 120.82 36.5 Favored 'General case' 0 N--CA 1.444 -0.752 0 N-CA-C 107.575 -1.268 . . . . 0.0 107.575 177.332 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . 0.448 ' HB2' ' HB3' ' A' ' 28' ' ' TYR . . . -54.9 149.8 11.0 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-O 121.073 0.464 . . . . 0.0 111.42 -177.729 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . 0.637 ' HB3' ' HB3' ' A' ' 71' ' ' ALA . 89.1 p -137.03 159.18 42.64 Favored 'General case' 0 N--CA 1.444 -0.763 0 CA-C-N 115.079 -0.964 . . . . 0.0 109.766 -179.645 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.543 ' CD2' ' HB1' ' A' ' 53' ' ' ALA . 2.0 tt -52.3 -48.32 65.43 Favored 'General case' 0 C--N 1.311 -1.082 0 CA-C-N 115.248 -0.887 . . . . 0.0 110.296 -178.38 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 47.9 t -62.54 -42.92 99.84 Favored 'General case' 0 C--N 1.313 -0.981 0 CA-C-N 115.243 -0.89 . . . . 0.0 110.61 179.456 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 29.1 mtpp -65.52 -49.91 67.21 Favored 'General case' 0 CA--C 1.513 -0.473 0 N-CA-C 114.052 1.13 . . . . 0.0 114.052 -177.777 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.521 HD11 ' HA ' ' A' ' 25' ' ' ALA . 98.0 mt -61.1 -40.03 92.2 Favored 'General case' 0 CA--C 1.485 -1.549 0 CA-C-O 122.499 1.142 . . . . 0.0 108.08 -176.298 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -72.27 -45.37 61.54 Favored 'Isoleucine or valine' 0 N--CA 1.402 -2.862 0 CA-C-N 112.302 -2.226 . . . . 0.0 111.038 -172.48 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . 0.531 ' C ' ' H ' ' A' ' 46' ' ' GLY . 46.7 t -61.25 -47.83 84.22 Favored 'General case' 0 N--CA 1.419 -2.023 0 C-N-CA 116.101 -2.239 . . . . 0.0 105.993 177.574 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . 0.416 ' O ' ' N ' ' A' ' 47' ' ' ASN . 33.4 t -49.91 6.75 0.0 OUTLIER 'General case' 0 N--CA 1.479 1.023 0 CA-C-N 113.844 -1.526 . . . . 0.0 114.47 173.148 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . 0.531 ' H ' ' C ' ' A' ' 44' ' ' SER . . . 28.83 37.4 0.01 OUTLIER Glycine 0 C--N 1.346 1.136 0 C-N-CA 124.479 1.037 . . . . 0.0 113.428 -173.437 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . 0.416 ' N ' ' O ' ' A' ' 45' ' ' SER . 21.6 m120 -66.72 -38.78 87.39 Favored 'General case' 0 CA--C 1.512 -0.493 0 N-CA-C 106.724 -1.584 . . . . 0.0 106.724 173.339 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 0.416 HG23 ' HG2' ' A' ' 24' ' ' GLN . 11.2 pt -137.09 -166.5 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.44 -0.967 0 CA-C-N 112.259 -2.246 . . . . 0.0 107.251 179.302 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 84.8 p -127.99 148.73 50.54 Favored 'General case' 0 C--N 1.321 -0.631 0 C-N-CA 119.986 -0.686 . . . . 0.0 110.639 178.938 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.734 ' HA ' ' HB3' ' A' ' 53' ' ' ALA . 9.3 mt-30 -54.11 0.47 0.02 OUTLIER 'General case' 0 C--O 1.214 -0.768 0 N-CA-C 114.577 1.325 . . . . 0.0 114.577 -177.133 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . 0.413 ' CG ' ' N ' ' A' ' 52' ' ' GLN . 62.8 pttt -77.06 -41.74 41.13 Favored 'General case' 0 C--N 1.313 -1.008 0 N-CA-C 103.679 -2.712 . . . . 0.0 103.679 175.934 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . 0.725 ' HG2' HG21 ' A' ' 20' ' ' VAL . 11.3 mt-30 -71.2 -53.43 14.44 Favored 'General case' 0 N--CA 1.423 -1.823 0 CA-C-N 111.891 -2.413 . . . . 0.0 107.829 176.312 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . 0.734 ' HB3' ' HA ' ' A' ' 50' ' ' GLN . . . -62.66 -40.73 97.99 Favored 'General case' 0 C--O 1.216 -0.678 0 N-CA-C 112.962 0.727 . . . . 0.0 112.962 -177.088 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -62.54 -39.53 93.92 Favored 'General case' 0 C--N 1.311 -1.106 0 C-N-CA 118.709 -1.197 . . . . 0.0 113.319 -178.651 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . 0.682 ' HB2' HG21 ' A' ' 17' ' ' VAL . 75.8 m -65.44 -42.04 92.81 Favored 'General case' 0 C--N 1.316 -0.888 0 C-N-CA 118.987 -1.085 . . . . 0.0 110.555 179.575 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' TYR . . . . . 0.569 ' HB2' HG21 ' A' ' 21' ' ' VAL . 3.1 t80 -72.65 -30.41 64.26 Favored 'General case' 0 C--N 1.334 -0.102 0 C-N-CA 118.988 -1.085 . . . . 0.0 109.405 -179.058 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -61.21 -37.24 82.3 Favored 'General case' 0 CA--C 1.501 -0.925 0 N-CA-C 108.186 -1.042 . . . . 0.0 108.186 177.59 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -65.86 -20.27 66.17 Favored 'General case' 0 N--CA 1.434 -1.24 0 CA-C-N 114.558 -1.201 . . . . 0.0 109.714 178.463 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 88.4 t80 . . . . . 0 CA--C 1.531 0.22 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 176.083 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.843 HG11 ' CB ' ' A' ' 25' ' ' ALA . 13.4 m . . . . . 0 N--CA 1.469 0.517 0 CA-C-O 119.914 -0.089 . . . . 0.0 111.212 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . 0.637 ' HB3' ' HB3' ' A' ' 38' ' ' SER . . . . . . . . 0 N--CA 1.437 -1.088 0 C-N-CA 119.108 -1.037 . . . . 0.0 112.444 -176.438 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.453 -0.28 0 CA-C-O 122.044 0.926 . . . . 0.0 108.744 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -60.32 -37.3 80.17 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-N 114.32 -1.309 . . . . 0.0 110.036 179.894 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . 0.856 HG21 ' HB2' ' A' ' 55' ' ' SER . 0.8 OUTLIER -54.09 -31.75 21.99 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 C-N-CA 119.296 -0.962 . . . . 0.0 109.599 -178.275 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 66.1 t -64.11 -46.88 92.42 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 N-CA-C 107.699 -1.222 . . . . 0.0 107.699 177.641 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 41.0 ttmt -60.37 -44.39 95.64 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-N 114.064 -1.426 . . . . 0.0 113.482 -177.997 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.613 HG21 ' CG ' ' A' ' 52' ' ' GLN . 28.5 m -68.14 -49.7 65.16 Favored 'Isoleucine or valine' 0 N--CA 1.46 0.055 0 CA-C-N 118.833 0.742 . . . . 0.0 111.827 -178.59 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . 0.682 HG21 ' HB2' ' A' ' 56' ' ' TYR . 54.0 t -61.23 -47.78 91.94 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.851 0 C-N-CA 119.846 -0.742 . . . . 0.0 111.529 -177.954 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -68.46 -29.83 68.56 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 112.605 0.595 . . . . 0.0 112.605 -179.247 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 70.9 m -73.45 -50.79 19.82 Favored 'General case' 0 N--CA 1.464 0.249 0 C-N-CA 119.771 -0.771 . . . . 0.0 109.351 177.732 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 99.8 mm-40 -65.04 -37.7 88.43 Favored 'General case' 0 C--O 1.217 -0.649 0 CA-C-N 114.648 -1.16 . . . . 0.0 109.595 179.953 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.7 ' HB1' ' HB ' ' A' ' 70' ' ' VAL . . . -55.37 -44.95 76.52 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 108.126 -1.064 . . . . 0.0 108.126 -177.872 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 88.9 tt0 -66.61 -38.45 87.0 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.451 -0.795 . . . . 0.0 110.803 178.364 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 66.5 tp -63.75 -45.82 88.14 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.17 -0.923 . . . . 0.0 109.937 179.392 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . 0.582 ' CD2' ' HB2' ' A' ' 37' ' ' ALA . 38.8 t80 -65.94 -40.05 91.01 Favored 'General case' 0 N--CA 1.441 -0.917 0 N-CA-C 107.261 -1.385 . . . . 0.0 107.261 -178.919 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 95.6 mt-10 -72.91 -10.85 60.25 Favored 'General case' 0 N--CA 1.441 -0.884 0 CA-C-N 115.083 -0.962 . . . . 0.0 110.287 177.432 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.404 ' HA ' HD12 ' A' ' 30' ' ' LEU . 62.7 tp -69.15 -48.22 62.92 Favored 'General case' 0 N--CA 1.437 -1.103 0 N-CA-C 104.25 -2.5 . . . . 0.0 104.25 174.843 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 64.9 tttp -51.5 -48.44 62.91 Favored 'General case' 0 CA--C 1.509 -0.629 0 CA-C-N 113.519 -1.673 . . . . 0.0 108.164 176.174 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 98.7 m-20 -128.6 94.56 3.9 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-N 114.492 -1.231 . . . . 0.0 110.738 -179.969 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 68.8 p -83.51 -15.37 49.62 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 120.882 -0.327 . . . . 0.0 111.429 -179.308 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 98.5 m-20 -95.01 4.03 54.24 Favored 'General case' 0 C--N 1.33 -0.248 0 C-N-CA 120.83 -0.348 . . . . 0.0 110.746 179.499 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 94.1 mt-10 -134.33 157.89 45.21 Favored 'General case' 0 CA--C 1.509 -0.599 0 N-CA-C 109.329 -0.619 . . . . 0.0 109.329 179.925 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 14.7 mptt -100.09 137.82 38.0 Favored 'General case' 0 N--CA 1.437 -1.104 0 N-CA-C 106.859 -1.534 . . . . 0.0 106.859 176.129 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . 0.582 ' HB2' ' CD2' ' A' ' 28' ' ' TYR . . . -85.98 -156.06 0.27 Allowed 'General case' 0 C--N 1.316 -0.85 0 N-CA-C 107.724 -1.213 . . . . 0.0 107.724 177.73 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . 0.465 ' H ' ' HB2' ' A' ' 41' ' ' LYS . 79.0 p -160.91 168.92 23.66 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 175.96 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.554 ' HB3' ' HB1' ' A' ' 53' ' ' ALA . 72.7 mt -59.88 -46.8 88.18 Favored 'General case' 0 C--N 1.316 -0.885 0 C-N-CA 119.374 -0.93 . . . . 0.0 109.541 179.727 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 91.9 p -60.38 -34.42 73.87 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 120.431 -0.507 . . . . 0.0 109.682 179.858 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . 0.465 ' HB2' ' H ' ' A' ' 38' ' ' SER . 98.0 mttt -69.33 -36.77 77.26 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-O 121.078 0.465 . . . . 0.0 111.014 178.274 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.445 HD23 ' HA ' ' A' ' 42' ' ' LEU . 87.2 mt -69.25 -35.86 76.55 Favored 'General case' 0 CA--C 1.496 -1.102 0 CA-C-N 115.47 -0.787 . . . . 0.0 109.267 179.896 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.778 HG21 ' HA ' ' A' ' 50' ' ' GLN . 0.3 OUTLIER -80.27 -34.96 15.18 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.713 0 C-N-CA 119.264 -0.974 . . . . 0.0 110.908 -176.641 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . 0.548 ' C ' ' H ' ' A' ' 46' ' ' GLY . 47.9 t -59.24 -51.15 71.22 Favored 'General case' 0 N--CA 1.431 -1.39 0 N-CA-C 104.635 -2.357 . . . . 0.0 104.635 179.691 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . 0.433 ' O ' ' N ' ' A' ' 47' ' ' ASN . 24.7 p -54.41 12.65 0.0 OUTLIER 'General case' 0 CA--C 1.558 1.264 0 CA-C-N 113.926 -1.488 . . . . 0.0 113.677 170.429 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . 0.548 ' H ' ' C ' ' A' ' 44' ' ' SER . . . 28.59 33.78 0.01 OUTLIER Glycine 0 C--N 1.347 1.171 0 C-N-CA 125.201 1.382 . . . . 0.0 114.486 -173.161 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . 0.433 ' N ' ' O ' ' A' ' 45' ' ' SER . 19.1 m120 -66.95 -40.82 87.62 Favored 'General case' 0 CA--C 1.52 -0.186 0 CA-C-O 122.329 1.062 . . . . 0.0 109.138 174.519 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 0.594 ' O ' HG23 ' A' ' 43' ' ' VAL . 23.4 pt -137.37 164.76 28.63 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-N 113.098 -1.865 . . . . 0.0 111.716 -177.447 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 67.6 m -76.48 155.75 33.57 Favored 'General case' 0 N--CA 1.439 -0.983 0 N-CA-C 107.524 -1.287 . . . . 0.0 107.524 178.192 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.778 ' HA ' HG21 ' A' ' 43' ' ' VAL . 71.5 tp60 -56.88 -46.4 81.91 Favored 'General case' 0 C--O 1.202 -1.401 0 C-N-CA 119.697 -0.801 . . . . 0.0 109.801 -179.163 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 21.9 pttp -64.11 -30.93 71.96 Favored 'General case' 0 CA--C 1.501 -0.939 0 CA-C-N 119.089 0.858 . . . . 0.0 110.709 -179.248 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . 0.613 ' CG ' HG21 ' A' ' 20' ' ' VAL . 33.5 tt0 -66.5 -38.14 86.59 Favored 'General case' 0 N--CA 1.421 -1.875 0 N-CA-C 103.639 -2.726 . . . . 0.0 103.639 177.437 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . 0.603 ' HB3' ' O ' ' A' ' 50' ' ' GLN . . . -65.96 -51.84 54.91 Favored 'General case' 0 N--CA 1.443 -0.777 0 CA-C-N 114.413 -1.267 . . . . 0.0 110.315 177.822 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 98.2 m-20 -58.11 -47.0 84.59 Favored 'General case' 0 CA--C 1.504 -0.805 0 C-N-CA 120.291 -0.563 . . . . 0.0 112.119 -177.172 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . 0.856 ' HB2' HG21 ' A' ' 17' ' ' VAL . 74.2 m -53.8 -36.06 62.06 Favored 'General case' 0 N--CA 1.436 -1.172 0 C-N-CA 119.312 -0.955 . . . . 0.0 110.724 -177.282 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' TYR . . . . . 0.682 ' HB2' HG21 ' A' ' 21' ' ' VAL . 8.3 t80 -70.16 -41.51 73.73 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 116.996 -1.882 . . . . 0.0 109.052 176.984 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -47.92 -44.39 29.81 Favored 'General case' 0 CA--C 1.498 -1.042 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.22 -175.912 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -59.64 -51.28 70.5 Favored 'General case' 0 N--CA 1.434 -1.234 0 N-CA-C 106.959 -1.497 . . . . 0.0 106.959 179.432 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 91.9 t80 . . . . . 0 N--CA 1.466 0.356 0 N-CA-C 109.583 -0.525 . . . . 0.0 109.583 -177.236 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.7 ' HB ' ' HB1' ' A' ' 25' ' ' ALA . 7.4 p . . . . . 0 N--CA 1.446 -0.642 0 CA-C-O 121.404 0.621 . . . . 0.0 111.68 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.234 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.532 -178.446 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.235 0.337 0 CA-C-O 122.047 0.927 . . . . 0.0 110.97 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -59.93 -37.18 78.76 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 114.305 -1.316 . . . . 0.0 110.28 -178.419 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . 0.606 HG21 ' HB2' ' A' ' 55' ' ' SER . 2.6 p -53.28 -35.64 24.46 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 C-N-CA 119.34 -0.944 . . . . 0.0 109.919 -178.076 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 61.4 t -63.63 -48.48 86.57 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-O 121.635 0.731 . . . . 0.0 109.207 178.936 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -61.93 -43.77 98.16 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 114.637 -1.165 . . . . 0.0 113.587 -178.7 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.673 HG21 ' HG2' ' A' ' 52' ' ' GLN . 28.5 m -71.95 -54.11 17.87 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.186 0 C-N-CA 119.949 -0.7 . . . . 0.0 112.621 -178.321 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . 0.596 HG21 ' HB2' ' A' ' 56' ' ' TYR . 53.2 t -61.1 -45.32 98.8 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.666 0 C-N-CA 119.398 -0.921 . . . . 0.0 111.975 -177.38 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -61.72 -51.64 67.57 Favored 'General case' 0 C--N 1.331 -0.207 0 C-N-CA 118.557 -1.257 . . . . 0.0 109.973 -179.892 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 48.4 t -58.54 -48.73 79.9 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 120.26 -0.576 . . . . 0.0 110.801 -176.771 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 28.3 mm100 -63.97 -40.38 96.26 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.647 0.737 . . . . 0.0 109.186 179.536 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.483 ' HB1' ' HB ' ' A' ' 70' ' ' VAL . . . -57.47 -42.76 83.24 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 114.608 -1.178 . . . . 0.0 110.484 -177.133 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 54.0 tp10 -65.24 -39.12 92.28 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.935 0.874 . . . . 0.0 109.18 178.394 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 53.6 tp -62.2 -44.22 97.08 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 114.316 -1.311 . . . . 0.0 109.622 -179.844 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 55.3 t80 -62.26 -38.85 90.87 Favored 'General case' 0 CA--C 1.504 -0.81 0 N-CA-C 107.475 -1.306 . . . . 0.0 107.475 -179.142 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . 0.44 ' O ' ' N ' ' A' ' 33' ' ' THR . 96.4 mt-10 -59.43 -43.79 93.01 Favored 'General case' 0 N--CA 1.44 -0.926 0 N-CA-C 106.72 -1.585 . . . . 0.0 106.72 178.694 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 64.3 tp -62.46 -43.58 98.47 Favored 'General case' 0 N--CA 1.443 -0.805 0 C-N-CA 118.513 -1.275 . . . . 0.0 108.743 178.387 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -49.03 -49.11 42.75 Favored 'General case' 0 CA--C 1.519 -0.224 0 CA-C-N 115.345 -0.843 . . . . 0.0 110.513 179.759 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 32.5 m120 -109.44 -66.11 1.09 Allowed 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 120.066 -0.654 . . . . 0.0 112.396 -179.356 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.44 ' N ' ' O ' ' A' ' 29' ' ' GLU . 0.2 OUTLIER 79.28 -34.75 0.15 Allowed 'General case' 0 N--CA 1.471 0.582 0 O-C-N 123.653 0.595 . . . . 0.0 112.53 179.067 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 99.2 m-20 -61.07 -39.28 89.3 Favored 'General case' 0 C--N 1.332 -0.162 0 N-CA-C 108.636 -0.876 . . . . 0.0 108.636 179.41 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 9.6 mm-40 -117.84 153.94 32.65 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 114.748 -1.115 . . . . 0.0 108.122 178.579 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -87.61 129.76 35.0 Favored 'General case' 0 N--CA 1.435 -1.215 0 C-N-CA 118.57 -1.252 . . . . 0.0 109.802 179.962 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . 0.666 ' C ' HG23 ' A' ' 70' ' ' VAL . . . -45.59 143.02 2.08 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 114.02 -1.446 . . . . 0.0 109.083 -178.522 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . 0.556 ' CA ' HG23 ' A' ' 70' ' ' VAL . 14.2 m -122.92 147.91 46.06 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 107.198 -1.408 . . . . 0.0 107.198 179.818 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.675 HD21 ' HB1' ' A' ' 53' ' ' ALA . 7.7 tt -54.72 -50.24 68.82 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 108.448 -0.945 . . . . 0.0 108.448 -177.708 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 74.1 m -59.42 -38.66 81.2 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 179.586 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . 0.425 ' HB2' ' H ' ' A' ' 38' ' ' SER . 61.7 mtpt -65.85 -38.24 88.33 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 120.781 0.324 . . . . 0.0 111.864 178.714 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.575 ' CD1' HG21 ' A' ' 70' ' ' VAL . 88.5 mt -64.51 -38.73 92.02 Favored 'General case' 0 CA--C 1.485 -1.542 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 -178.025 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -81.93 -35.29 13.27 Favored 'Isoleucine or valine' 0 N--CA 1.417 -2.105 0 C-N-CA 118.956 -1.098 . . . . 0.0 110.92 -176.762 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . 0.585 ' C ' ' H ' ' A' ' 46' ' ' GLY . 47.9 t -60.85 -50.87 71.69 Favored 'General case' 0 N--CA 1.43 -1.442 0 N-CA-C 105.353 -2.091 . . . . 0.0 105.353 178.583 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . 0.452 ' O ' ' N ' ' A' ' 47' ' ' ASN . 89.6 p -54.08 9.5 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.125 0 CA-C-N 113.727 -1.579 . . . . 0.0 113.055 171.579 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . 0.585 ' H ' ' C ' ' A' ' 44' ' ' SER . . . 29.04 30.45 0.01 OUTLIER Glycine 0 C--N 1.343 0.964 0 C-N-CA 125.531 1.539 . . . . 0.0 114.613 -172.702 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . 0.452 ' N ' ' O ' ' A' ' 45' ' ' SER . 56.1 t30 -66.16 -42.66 88.67 Favored 'General case' 0 CA--C 1.517 -0.29 0 N-CA-C 104.874 -2.269 . . . . 0.0 104.874 175.193 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 36.2 pt -129.14 166.83 25.75 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.766 0 CA-C-N 111.619 -2.537 . . . . 0.0 107.902 177.922 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . 0.537 ' C ' ' H ' ' A' ' 51' ' ' LYS . 67.6 m -119.5 156.5 30.14 Favored 'General case' 0 C--N 1.32 -0.702 0 C-N-CA 120.534 -0.466 . . . . 0.0 110.815 -179.151 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.838 ' HA ' ' HB3' ' A' ' 53' ' ' ALA . 12.6 tp60 -50.84 6.14 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.348 0 N-CA-C 114.743 1.386 . . . . 0.0 114.743 -179.536 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . 0.537 ' H ' ' C ' ' A' ' 49' ' ' SER . 71.9 mmtt -83.43 -52.99 6.04 Favored 'General case' 0 C--N 1.309 -1.183 0 N-CA-C 104.757 -2.312 . . . . 0.0 104.757 176.147 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . 0.673 ' HG2' HG21 ' A' ' 20' ' ' VAL . 4.1 mt-30 -85.28 -29.22 24.76 Favored 'General case' 0 N--CA 1.431 -1.425 0 CA-C-N 110.989 -2.823 . . . . 0.0 110.333 178.105 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . 0.838 ' HB3' ' HA ' ' A' ' 50' ' ' GLN . . . -65.17 -49.99 67.66 Favored 'General case' 0 N--CA 1.443 -0.801 0 C-N-CA 118.304 -1.358 . . . . 0.0 109.606 179.8 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 99.2 m-20 -60.9 -51.84 67.58 Favored 'General case' 0 CA--C 1.498 -1.038 0 C-N-CA 117.932 -1.507 . . . . 0.0 112.13 -178.152 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . 0.606 ' HB2' HG21 ' A' ' 17' ' ' VAL . 67.2 m -56.67 -38.27 71.99 Favored 'General case' 0 N--CA 1.434 -1.269 0 C-N-CA 118.534 -1.267 . . . . 0.0 112.122 -175.62 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' TYR . . . . . 0.596 ' HB2' HG21 ' A' ' 21' ' ' VAL . 22.9 t80 -72.21 -39.5 68.51 Favored 'General case' 0 CA--C 1.516 -0.355 0 C-N-CA 117.488 -1.685 . . . . 0.0 109.627 178.806 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 64.8 tttp -50.71 -40.27 53.66 Favored 'General case' 0 CA--C 1.493 -1.221 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.453 -176.348 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -59.13 -50.86 72.43 Favored 'General case' 0 N--CA 1.431 -1.391 0 N-CA-C 106.459 -1.682 . . . . 0.0 106.459 178.783 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 90.1 t80 . . . . . 0 N--CA 1.473 0.703 0 C-N-CA 120.02 -0.672 . . . . 0.0 110.14 -176.345 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.666 HG23 ' C ' ' A' ' 37' ' ' ALA . 0.1 OUTLIER . . . . . 0 CA--C 1.542 0.662 0 N-CA-C 107.269 -1.382 . . . . 0.0 107.269 . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.22 -0.463 0 O-C-N 121.014 -1.053 . . . . 0.0 113.327 -175.777 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.513 -0.463 0 CA-C-O 121.369 0.604 . . . . 0.0 111.517 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -61.92 -39.42 91.97 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 115.481 -0.782 . . . . 0.0 110.826 -178.87 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . 0.533 ' HA ' HG22 ' A' ' 20' ' ' VAL . 14.1 p -67.8 -28.96 43.42 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 C-N-CA 118.98 -1.088 . . . . 0.0 111.113 -179.046 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 55.8 t -60.55 -44.61 97.0 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.821 0 N-CA-C 108.955 -0.758 . . . . 0.0 108.955 -179.236 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.1 tmmt? -65.44 -36.01 82.64 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 114.99 -1.005 . . . . 0.0 113.631 -179.685 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.533 HG22 ' HA ' ' A' ' 17' ' ' VAL . 33.0 m -82.96 -49.9 16.3 Favored 'Isoleucine or valine' 0 C--N 1.342 0.263 0 O-C-N 121.449 -0.782 . . . . 0.0 113.086 -178.527 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . 0.509 ' N ' HG23 ' A' ' 20' ' ' VAL . 59.3 t -63.1 -44.75 99.65 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 C-N-CA 120.309 -0.556 . . . . 0.0 111.258 -178.861 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 96.3 mt-10 -60.72 -42.48 97.35 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 119.884 -0.727 . . . . 0.0 111.467 -178.988 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 74.6 m -64.9 -42.74 94.49 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 119.542 -0.863 . . . . 0.0 110.816 179.349 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 97.9 mm-40 -68.97 -40.19 79.0 Favored 'General case' 0 CA--C 1.53 0.177 0 C-N-CA 120.467 -0.493 . . . . 0.0 110.757 -178.948 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.431 ' O ' ' HG3' ' A' ' 29' ' ' GLU . . . -58.04 -41.49 83.39 Favored 'General case' 0 CA--C 1.502 -0.889 0 N-CA-C 108.61 -0.885 . . . . 0.0 108.61 -177.9 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 89.0 tt0 -59.79 -43.48 94.38 Favored 'General case' 0 C--N 1.31 -1.144 0 CA-C-N 114.084 -1.416 . . . . 0.0 108.354 179.088 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 60.2 tp -68.41 -39.15 81.72 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 113.162 0.801 . . . . 0.0 113.162 -179.651 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . 0.515 ' HD2' ' HB2' ' A' ' 37' ' ' ALA . 94.1 t80 -63.51 -49.36 73.84 Favored 'General case' 0 CA--C 1.494 -1.21 0 N-CA-C 108.465 -0.939 . . . . 0.0 108.465 -179.561 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . 0.431 ' HG3' ' O ' ' A' ' 25' ' ' ALA . 2.6 pp20? -69.18 -23.21 63.9 Favored 'General case' 0 N--CA 1.428 -1.558 0 C-N-CA 118.997 -1.081 . . . . 0.0 109.022 178.235 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 64.3 tp -63.9 -49.05 74.22 Favored 'General case' 0 N--CA 1.44 -0.948 0 N-CA-C 105.828 -1.916 . . . . 0.0 105.828 177.803 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -51.01 -49.21 60.89 Favored 'General case' 0 CA--C 1.519 -0.239 0 CA-C-N 114.275 -1.33 . . . . 0.0 108.805 176.159 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 98.7 m-20 -127.24 106.96 9.59 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-N 114.828 -1.078 . . . . 0.0 109.967 179.507 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 76.6 p -90.3 -2.44 58.01 Favored 'General case' 0 C--N 1.324 -0.524 0 C-N-CA 120.287 -0.565 . . . . 0.0 112.307 -177.948 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 66.5 t30 -60.26 -38.22 82.84 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 108.451 -0.944 . . . . 0.0 108.451 179.385 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 21.0 pt-20 -139.88 157.56 45.51 Favored 'General case' 0 CA--C 1.506 -0.742 0 CA-C-N 114.664 -1.153 . . . . 0.0 111.259 179.053 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 30.4 mtpp -89.36 145.37 25.39 Favored 'General case' 0 N--CA 1.425 -1.696 0 C-N-CA 119.625 -0.83 . . . . 0.0 108.86 177.459 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . 0.515 ' HB2' ' HD2' ' A' ' 28' ' ' TYR . . . -57.41 -178.97 0.04 OUTLIER 'General case' 0 C--N 1.297 -1.682 0 CA-C-N 114.202 -1.363 . . . . 0.0 109.157 179.354 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . 0.442 ' OG ' ' HG3' ' A' ' 41' ' ' LYS . 59.7 p -154.41 168.31 27.08 Favored 'General case' 0 C--N 1.315 -0.892 0 C-N-CA 120.048 -0.661 . . . . 0.0 109.464 178.018 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.432 HD11 ' HB2' ' A' ' 57' ' ' LYS . 6.3 tt -57.62 -44.62 85.66 Favored 'General case' 0 C--N 1.31 -1.136 0 N-CA-C 107.658 -1.238 . . . . 0.0 107.658 -179.361 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 94.0 p -70.81 -37.08 73.22 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 115.187 -0.915 . . . . 0.0 113.033 178.616 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . 0.442 ' HG3' ' OG ' ' A' ' 38' ' ' SER . 97.9 mttt -69.69 -50.92 39.21 Favored 'General case' 0 N--CA 1.471 0.582 0 N-CA-C 113.278 0.844 . . . . 0.0 113.278 -177.914 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.604 ' HB3' HG12 ' A' ' 48' ' ' ILE . 89.9 mt -61.73 -38.05 86.5 Favored 'General case' 0 CA--C 1.482 -1.635 0 CA-C-O 122.225 1.012 . . . . 0.0 108.665 -176.129 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.41 HG21 ' CB ' ' A' ' 53' ' ' ALA . 0.4 OUTLIER -81.44 -26.55 10.19 Favored 'Isoleucine or valine' 0 N--CA 1.404 -2.757 0 CA-C-N 113.316 -1.765 . . . . 0.0 112.285 -177.056 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . 0.583 ' C ' ' H ' ' A' ' 46' ' ' GLY . 48.0 t -65.81 -50.42 64.71 Favored 'General case' 0 N--CA 1.422 -1.874 0 N-CA-C 102.963 -2.977 . . . . 0.0 102.963 175.294 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . 0.496 ' O ' ' N ' ' A' ' 47' ' ' ASN . 60.3 m -51.97 2.53 0.01 OUTLIER 'General case' 0 CA--C 1.547 0.846 0 CA-C-N 111.443 -2.617 . . . . 0.0 113.214 170.902 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . 0.583 ' H ' ' C ' ' A' ' 44' ' ' SER . . . 28.89 21.21 0.0 OUTLIER Glycine 0 CA--C 1.536 1.346 0 C-N-CA 126.478 1.989 . . . . 0.0 116.389 -172.771 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . 0.496 ' N ' ' O ' ' A' ' 45' ' ' SER . 50.5 t30 -59.8 -55.25 36.52 Favored 'General case' 0 CA--C 1.507 -0.693 0 N-CA-C 104.602 -2.37 . . . . 0.0 104.602 177.74 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 0.604 HG12 ' HB3' ' A' ' 42' ' ' LEU . 29.5 pt -92.95 146.72 6.04 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.242 0 N-CA-C 104.1 -2.555 . . . . 0.0 104.1 174.47 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . 0.401 ' O ' ' N ' ' A' ' 52' ' ' GLN . 68.2 m -98.82 163.22 12.71 Favored 'General case' 0 C--N 1.311 -1.091 0 C-N-CA 119.309 -0.956 . . . . 0.0 110.903 -178.177 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 63.3 tp60 -50.22 -15.24 0.21 Allowed 'General case' 0 C--N 1.308 -1.21 0 CA-C-N 114.569 -1.196 . . . . 0.0 112.041 -177.479 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 26.0 pttm -81.62 -36.17 29.21 Favored 'General case' 0 CA--C 1.516 -0.351 0 N-CA-C 107.201 -1.407 . . . . 0.0 107.201 177.618 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . 0.521 ' HG2' HG21 ' A' ' 20' ' ' VAL . 16.2 mt-30 -79.14 -23.34 44.06 Favored 'General case' 0 N--CA 1.439 -0.979 0 CA-C-N 113.047 -1.888 . . . . 0.0 109.603 176.559 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . 0.41 ' CB ' HG21 ' A' ' 43' ' ' VAL . . . -84.7 -44.67 13.17 Favored 'General case' 0 C--O 1.219 -0.529 0 C-N-CA 118.785 -1.166 . . . . 0.0 108.279 175.151 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 99.8 m-20 -63.68 -38.99 93.19 Favored 'General case' 0 CA--C 1.506 -0.714 0 CA-C-N 114.966 -1.016 . . . . 0.0 111.265 179.015 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . 0.726 ' O ' ' HB3' ' A' ' 58' ' ' ALA . 67.6 m -65.7 -40.99 92.86 Favored 'General case' 0 N--CA 1.437 -1.085 0 C-N-CA 119.563 -0.855 . . . . 0.0 110.109 178.866 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' TYR . . . . . 0.422 ' HB2' HG21 ' A' ' 21' ' ' VAL . 3.5 t80 -71.48 -40.61 70.12 Favored 'General case' 0 C--N 1.342 0.263 0 C-N-CA 118.333 -1.347 . . . . 0.0 109.916 -179.109 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . 0.432 ' HB2' HD11 ' A' ' 39' ' ' LEU . 88.7 tttt -58.23 -24.1 58.11 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.112 -0.949 . . . . 0.0 108.495 177.806 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . 0.726 ' HB3' ' O ' ' A' ' 55' ' ' SER . . . -66.34 -40.21 89.71 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-N 113.595 -1.639 . . . . 0.0 109.233 175.99 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 91.5 t80 . . . . . 0 N--CA 1.471 0.615 0 CA-C-O 121.304 0.573 . . . . 0.0 111.022 177.178 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 2.9 p . . . . . 0 N--CA 1.465 0.294 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.224 -0.261 0 N-CA-C 114.569 1.322 . . . . 0.0 114.569 -174.892 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 13.9 m120 . . . . . 0 N--CA 1.49 1.548 0 N-CA-C 109.386 -0.598 . . . . 0.0 109.386 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 86.6 mt 57.88 31.57 20.73 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.464 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 12.7 t -148.86 152.99 37.42 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.441 179.884 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -128.37 147.43 50.64 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.703 -179.834 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 64.6 tt0 55.83 99.09 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.922 179.592 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 64.9 pttt -150.58 157.53 43.1 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.379 179.57 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 68.4 t0 -123.79 106.65 10.66 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.31 -179.866 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -149.13 149.85 31.71 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.613 179.769 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 91.3 t -123.73 127.69 74.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.563 179.923 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 96.4 p -154.65 161.45 41.57 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.692 179.856 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 53.7 p-10 -84.36 -178.25 6.87 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.018 179.857 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 12.4 t -148.51 151.76 35.7 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.57 179.867 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -115.97 -130.91 4.73 Favored Glycine 0 CA--C 1.51 -0.221 0 N-CA-C 111.354 -0.699 . . . . 0.0 111.354 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 2.7 m 74.32 -64.45 0.39 Allowed 'General case' 0 CA--C 1.516 -0.354 0 N-CA-C 108.458 -0.942 . . . . 0.0 108.458 -178.31 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -66.15 -41.6 90.18 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 109.19 -0.67 . . . . 0.0 109.19 177.726 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . 0.646 ' O ' HG22 ' A' ' 20' ' ' VAL . . . -63.03 -37.64 88.01 Favored 'General case' 0 CA--C 1.506 -0.719 0 CA-C-N 114.856 -1.065 . . . . 0.0 109.71 178.934 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . 0.677 HG21 ' HB3' ' A' ' 55' ' ' SER . 54.6 t -60.03 -42.95 91.49 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.834 0 CA-C-N 115.162 -0.926 . . . . 0.0 109.969 -179.966 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 67.9 t -65.45 -44.3 94.34 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.104 0 CA-C-N 115.268 -0.878 . . . . 0.0 110.257 -179.444 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 60.7 tptt -64.78 -42.93 94.7 Favored 'General case' 0 CA--C 1.538 0.502 0 N-CA-C 113.638 0.977 . . . . 0.0 113.638 -179.798 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.733 HG21 ' HG2' ' A' ' 52' ' ' GLN . 28.3 m -74.09 -51.53 23.54 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.296 0 N-CA-C 113.822 1.045 . . . . 0.0 113.822 -176.962 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . 0.636 HG21 ' HB2' ' A' ' 56' ' ' TYR . 75.4 t -62.97 -45.22 99.44 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 C-N-CA 120.341 -0.544 . . . . 0.0 111.057 -178.079 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -63.3 -37.85 88.87 Favored 'General case' 0 C--N 1.323 -0.587 0 N-CA-C 113.294 0.85 . . . . 0.0 113.294 -178.829 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 48.0 t -65.35 -49.83 67.9 Favored 'General case' 0 N--CA 1.463 0.212 0 C-N-CA 119.776 -0.77 . . . . 0.0 110.702 179.082 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 99.7 mm-40 -67.45 -38.49 84.58 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.485 179.53 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.436 ' HA ' HD11 ' A' ' 42' ' ' LEU . . . -59.56 -42.45 92.45 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.282 -0.872 . . . . 0.0 109.909 -178.019 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 88.8 tt0 -64.69 -41.51 95.99 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.268 -0.878 . . . . 0.0 110.27 179.278 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 55.9 tp -68.38 -38.0 80.93 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.56 -0.746 . . . . 0.0 112.156 -179.786 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . 0.697 ' HD2' ' HB2' ' A' ' 37' ' ' ALA . 49.2 t80 -67.83 -37.13 81.53 Favored 'General case' 0 CA--C 1.504 -0.812 0 N-CA-C 106.969 -1.493 . . . . 0.0 106.969 179.182 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 91.0 mt-10 -63.51 -37.03 85.75 Favored 'General case' 0 N--CA 1.442 -0.839 0 CA-C-N 115.249 -0.887 . . . . 0.0 108.868 176.525 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 66.5 tp -62.64 -47.81 82.11 Favored 'General case' 0 N--CA 1.438 -1.05 0 N-CA-C 107.06 -1.459 . . . . 0.0 107.06 177.488 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 29.6 tptp -50.48 -50.09 53.54 Favored 'General case' 0 CA--C 1.521 -0.16 0 CA-C-N 115.18 -0.918 . . . . 0.0 109.383 177.66 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 81.7 m-20 -129.26 86.75 2.46 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 114.744 -1.116 . . . . 0.0 110.325 179.571 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 96.3 m -66.36 -39.75 89.34 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 112.323 0.49 . . . . 0.0 112.323 -178.827 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 65.7 t30 -58.35 -39.49 79.68 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.577 -0.283 . . . . 0.0 111.494 -177.862 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -108.63 141.08 41.1 Favored 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 120.598 -0.441 . . . . 0.0 110.073 179.919 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 2.5 mptp? -89.94 121.98 32.54 Favored 'General case' 0 N--CA 1.438 -1.049 0 C-N-CA 119.861 -0.736 . . . . 0.0 109.415 178.839 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . 0.697 ' HB2' ' HD2' ' A' ' 28' ' ' TYR . . . -52.46 -173.36 0.0 OUTLIER 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.614 -179.827 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 80.2 p -160.63 168.55 24.69 Favored 'General case' 0 C--N 1.317 -0.838 0 N-CA-C 109.257 -0.646 . . . . 0.0 109.257 178.343 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.609 HD22 ' HA ' ' A' ' 53' ' ' ALA . 54.1 mt -59.99 -40.19 88.31 Favored 'General case' 0 C--N 1.311 -1.07 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 179.15 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 74.8 m -62.82 -40.33 97.07 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 116.059 -0.518 . . . . 0.0 110.549 178.302 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -72.48 -48.85 37.51 Favored 'General case' 0 N--CA 1.464 0.256 0 N-CA-C 113.382 0.882 . . . . 0.0 113.382 -178.842 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.436 HD11 ' HA ' ' A' ' 25' ' ' ALA . 95.3 mt -62.46 -35.53 79.59 Favored 'General case' 0 CA--C 1.484 -1.56 0 N-CA-C 108.948 -0.76 . . . . 0.0 108.948 -175.601 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.423 HG23 ' O ' ' A' ' 48' ' ' ILE . 0.4 OUTLIER -78.78 -34.04 16.99 Favored 'Isoleucine or valine' 0 N--CA 1.409 -2.484 0 CA-C-N 114.385 -1.279 . . . . 0.0 111.217 -176.101 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . 0.557 ' C ' ' H ' ' A' ' 46' ' ' GLY . 47.9 t -62.84 -49.89 73.11 Favored 'General case' 0 N--CA 1.425 -1.717 0 N-CA-C 104.201 -2.518 . . . . 0.0 104.201 176.363 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . 0.484 ' O ' ' N ' ' A' ' 47' ' ' ASN . 70.5 m -51.62 9.69 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.044 0 CA-C-N 112.253 -2.249 . . . . 0.0 114.053 172.125 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . 0.557 ' H ' ' C ' ' A' ' 44' ' ' SER . . . 29.4 25.28 0.0 OUTLIER Glycine 0 CA--C 1.539 1.588 0 C-N-CA 125.679 1.609 . . . . 0.0 115.711 -172.288 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . 0.484 ' N ' ' O ' ' A' ' 45' ' ' SER . 21.6 m120 -63.04 -41.92 99.61 Favored 'General case' 0 CA--C 1.51 -0.573 0 N-CA-C 106.529 -1.656 . . . . 0.0 106.529 174.306 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.423 ' O ' HG23 ' A' ' 43' ' ' VAL . 17.4 pt -131.16 160.98 41.88 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.157 0 CA-C-N 111.71 -2.496 . . . . 0.0 109.5 178.952 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 69.7 m -108.38 157.1 18.7 Favored 'General case' 0 C--N 1.313 -1.019 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.549 -179.02 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.82 ' HA ' ' HB3' ' A' ' 53' ' ' ALA . 24.1 tp60 -47.18 -6.06 0.01 OUTLIER 'General case' 0 CA--C 1.555 1.161 0 N-CA-C 114.758 1.392 . . . . 0.0 114.758 -178.554 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 21.0 ptmt -84.28 -47.17 11.05 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 105.852 -1.907 . . . . 0.0 105.852 175.564 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . 0.733 ' HG2' HG21 ' A' ' 20' ' ' VAL . 85.3 mt-30 -71.1 -35.22 71.72 Favored 'General case' 0 N--CA 1.439 -0.981 0 CA-C-N 112.659 -2.064 . . . . 0.0 110.167 174.228 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.82 ' HB3' ' HA ' ' A' ' 50' ' ' GLN . . . -72.62 -51.61 18.87 Favored 'General case' 0 C--O 1.221 -0.436 0 CA-C-N 115.14 -0.936 . . . . 0.0 112.654 -177.805 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 96.4 m-20 -77.71 -17.89 57.15 Favored 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 114.356 1.243 . . . . 0.0 114.356 -178.978 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . 0.677 ' HB3' HG21 ' A' ' 17' ' ' VAL . 70.9 m -79.67 -39.4 31.45 Favored 'General case' 0 C--N 1.299 -1.61 0 C-N-CA 119.273 -0.971 . . . . 0.0 110.402 179.125 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . 0.636 ' HB2' HG21 ' A' ' 21' ' ' VAL . 19.5 t80 -70.64 -35.55 72.97 Favored 'General case' 0 CA--C 1.502 -0.9 0 N-CA-C 107.517 -1.29 . . . . 0.0 107.517 178.253 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.479 ' HB2' HD13 ' A' ' 39' ' ' LEU . 64.2 tttm -57.14 -41.58 79.37 Favored 'General case' 0 CA--C 1.488 -1.415 0 CA-C-N 113.19 -1.823 . . . . 0.0 110.416 -178.308 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -80.27 -5.25 55.94 Favored 'General case' 0 N--CA 1.425 -1.683 0 O-C-N 120.662 -1.274 . . . . 0.0 110.175 179.528 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 65.7 t80 -72.38 -42.19 65.51 Favored 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 119.899 -0.721 . . . . 0.0 109.182 175.402 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.414 ' CD2' ' O ' ' A' ' 57' ' ' LYS . 0.3 OUTLIER -71.34 -35.37 71.17 Favored 'General case' 0 C--N 1.351 0.67 0 N-CA-C 108.093 -1.077 . . . . 0.0 108.093 179.988 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -55.03 -36.41 60.86 Favored Glycine 0 CA--C 1.526 0.724 0 CA-C-N 113.921 -1.49 . . . . 0.0 111.789 179.762 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -57.07 -45.06 83.56 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 112.179 0.437 . . . . 0.0 112.179 -177.879 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 94.0 m-70 -97.72 -74.56 0.57 Allowed 'General case' 0 C--N 1.331 -0.217 0 C-N-CA 119.75 -0.78 . . . . 0.0 111.391 -179.506 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 168.76 39.06 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.258 0 O-C-N 123.549 0.531 . . . . 0.0 109.624 -179.794 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 73.95 22.78 77.6 Favored Glycine 0 CA--C 1.523 0.578 0 N-CA-C 110.001 -1.239 . . . . 0.0 110.001 -178.856 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -84.21 -13.35 52.95 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 111.63 0.233 . . . . 0.0 111.63 -178.653 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 74.7 p -113.8 -38.02 4.37 Favored 'General case' 0 N--CA 1.462 0.157 0 C-N-CA 120.101 -0.639 . . . . 0.0 112.234 -179.204 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -37.16 97.0 0.01 OUTLIER 'General case' 0 C--N 1.343 0.301 0 CA-C-O 122.638 1.209 . . . . 0.0 113.305 -175.024 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 92.7 m -54.76 -21.45 11.07 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 112.451 -2.158 . . . . 0.0 109.369 179.285 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.449 HG22 ' O ' ' A' ' 37' ' ' ALA . 7.2 p -129.46 149.21 33.43 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.8 0 N-CA-C 107.897 -1.149 . . . . 0.0 107.897 179.644 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -52.23 88.03 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.481 0 N-CA-C 112.775 0.657 . . . . 0.0 112.775 -176.348 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . 0.42 ' N ' ' O ' ' A' ' 70' ' ' VAL . 30.6 m120 . . . . . 0 C--N 1.348 0.531 0 CA-C-O 118.237 -0.887 . . . . 0.0 112.221 179.396 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 99.2 m-20 . . . . . 0 N--CA 1.49 1.573 0 N-CA-C 109.556 -0.535 . . . . 0.0 109.556 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 64.6 tp -61.31 -44.97 96.31 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.515 -179.973 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . 0.458 ' O ' ' HB2' ' A' ' 8' ' ' ALA . 20.9 p 49.71 40.03 19.08 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.885 179.87 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 26.2 pttm -60.96 -22.96 64.96 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.897 -179.893 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 16.2 pm0 -70.79 -179.54 2.25 Favored 'General case' 0 CA--C 1.516 -0.362 0 CA-C-O 121.526 0.679 . . . . 0.0 111.546 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 64.2 mttp 59.29 40.53 21.19 Favored 'General case' 0 N--CA 1.445 -0.695 0 CA-C-N 114.756 -1.111 . . . . 0.0 110.908 179.96 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 52.4 t0 53.52 47.6 23.63 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.032 179.348 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.458 ' HB2' ' O ' ' A' ' 3' ' ' THR . . . -61.33 -40.05 92.79 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.761 179.975 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 10.7 p -138.63 140.28 39.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.651 -179.941 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 66.3 m -127.82 150.24 49.92 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.784 -179.756 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 68.5 t0 -84.35 109.33 17.75 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.082 -0.508 . . . . 0.0 109.664 179.512 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 71.9 p -75.12 162.14 28.78 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.058 0.456 . . . . 0.0 111.279 -179.168 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . 0.786 ' O ' HG23 ' A' ' 17' ' ' VAL . . . -125.01 54.58 0.74 Allowed Glycine 0 CA--C 1.503 -0.695 0 N-CA-C 111.284 -0.726 . . . . 0.0 111.284 -179.904 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 70.1 p -65.03 -37.54 87.93 Favored 'General case' 0 N--CA 1.443 -0.787 0 N-CA-C 107.429 -1.323 . . . . 0.0 107.429 178.389 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -67.79 -42.23 81.95 Favored 'General case' 0 CA--C 1.514 -0.426 0 CA-C-N 115.522 -0.763 . . . . 0.0 110.226 177.428 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . 0.421 ' O ' HG22 ' A' ' 20' ' ' VAL . . . -62.26 -37.34 85.1 Favored 'General case' 0 CA--C 1.503 -0.833 0 CA-C-N 114.728 -1.124 . . . . 0.0 109.607 179.926 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . 0.822 HG22 ' HB3' ' A' ' 55' ' ' SER . 46.7 t -56.4 -46.03 81.87 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.044 0 CA-C-N 114.932 -1.031 . . . . 0.0 109.942 -178.945 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 67.7 t -63.26 -49.32 83.56 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.036 0 CA-C-N 114.315 -1.311 . . . . 0.0 112.222 -177.687 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 64.3 tttm -64.64 -42.87 95.16 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 116.755 2.131 . . . . 0.0 116.755 -176.928 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.476 HG23 ' N ' ' A' ' 21' ' ' VAL . 35.1 m -78.44 -53.78 13.28 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.17 0 C-N-CA 118.391 -1.324 . . . . 0.0 113.708 -176.135 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . 0.476 ' N ' HG23 ' A' ' 20' ' ' VAL . 53.1 t -61.64 -43.18 96.65 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.72 0 C-N-CA 118.189 -1.404 . . . . 0.0 111.411 -178.181 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -64.94 -26.39 68.29 Favored 'General case' 0 C--N 1.321 -0.647 0 C-N-CA 119.972 -0.691 . . . . 0.0 112.189 179.954 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 82.3 p -75.96 -52.09 11.02 Favored 'General case' 0 N--CA 1.463 0.202 0 C-N-CA 119.642 -0.823 . . . . 0.0 111.405 179.16 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.524 ' HB3' HD22 ' A' ' 42' ' ' LEU . 22.0 mp0 -70.34 -38.49 74.86 Favored 'General case' 0 C--O 1.223 -0.319 0 C-N-CA 120.838 -0.345 . . . . 0.0 111.876 178.627 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -59.74 -41.4 90.87 Favored 'General case' 0 CA--C 1.511 -0.542 0 N-CA-C 109.762 -0.458 . . . . 0.0 109.762 -177.923 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 88.9 tt0 -61.09 -46.23 91.47 Favored 'General case' 0 C--N 1.319 -0.733 0 N-CA-C 108.281 -1.007 . . . . 0.0 108.281 178.925 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 57.8 tp -65.55 -38.57 89.99 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.632 -0.713 . . . . 0.0 112.531 -179.061 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . 0.569 ' HD2' ' HB2' ' A' ' 37' ' ' ALA . 65.8 t80 -64.9 -40.2 94.71 Favored 'General case' 0 CA--C 1.506 -0.74 0 N-CA-C 106.594 -1.632 . . . . 0.0 106.594 179.112 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 92.1 mt-10 -62.66 -37.02 84.75 Favored 'General case' 0 N--CA 1.443 -0.799 0 CA-C-N 114.65 -1.159 . . . . 0.0 108.976 177.221 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 66.9 tp -61.99 -47.54 84.35 Favored 'General case' 0 N--CA 1.438 -1.069 0 C-N-CA 117.871 -1.532 . . . . 0.0 107.012 177.656 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 64.7 tttp -50.49 -49.73 54.65 Favored 'General case' 0 CA--C 1.52 -0.184 0 CA-C-N 115.338 -0.847 . . . . 0.0 109.422 177.433 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 98.8 m-20 -129.14 86.82 2.48 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 114.785 -1.098 . . . . 0.0 110.093 179.509 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 96.1 m -66.21 -40.35 90.27 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 112.901 0.704 . . . . 0.0 112.901 -178.209 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 65.5 t30 -58.51 -40.15 82.08 Favored 'General case' 0 C--N 1.325 -0.465 0 C-N-CA 120.823 -0.351 . . . . 0.0 111.254 -177.901 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 96.2 mt-10 -106.45 137.4 44.51 Favored 'General case' 0 C--N 1.325 -0.494 0 C-N-CA 120.53 -0.468 . . . . 0.0 110.008 -179.897 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -88.12 129.57 35.27 Favored 'General case' 0 N--CA 1.433 -1.301 0 C-N-CA 118.614 -1.234 . . . . 0.0 109.943 179.333 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . 0.569 ' HB2' ' HD2' ' A' ' 28' ' ' TYR . . . -48.72 -178.72 0.0 OUTLIER 'General case' 0 C--N 1.315 -0.911 0 CA-C-N 114.005 -1.452 . . . . 0.0 111.025 -179.377 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . 0.404 ' HA ' HG22 ' A' ' 70' ' ' VAL . 81.3 p -153.57 170.31 21.1 Favored 'General case' 0 C--N 1.314 -0.974 0 N-CA-C 108.427 -0.953 . . . . 0.0 108.427 177.917 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.681 HD21 ' HB3' ' A' ' 56' ' ' TYR . 97.5 mt -60.89 -41.78 96.72 Favored 'General case' 0 C--N 1.311 -1.093 0 N-CA-C 108.154 -1.054 . . . . 0.0 108.154 -179.601 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 75.0 m -63.86 -40.11 95.78 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.502 -0.772 . . . . 0.0 111.949 179.198 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -64.13 -46.74 82.79 Favored 'General case' 0 N--CA 1.464 0.231 0 N-CA-C 113.011 0.745 . . . . 0.0 113.011 -178.34 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.524 HD22 ' HB3' ' A' ' 24' ' ' GLN . 77.2 mt -63.29 -34.91 78.71 Favored 'General case' 0 CA--C 1.491 -1.292 0 N-CA-C 108.578 -0.897 . . . . 0.0 108.578 -178.026 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.914 HG21 ' HA ' ' A' ' 50' ' ' GLN . 0.4 OUTLIER -81.53 -28.37 10.27 Favored 'Isoleucine or valine' 0 N--CA 1.416 -2.146 0 CA-C-N 114.666 -1.152 . . . . 0.0 111.718 -176.676 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . 0.557 ' C ' ' H ' ' A' ' 46' ' ' GLY . 75.8 m -61.88 -50.54 71.81 Favored 'General case' 0 N--CA 1.417 -2.075 0 N-CA-C 104.797 -2.298 . . . . 0.0 104.797 177.617 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . 0.438 ' O ' ' N ' ' A' ' 47' ' ' ASN . 2.4 p -52.8 1.6 0.01 OUTLIER 'General case' 0 CA--C 1.551 0.985 0 CA-C-N 113.249 -1.796 . . . . 0.0 112.933 170.739 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . 0.557 ' H ' ' C ' ' A' ' 44' ' ' SER . . . 28.27 32.33 0.01 OUTLIER Glycine 0 C--N 1.346 1.116 0 C-N-CA 125.757 1.646 . . . . 0.0 114.679 -173.466 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . 0.438 ' N ' ' O ' ' A' ' 45' ' ' SER . 54.7 t-20 -63.79 -42.28 97.75 Favored 'General case' 0 CA--C 1.518 -0.272 0 N-CA-C 106.588 -1.634 . . . . 0.0 106.588 175.699 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.735 HD12 HG23 ' A' ' 43' ' ' VAL . 2.4 pp -121.94 166.44 16.57 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.703 0 CA-C-N 112.221 -2.263 . . . . 0.0 109.941 -179.284 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 98.7 p -81.17 166.97 20.16 Favored 'General case' 0 N--CA 1.444 -0.764 0 C-N-CA 120.544 -0.462 . . . . 0.0 110.251 -179.636 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.914 ' HA ' HG21 ' A' ' 43' ' ' VAL . 11.9 tm0? -57.93 -48.86 78.66 Favored 'General case' 0 CA--C 1.493 -1.224 0 CA-C-O 118.531 -0.747 . . . . 0.0 109.212 179.942 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.475 ' O ' ' N ' ' A' ' 55' ' ' SER . 64.3 pttt -60.0 -24.88 64.83 Favored 'General case' 0 CA--C 1.482 -1.672 0 CA-C-N 120.166 1.348 . . . . 0.0 110.953 -177.533 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . 0.462 ' HG2' HG21 ' A' ' 20' ' ' VAL . 3.6 tm0? -67.84 -37.5 81.96 Favored 'General case' 0 N--CA 1.434 -1.25 0 N-CA-C 104.978 -2.231 . . . . 0.0 104.978 175.035 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.644 ' O ' HD13 ' A' ' 39' ' ' LEU . . . -63.68 -49.11 74.45 Favored 'General case' 0 C--O 1.218 -0.557 0 C-N-CA 118.608 -1.237 . . . . 0.0 107.935 175.927 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 99.9 m-20 -70.56 -11.29 60.84 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 119.226 -0.99 . . . . 0.0 112.125 177.855 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . 0.822 ' HB3' HG22 ' A' ' 17' ' ' VAL . 62.5 m -64.65 -41.29 96.23 Favored 'General case' 0 CA--C 1.503 -0.836 0 N-CA-C 109.028 -0.73 . . . . 0.0 109.028 -179.734 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . 0.681 ' HB3' HD21 ' A' ' 39' ' ' LEU . 1.1 t80 -79.55 -30.49 41.75 Favored 'General case' 0 C--N 1.321 -0.669 0 C-N-CA 118.548 -1.261 . . . . 0.0 109.469 179.565 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -60.54 -27.5 67.69 Favored 'General case' 0 CA--C 1.54 0.558 0 N-CA-C 106.797 -1.557 . . . . 0.0 106.797 174.425 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.784 ' HB3' ' O ' ' A' ' 55' ' ' SER . . . -68.57 -39.38 81.02 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 112.105 -2.316 . . . . 0.0 109.881 176.255 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 66.5 t80 -71.4 -39.4 71.18 Favored 'General case' 0 C--N 1.344 0.341 0 N-CA-C 108.668 -0.864 . . . . 0.0 108.668 176.687 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.456 ' O ' ' O ' ' A' ' 63' ' ' HIS . 55.0 t80 -59.49 -39.66 84.5 Favored 'General case' 0 CA--C 1.503 -0.832 0 N-CA-C 106.998 -1.482 . . . . 0.0 106.998 177.295 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -52.43 -43.45 58.17 Favored Glycine 0 N--CA 1.436 -1.309 0 CA-C-N 113.798 -1.547 . . . . 0.0 110.463 -179.051 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 39.1 ttpt -58.77 -45.37 89.95 Favored 'General case' 0 CA--C 1.548 0.885 0 N-CA-C 113.611 0.967 . . . . 0.0 113.611 -179.325 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' HIS . . . . . 0.456 ' O ' ' O ' ' A' ' 60' ' ' TYR . 96.3 m-70 -129.76 176.3 8.13 Favored 'General case' 0 N--CA 1.482 1.152 0 CA-C-O 121.513 0.673 . . . . 0.0 112.705 -179.06 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 15.7 m -59.58 -156.87 0.0 OUTLIER 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.998 179.871 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -78.73 8.0 45.7 Favored Glycine 0 CA--C 1.529 0.933 0 N-CA-C 112.235 -0.346 . . . . 0.0 112.235 -179.083 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 24.8 pt-20 -82.32 -6.67 59.41 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 111.689 0.255 . . . . 0.0 111.689 -179.789 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 1.1 p -93.49 -70.25 0.71 Allowed 'General case' 0 CA--C 1.532 0.266 0 N-CA-C 113.228 0.825 . . . . 0.0 113.228 -178.706 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 1.1 mm-40 -36.99 100.7 0.02 OUTLIER 'General case' 0 N--CA 1.45 -0.454 0 CA-C-O 123.105 1.431 . . . . 0.0 113.964 -173.488 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 73.9 p -62.36 -15.12 46.56 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 111.479 -2.6 . . . . 0.0 109.253 179.627 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.404 HG22 ' HA ' ' A' ' 38' ' ' SER . 3.8 p -130.76 139.97 49.87 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.966 0 N-CA-C 105.593 -2.003 . . . . 0.0 105.593 177.723 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -63.2 100.56 0.24 Allowed 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 119.303 -0.959 . . . . 0.0 113.015 -174.547 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 52.2 p30 . . . . . 0 C--O 1.22 -0.498 0 CA-C-O 117.964 -1.017 . . . . 0.0 110.38 178.259 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 74.4 m-20 . . . . . 0 N--CA 1.49 1.566 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 65.3 tp -108.11 121.76 45.49 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.515 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 68.0 p -88.76 -12.01 43.37 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.053 179.864 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 64.4 tttm -61.38 -41.74 97.58 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.776 0.322 . . . . 0.0 110.598 -179.909 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 24.8 pt20 -144.78 173.39 11.89 Favored 'General case' 0 CA--C 1.505 -0.785 0 CA-C-O 121.432 0.634 . . . . 0.0 111.695 -179.304 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -61.88 -39.83 93.29 Favored 'General case' 0 N--CA 1.437 -1.096 0 CA-C-N 114.939 -1.028 . . . . 0.0 111.029 -179.149 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 53.4 t0 70.08 -67.06 0.25 Allowed 'General case' 0 N--CA 1.467 0.378 0 O-C-N 123.633 0.583 . . . . 0.0 111.318 179.663 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -146.26 159.48 43.28 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.88 0.371 . . . . 0.0 110.692 -179.419 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 35.9 m -51.2 165.23 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.628 -179.634 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 40.7 t -61.89 137.34 58.24 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.238 -179.146 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 167.99 -81.79 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 115.174 -0.921 . . . . 0.0 109.028 179.595 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 10.8 t -86.02 -25.56 25.89 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.233 178.903 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -77.36 58.26 3.69 Favored Glycine 0 CA--C 1.505 -0.584 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.919 -179.594 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.781 ' O ' HG12 ' A' ' 17' ' ' VAL . 70.0 p -68.02 -38.57 82.71 Favored 'General case' 0 N--CA 1.439 -1.0 0 N-CA-C 106.48 -1.674 . . . . 0.0 106.48 177.051 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -68.13 -41.26 81.95 Favored 'General case' 0 CA--C 1.515 -0.366 0 CA-C-O 122.007 0.908 . . . . 0.0 109.978 176.951 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -61.85 -38.26 87.57 Favored 'General case' 0 N--CA 1.444 -0.728 0 CA-C-N 114.456 -1.247 . . . . 0.0 110.038 -179.807 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . 0.826 HG11 ' HB3' ' A' ' 55' ' ' SER . 3.4 p -67.79 -25.65 33.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 C-N-CA 119.39 -0.924 . . . . 0.0 110.888 -178.78 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 60.8 t -63.33 -45.2 98.8 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.709 0 C-N-CA 119.75 -0.78 . . . . 0.0 109.152 179.893 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 15.0 tmtt? -64.56 -39.59 94.03 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 114.57 -1.196 . . . . 0.0 114.057 -178.925 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.467 HG21 ' CG ' ' A' ' 52' ' ' GLN . 34.6 m -69.94 -45.17 77.62 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.126 0 N-CA-C 113.221 0.823 . . . . 0.0 113.221 -176.729 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . 0.519 HG21 ' HB2' ' A' ' 56' ' ' TYR . 54.2 t -59.86 -42.36 88.86 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.842 0 C-N-CA 120.223 -0.591 . . . . 0.0 110.342 -179.403 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 98.7 mt-10 -62.35 -38.25 88.82 Favored 'General case' 0 C--N 1.321 -0.656 0 C-N-CA 120.837 -0.345 . . . . 0.0 111.561 179.74 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 73.1 m -64.89 -49.06 71.97 Favored 'General case' 0 N--CA 1.467 0.386 0 C-N-CA 120.379 -0.529 . . . . 0.0 111.431 179.636 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 18.3 mp0 -67.64 -37.42 82.42 Favored 'General case' 0 C--O 1.222 -0.389 0 CA-C-O 121.077 0.465 . . . . 0.0 109.955 178.059 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.406 ' O ' ' HG3' ' A' ' 29' ' ' GLU . . . -60.48 -39.58 88.16 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.309 -0.859 . . . . 0.0 110.265 -179.338 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 54.5 tp10 -68.74 -41.27 79.19 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 123.869 0.73 . . . . 0.0 110.25 178.781 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 58.5 tp -71.04 -38.46 72.56 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.302 -0.863 . . . . 0.0 113.063 -179.525 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . 0.43 ' HD2' ' HB2' ' A' ' 37' ' ' ALA . 85.9 t80 -65.11 -46.6 80.4 Favored 'General case' 0 CA--C 1.493 -1.225 0 N-CA-C 107.969 -1.123 . . . . 0.0 107.969 179.906 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.566 ' O ' ' N ' ' A' ' 33' ' ' THR . 2.6 pp20? -71.88 -23.23 61.47 Favored 'General case' 0 N--CA 1.43 -1.43 0 C-N-CA 118.563 -1.255 . . . . 0.0 108.809 176.636 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 67.5 tp -62.91 -48.54 78.49 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 105.979 -1.86 . . . . 0.0 105.979 177.894 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -50.69 -48.27 58.7 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 113.691 -1.595 . . . . 0.0 110.606 176.805 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 28.2 m120 -89.17 -66.71 0.89 Allowed 'General case' 0 N--CA 1.479 0.996 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.935 -178.225 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.566 ' N ' ' O ' ' A' ' 29' ' ' GLU . 4.0 m 81.31 -36.0 0.11 Allowed 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.182 0.926 . . . . 0.0 112.228 178.415 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 99.1 m-20 -61.38 -41.09 96.53 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 119.819 -0.752 . . . . 0.0 109.664 -179.971 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 94.6 mt-10 -115.16 -162.36 0.82 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.07 -0.513 . . . . 0.0 109.708 -179.469 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 1.1 mptp? -129.38 133.56 47.44 Favored 'General case' 0 N--CA 1.437 -1.078 0 N-CA-C 107.241 -1.392 . . . . 0.0 107.241 176.43 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . 0.43 ' HB2' ' HD2' ' A' ' 28' ' ' TYR . . . -52.54 178.21 0.02 OUTLIER 'General case' 0 C--N 1.318 -0.772 0 CA-C-O 120.989 0.423 . . . . 0.0 110.086 -179.67 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . 0.441 ' CB ' ' O ' ' A' ' 71' ' ' ALA . 82.6 p -158.61 157.6 32.23 Favored 'General case' 0 CA--C 1.508 -0.644 0 N-CA-C 109.083 -0.71 . . . . 0.0 109.083 178.352 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.526 HD11 ' HB3' ' A' ' 56' ' ' TYR . 75.6 mt -58.48 -41.65 85.73 Favored 'General case' 0 C--N 1.317 -0.841 0 C-N-CA 117.9 -1.52 . . . . 0.0 109.122 -179.216 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 93.0 p -63.35 -33.97 76.69 Favored 'General case' 0 C--N 1.313 -1.016 0 C-N-CA 119.191 -1.004 . . . . 0.0 109.817 177.805 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 57.7 mtpt -76.14 -54.83 6.24 Favored 'General case' 0 CA--C 1.52 -0.175 0 N-CA-C 114.874 1.435 . . . . 0.0 114.874 -178.211 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 82.6 mt -60.54 -41.16 93.92 Favored 'General case' 0 CA--C 1.49 -1.344 0 CA-C-O 123.023 1.392 . . . . 0.0 107.63 -176.568 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.461 ' HB ' ' O ' ' A' ' 39' ' ' LEU . 0.3 OUTLIER -69.58 -46.15 76.23 Favored 'Isoleucine or valine' 0 N--CA 1.398 -3.054 0 CA-C-N 111.523 -2.58 . . . . 0.0 110.873 -172.788 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . 0.564 ' C ' ' H ' ' A' ' 46' ' ' GLY . 48.2 t -61.08 -46.7 89.56 Favored 'General case' 0 N--CA 1.42 -1.951 0 C-N-CA 116.359 -2.136 . . . . 0.0 105.508 178.208 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . 0.4 ' O ' ' N ' ' A' ' 47' ' ' ASN . 59.1 m -50.58 2.53 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.89 0 CA-C-N 113.303 -1.772 . . . . 0.0 113.555 172.483 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . 0.564 ' H ' ' C ' ' A' ' 44' ' ' SER . . . 28.46 37.5 0.01 OUTLIER Glycine 0 C--N 1.347 1.187 0 C-N-CA 125.043 1.306 . . . . 0.0 113.42 -173.45 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . 0.4 ' N ' ' O ' ' A' ' 45' ' ' SER . 55.6 t-20 -68.01 -39.85 83.11 Favored 'General case' 0 N--CA 1.449 -0.489 0 N-CA-C 106.256 -1.757 . . . . 0.0 106.256 173.126 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 24.1 pt -129.08 161.14 39.04 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.638 0 CA-C-N 112.187 -2.278 . . . . 0.0 108.701 179.645 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . 0.403 ' O ' ' N ' ' A' ' 52' ' ' GLN . 72.3 m -91.27 136.26 33.22 Favored 'General case' 0 C--O 1.216 -0.704 0 C-N-CA 119.993 -0.683 . . . . 0.0 111.597 -179.315 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.591 ' HA ' ' HB3' ' A' ' 53' ' ' ALA . 65.8 tp60 -48.7 -17.57 0.19 Allowed 'General case' 0 C--O 1.214 -0.79 0 CA-C-N 114.986 -1.007 . . . . 0.0 112.842 -177.392 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 63.5 pttt -71.94 -39.4 69.44 Favored 'General case' 0 C--N 1.31 -1.141 0 N-CA-C 106.35 -1.722 . . . . 0.0 106.35 177.806 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . 0.467 ' CG ' HG21 ' A' ' 20' ' ' VAL . 5.8 tt0 -69.69 -52.36 26.38 Favored 'General case' 0 N--CA 1.428 -1.531 0 CA-C-N 112.323 -2.217 . . . . 0.0 106.224 176.791 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.591 ' HB3' ' HA ' ' A' ' 50' ' ' GLN . . . -60.36 -38.51 84.08 Favored 'General case' 0 C--N 1.344 0.347 0 CA-C-N 115.375 -0.829 . . . . 0.0 111.881 -176.086 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 98.8 m-20 -62.03 -39.61 92.9 Favored 'General case' 0 C--N 1.314 -0.949 0 C-N-CA 120.197 -0.601 . . . . 0.0 112.614 179.638 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . 0.826 ' HB3' HG11 ' A' ' 17' ' ' VAL . 75.4 m -62.87 -41.38 99.36 Favored 'General case' 0 C--N 1.314 -0.97 0 C-N-CA 119.213 -0.995 . . . . 0.0 110.473 -179.318 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . 0.526 ' HB3' HD11 ' A' ' 39' ' ' LEU . 0.9 OUTLIER -69.6 -39.0 77.51 Favored 'General case' 0 N--CA 1.464 0.269 0 C-N-CA 118.015 -1.474 . . . . 0.0 108.81 179.942 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.434 ' HB2' HD13 ' A' ' 39' ' ' LEU . 87.9 tttt -55.76 -33.34 64.22 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.173 -0.922 . . . . 0.0 108.753 178.524 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.504 ' HB3' ' O ' ' A' ' 55' ' ' SER . . . -60.5 -37.46 81.19 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-N 115.226 -0.897 . . . . 0.0 109.623 178.519 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 62.4 m-85 -62.28 -39.33 92.58 Favored 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 120.065 -0.654 . . . . 0.0 109.981 178.768 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 80.1 t80 -60.39 -46.72 88.97 Favored 'General case' 0 CA--C 1.511 -0.544 0 N-CA-C 107.583 -1.265 . . . . 0.0 107.583 174.513 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -54.09 -44.02 73.4 Favored Glycine 0 CA--C 1.529 0.942 0 CA-C-N 113.064 -1.88 . . . . 0.0 112.829 -178.685 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 60.6 tptt -58.46 -45.88 87.69 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.933 0.367 . . . . 0.0 111.568 -178.632 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 63.5 m170 -123.33 -81.59 0.64 Allowed 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 120.695 -0.402 . . . . 0.0 112.016 -179.781 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 9.4 t -167.8 -155.17 0.16 Allowed 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 120.808 -0.357 . . . . 0.0 111.047 -178.607 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -68.95 -5.05 44.96 Favored Glycine 0 CA--C 1.529 0.912 0 N-CA-C 111.626 -0.59 . . . . 0.0 111.626 -179.908 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 24.6 pt-20 -81.57 -10.78 59.36 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 111.795 0.294 . . . . 0.0 111.795 -179.079 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 80.7 p -98.61 -19.17 17.72 Favored 'General case' 0 C--N 1.331 -0.224 0 C-N-CA 119.967 -0.693 . . . . 0.0 111.886 -179.701 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -92.76 102.37 14.77 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-O 121.835 0.826 . . . . 0.0 111.76 -179.113 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 91.4 m -51.0 -23.4 2.9 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 114.058 -1.428 . . . . 0.0 110.945 -179.374 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.406 ' CG2' ' O ' ' A' ' 37' ' ' ALA . 2.9 p -109.62 150.15 12.39 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.516 0 N-CA-C 108.285 -1.006 . . . . 0.0 108.285 179.249 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . 0.441 ' O ' ' CB ' ' A' ' 38' ' ' SER . . . -53.27 115.32 1.84 Allowed 'General case' 0 C--O 1.21 -1.012 0 C-N-CA 119.342 -0.943 . . . . 0.0 110.667 -177.371 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 1.3 m120 . . . . . 0 C--N 1.323 -0.564 0 CA-C-O 117.987 -1.006 . . . . 0.0 111.207 179.254 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 99.1 m-20 . . . . . 0 N--CA 1.49 1.565 0 N-CA-C 109.406 -0.59 . . . . 0.0 109.406 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 86.0 mt 58.27 48.06 13.17 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.677 179.88 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 95.7 m -116.04 129.17 56.24 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.044 -179.724 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -126.92 146.39 50.33 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.356 179.768 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 26.1 pt20 -155.35 159.96 40.34 Favored 'General case' 0 CA--C 1.516 -0.358 0 CA-C-O 121.094 0.473 . . . . 0.0 111.395 -179.985 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 29.5 tptp -134.61 129.29 34.72 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.8 178.528 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -111.66 -80.0 0.58 Allowed 'General case' 0 C--N 1.33 -0.276 0 C-N-CA 120.842 -0.343 . . . . 0.0 111.778 -179.002 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -154.77 -154.86 0.53 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.172 -178.891 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 35.1 m -53.93 -25.66 12.84 Favored 'Isoleucine or valine' 0 C--O 1.231 0.119 0 C-N-CA 120.403 -0.519 . . . . 0.0 109.709 179.869 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 68.5 m -113.98 129.09 56.63 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 178.527 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 18.5 t0 -168.27 179.24 4.57 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.274 -179.247 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 68.7 p -71.42 160.82 32.08 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.346 -0.613 . . . . 0.0 109.346 179.435 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -93.97 7.02 73.29 Favored Glycine 0 CA--C 1.504 -0.633 0 C-N-CA 120.606 -0.807 . . . . 0.0 112.861 -178.805 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.748 ' O ' HG12 ' A' ' 17' ' ' VAL . 71.1 p -59.61 -39.03 82.9 Favored 'General case' 0 N--CA 1.441 -0.904 0 N-CA-C 106.175 -1.787 . . . . 0.0 106.175 179.168 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -69.9 -39.4 76.23 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 122.292 1.044 . . . . 0.0 110.795 175.696 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . 0.6 ' O ' HG22 ' A' ' 20' ' ' VAL . . . -59.72 -36.44 76.56 Favored 'General case' 0 N--CA 1.446 -0.671 0 CA-C-N 113.761 -1.563 . . . . 0.0 111.246 -177.46 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . 0.748 HG12 ' O ' ' A' ' 14' ' ' THR . 9.8 p -51.79 -36.75 19.52 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 C-N-CA 119.155 -1.018 . . . . 0.0 111.027 -178.199 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 77.3 t -70.44 -45.67 73.87 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 C-N-CA 119.832 -0.747 . . . . 0.0 110.042 179.531 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 64.8 tttp -62.64 -43.85 97.77 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-N 115.302 -0.863 . . . . 0.0 113.263 -178.962 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.747 HG21 ' HG2' ' A' ' 52' ' ' GLN . 30.1 m -70.44 -50.65 44.17 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.18 0 N-CA-C 113.723 1.009 . . . . 0.0 113.723 -177.303 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . 0.67 HG11 ' CD2' ' A' ' 56' ' ' TYR . 65.3 t -65.48 -44.89 94.07 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 C-N-CA 120.249 -0.58 . . . . 0.0 112.073 -178.495 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 98.7 mt-10 -65.0 -42.66 94.3 Favored 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 112.763 0.653 . . . . 0.0 112.763 -179.129 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 74.1 m -66.51 -45.08 80.74 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-O 121.518 0.675 . . . . 0.0 110.501 -179.909 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 99.5 mm-40 -66.0 -37.93 87.18 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 114.859 -1.064 . . . . 0.0 109.114 179.065 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.427 ' HB2' ' O ' ' A' ' 21' ' ' VAL . . . -59.3 -40.36 85.93 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 114.725 -1.125 . . . . 0.0 109.516 -179.125 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 88.8 tt0 -66.15 -39.87 90.15 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.304 178.441 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 56.8 tp -64.31 -38.47 91.15 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.563 -179.591 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . 0.444 ' HB3' ' HB2' ' A' ' 37' ' ' ALA . 87.5 t80 -66.26 -36.74 83.77 Favored 'General case' 0 CA--C 1.503 -0.856 0 N-CA-C 107.695 -1.224 . . . . 0.0 107.695 177.762 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 95.1 mt-10 -64.94 -35.6 81.7 Favored 'General case' 0 N--CA 1.445 -0.682 0 N-CA-C 108.905 -0.776 . . . . 0.0 108.905 176.638 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 66.7 tp -62.36 -47.92 82.04 Favored 'General case' 0 N--CA 1.436 -1.141 0 N-CA-C 106.619 -1.623 . . . . 0.0 106.619 177.894 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 60.9 tptt -50.82 -50.57 56.14 Favored 'General case' 0 CA--C 1.523 -0.09 0 CA-C-N 115.115 -0.948 . . . . 0.0 109.279 177.371 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 27.5 m120 -129.55 102.17 6.26 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 114.63 -1.168 . . . . 0.0 109.891 179.172 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 11.3 t -87.08 -15.75 37.61 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 112.309 0.485 . . . . 0.0 112.309 -178.241 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 48.3 t30 -59.92 -43.53 94.85 Favored 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 120.519 -0.472 . . . . 0.0 110.81 -179.079 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 70.9 mm-40 -109.79 -161.03 0.74 Allowed 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 179.791 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 75.8 mmtt -128.69 140.49 51.72 Favored 'General case' 0 N--CA 1.43 -1.466 0 N-CA-C 106.34 -1.726 . . . . 0.0 106.34 175.406 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . 0.444 ' HB2' ' HB3' ' A' ' 28' ' ' TYR . . . -51.03 163.81 0.19 Allowed 'General case' 0 C--N 1.315 -0.921 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 -179.535 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . 0.532 ' HA ' HG22 ' A' ' 70' ' ' VAL . 19.7 m -135.47 144.69 46.55 Favored 'General case' 0 N--CA 1.433 -1.307 0 N-CA-C 107.226 -1.398 . . . . 0.0 107.226 177.97 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.563 HD12 HE22 ' A' ' 68' ' ' GLN . 8.5 tt -53.93 -40.64 66.92 Favored 'General case' 0 C--N 1.315 -0.901 0 N-CA-C 108.697 -0.853 . . . . 0.0 108.697 -178.365 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 92.8 p -65.3 -34.61 78.74 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.452 -0.794 . . . . 0.0 110.171 177.807 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . 0.404 ' HG3' ' HB2' ' A' ' 38' ' ' SER . 97.7 mttt -73.17 -49.18 29.54 Favored 'General case' 0 CA--C 1.513 -0.475 0 N-CA-C 114.122 1.156 . . . . 0.0 114.122 -178.883 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.439 HD23 HD22 ' A' ' 47' ' ' ASN . 96.3 mt -60.62 -40.58 92.4 Favored 'General case' 0 CA--C 1.49 -1.352 0 N-CA-C 107.243 -1.391 . . . . 0.0 107.243 -176.116 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.401 HG21 ' HA ' ' A' ' 50' ' ' GLN . 0.3 OUTLIER -70.04 -46.88 71.4 Favored 'Isoleucine or valine' 0 N--CA 1.397 -3.081 0 CA-C-N 111.815 -2.448 . . . . 0.0 111.251 -172.906 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . 0.543 ' C ' ' H ' ' A' ' 46' ' ' GLY . 74.2 m -61.37 -45.77 93.0 Favored 'General case' 0 N--CA 1.407 -2.604 0 C-N-CA 116.242 -2.183 . . . . 0.0 105.997 178.511 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . 0.424 ' O ' ' N ' ' A' ' 47' ' ' ASN . 26.4 t -50.6 6.23 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.967 0 CA-C-N 113.724 -1.58 . . . . 0.0 114.082 172.536 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . 0.543 ' H ' ' C ' ' A' ' 44' ' ' SER . . . 29.17 36.11 0.01 OUTLIER Glycine 0 C--N 1.351 1.374 0 C-N-CA 124.586 1.088 . . . . 0.0 113.25 -173.013 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . 0.439 HD22 HD23 ' A' ' 42' ' ' LEU . 95.5 m-20 -67.98 -39.55 83.27 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-O 122.779 1.275 . . . . 0.0 107.696 172.989 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 11.6 pt -131.7 159.43 43.08 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.858 0 CA-C-N 112.382 -2.19 . . . . 0.0 109.205 179.87 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . 0.444 ' O ' ' N ' ' A' ' 52' ' ' GLN . 45.3 t -83.08 134.19 35.03 Favored 'General case' 0 C--O 1.211 -0.944 0 C-N-CA 120.494 -0.482 . . . . 0.0 111.14 -179.625 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.456 ' HA ' ' HB3' ' A' ' 53' ' ' ALA . 66.4 tp60 -50.44 -18.48 0.65 Allowed 'General case' 0 C--O 1.212 -0.908 0 CA-C-N 116.279 -0.418 . . . . 0.0 111.61 -179.22 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.407 ' CG ' ' N ' ' A' ' 52' ' ' GLN . 63.3 pttt -72.86 -40.6 65.53 Favored 'General case' 0 C--N 1.317 -0.831 0 N-CA-C 106.018 -1.845 . . . . 0.0 106.018 178.092 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . 0.747 ' HG2' HG21 ' A' ' 20' ' ' VAL . 0.5 OUTLIER -67.63 -53.01 31.51 Favored 'General case' 0 N--CA 1.424 -1.759 0 CA-C-N 112.082 -2.326 . . . . 0.0 106.549 176.483 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.456 ' HB3' ' HA ' ' A' ' 50' ' ' GLN . . . -61.63 -38.9 89.36 Favored 'General case' 0 C--O 1.22 -0.46 0 C-N-CA 119.885 -0.726 . . . . 0.0 112.161 -177.579 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 98.0 m-20 -60.62 -39.83 89.66 Favored 'General case' 0 C--N 1.311 -1.092 0 C-N-CA 119.374 -0.93 . . . . 0.0 111.579 -179.718 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . 0.461 ' CB ' HG21 ' A' ' 17' ' ' VAL . 67.3 m -64.62 -40.68 95.91 Favored 'General case' 0 C--N 1.31 -1.135 0 C-N-CA 119.751 -0.78 . . . . 0.0 111.147 179.147 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . 0.67 ' CD2' HG11 ' A' ' 21' ' ' VAL . 10.7 t80 -70.44 -39.98 74.02 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-O 122.069 0.938 . . . . 0.0 109.737 -178.66 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 64.4 tttm -58.48 -33.24 69.56 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 113.886 -1.506 . . . . 0.0 108.879 179.148 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.449 ' HB3' ' O ' ' A' ' 55' ' ' SER . . . -61.4 -37.87 85.0 Favored 'General case' 0 N--CA 1.443 -0.803 0 CA-C-N 114.886 -1.052 . . . . 0.0 110.143 178.14 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . 0.567 ' HE1' HG11 ' A' ' 17' ' ' VAL . 73.2 m-85 -63.28 -39.46 94.64 Favored 'General case' 0 C--N 1.342 0.281 0 C-N-CA 119.966 -0.694 . . . . 0.0 109.894 178.666 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.435 ' O ' ' HB3' ' A' ' 63' ' ' HIS . 93.1 t80 -62.22 -44.47 96.5 Favored 'General case' 0 N--CA 1.446 -0.675 0 N-CA-C 106.974 -1.491 . . . . 0.0 106.974 175.324 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -52.43 -49.22 52.62 Favored Glycine 0 CA--C 1.529 0.953 0 CA-C-N 114.749 -1.114 . . . . 0.0 110.567 -179.54 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 14.4 mptt -59.59 -2.92 0.39 Allowed 'General case' 0 CA--C 1.539 0.525 0 N-CA-C 112.812 0.671 . . . . 0.0 112.812 178.075 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' HIS . . . . . 0.435 ' HB3' ' O ' ' A' ' 60' ' ' TYR . 34.3 p80 -44.98 156.55 0.09 Allowed 'General case' 0 N--CA 1.462 0.14 0 CA-C-O 122.567 1.175 . . . . 0.0 113.76 -176.212 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 48.4 t 179.15 75.52 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 112.457 -2.156 . . . . 0.0 105.884 179.486 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 82.85 10.92 82.38 Favored Glycine 0 CA--C 1.537 1.446 0 N-CA-C 109.404 -1.478 . . . . 0.0 109.404 -175.918 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 24.4 pt-20 -143.56 171.12 14.6 Favored 'General case' 0 C--N 1.345 0.397 0 CA-C-O 120.633 0.254 . . . . 0.0 110.359 -179.597 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . 0.412 ' HG1' ' HE1' ' A' ' 60' ' ' TYR . 12.6 t -148.55 -166.19 2.48 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 116.674 -0.239 . . . . 0.0 111.004 -179.226 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . 0.563 HE22 HD12 ' A' ' 39' ' ' LEU . 1.7 pt20 -102.64 158.4 16.27 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-O 121.54 0.686 . . . . 0.0 110.896 177.805 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 94.5 m -56.77 -35.96 69.26 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 114.627 -1.17 . . . . 0.0 113.032 -177.905 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.532 HG22 ' HA ' ' A' ' 38' ' ' SER . 4.0 p -102.09 152.55 5.46 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.57 0 N-CA-C 108.986 -0.746 . . . . 0.0 108.986 -178.271 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -87.63 75.49 9.03 Favored 'General case' 0 C--N 1.348 0.528 0 N-CA-C 113.79 1.033 . . . . 0.0 113.79 -174.901 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 50.0 p30 . . . . . 0 C--O 1.219 -0.508 0 CA-C-O 118.079 -0.962 . . . . 0.0 111.172 178.386 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 56.3 t30 . . . . . 0 N--CA 1.49 1.543 0 N-CA-C 109.587 -0.523 . . . . 0.0 109.587 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 86.5 mt 55.62 35.57 25.48 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.562 179.789 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 66.6 p -68.13 -30.93 70.19 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.365 -0.379 . . . . 0.0 110.358 179.994 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -62.69 -40.0 95.75 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.994 0.426 . . . . 0.0 110.078 179.58 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 62.6 tt0 -88.5 136.36 33.03 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.815 -0.63 . . . . 0.0 109.315 179.566 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 62.7 mttp 65.1 -170.07 0.2 Allowed 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 109.33 -0.619 . . . . 0.0 109.33 -178.363 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 37.0 t70 -139.33 110.46 6.89 Favored 'General case' 0 C--N 1.322 -0.606 0 C-N-CA 120.093 -0.643 . . . . 0.0 111.63 -178.563 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.71 149.89 45.66 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.595 -179.973 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 34.0 m -128.35 161.28 37.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.737 -179.588 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 87.4 p -147.08 163.81 35.07 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.307 -179.36 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 52.6 t0 57.8 47.13 15.93 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.226 0.536 . . . . 0.0 109.685 -179.046 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . 0.825 HG22 ' H ' ' A' ' 14' ' ' THR . 89.7 m -62.68 133.54 54.98 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.417 -0.811 . . . . 0.0 110.831 -179.715 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -89.99 12.55 67.22 Favored Glycine 0 C--O 1.225 -0.421 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.989 -179.501 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.825 ' H ' HG22 ' A' ' 12' ' ' THR . 98.6 m -59.0 -40.31 84.48 Favored 'General case' 0 N--CA 1.438 -1.028 0 N-CA-C 106.191 -1.781 . . . . 0.0 106.191 178.513 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -67.67 -40.57 84.43 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 114.98 -1.009 . . . . 0.0 110.815 177.864 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -62.03 -39.47 92.43 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.366 -0.834 . . . . 0.0 111.062 -178.837 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . 0.593 HG12 ' O ' ' A' ' 14' ' ' THR . 12.9 p -67.65 -28.19 40.92 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 C-N-CA 119.296 -0.962 . . . . 0.0 110.882 -178.994 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 58.3 t -61.13 -45.28 98.88 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.908 0 N-CA-C 108.491 -0.929 . . . . 0.0 108.491 179.402 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 40.2 ttpt -65.32 -39.94 93.08 Favored 'General case' 0 CA--C 1.541 0.606 0 N-CA-C 115.07 1.507 . . . . 0.0 115.07 -179.56 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.755 HG21 ' HG2' ' A' ' 52' ' ' GLN . 27.2 m -76.8 -51.09 19.78 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.298 0 N-CA-C 114.208 1.188 . . . . 0.0 114.208 -177.224 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . 0.485 ' N ' HG23 ' A' ' 20' ' ' VAL . 79.6 t -64.22 -44.87 97.5 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.748 0 N-CA-C 112.057 0.391 . . . . 0.0 112.057 -177.887 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 97.3 mt-10 -64.6 -40.18 95.06 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 112.911 0.708 . . . . 0.0 112.911 -179.682 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 47.8 t -65.84 -47.76 73.9 Favored 'General case' 0 N--CA 1.463 0.205 0 C-N-CA 120.209 -0.596 . . . . 0.0 110.212 178.878 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -65.28 -37.51 87.4 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.206 -0.906 . . . . 0.0 110.068 178.598 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.973 ' HB1' HG11 ' A' ' 70' ' ' VAL . . . -58.1 -43.89 87.34 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 -177.845 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 88.9 tt0 -61.63 -43.91 97.98 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 114.657 -1.156 . . . . 0.0 109.596 179.74 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 53.8 tp -65.88 -37.92 87.42 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.676 -0.693 . . . . 0.0 112.389 -179.646 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . 0.736 ' HB3' ' HB2' ' A' ' 37' ' ' ALA . 83.7 t80 -67.52 -39.46 85.1 Favored 'General case' 0 CA--C 1.509 -0.609 0 N-CA-C 106.942 -1.503 . . . . 0.0 106.942 178.896 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.422 ' O ' ' N ' ' A' ' 33' ' ' THR . 94.4 mt-10 -61.94 -37.92 86.54 Favored 'General case' 0 N--CA 1.443 -0.803 0 N-CA-C 108.272 -1.01 . . . . 0.0 108.272 176.966 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 65.6 tp -63.49 -46.39 86.36 Favored 'General case' 0 N--CA 1.442 -0.872 0 N-CA-C 107.137 -1.431 . . . . 0.0 107.137 177.303 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 24.7 ttmm -50.46 -49.35 55.37 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-N 114.449 -1.25 . . . . 0.0 111.94 178.987 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 99.2 m-20 -108.52 -57.33 2.14 Favored 'General case' 0 N--CA 1.479 1.003 0 N-CA-C 113.515 0.931 . . . . 0.0 113.515 -177.824 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.422 ' N ' ' O ' ' A' ' 29' ' ' GLU . 0.4 OUTLIER 80.79 -41.41 0.18 Allowed 'General case' 0 N--CA 1.471 0.616 0 O-C-N 123.793 0.683 . . . . 0.0 111.999 179.859 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 65.2 t30 -60.75 -39.26 88.07 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.558 -0.457 . . . . 0.0 109.961 179.666 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 16.8 pm0 -117.51 162.32 18.17 Favored 'General case' 0 CA--C 1.513 -0.464 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.62 178.847 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.511 ' HB2' ' HB2' ' A' ' 71' ' ' ALA . 99.2 mttt -99.73 136.27 39.9 Favored 'General case' 0 N--CA 1.431 -1.397 0 N-CA-C 108.43 -0.952 . . . . 0.0 108.43 177.613 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . 0.736 ' HB2' ' HB3' ' A' ' 28' ' ' TYR . . . -49.44 160.53 0.25 Allowed 'General case' 0 C--N 1.311 -1.107 0 CA-C-N 115.265 -0.879 . . . . 0.0 109.183 -179.687 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . 0.412 ' H ' ' HB2' ' A' ' 41' ' ' LYS . 84.7 p -146.84 169.14 19.73 Favored 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 108.735 -0.839 . . . . 0.0 108.735 179.678 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.61 HD22 ' HA ' ' A' ' 53' ' ' ALA . 86.5 mt -60.53 -39.78 89.1 Favored 'General case' 0 C--N 1.314 -0.946 0 C-N-CA 118.508 -1.277 . . . . 0.0 108.414 179.672 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 75.4 m -64.6 -40.72 96.01 Favored 'General case' 0 C--N 1.319 -0.734 0 C-N-CA 120.459 -0.497 . . . . 0.0 111.948 178.621 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . 0.412 ' HB2' ' H ' ' A' ' 38' ' ' SER . 99.3 mttt -74.86 -54.16 7.78 Favored 'General case' 0 N--CA 1.472 0.67 0 N-CA-C 114.232 1.197 . . . . 0.0 114.232 -177.389 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.495 ' HG ' ' HB1' ' A' ' 37' ' ' ALA . 87.6 mt -59.79 -34.83 73.54 Favored 'General case' 0 CA--C 1.485 -1.533 0 N-CA-C 108.549 -0.908 . . . . 0.0 108.549 -175.853 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.539 HG23 ' O ' ' A' ' 48' ' ' ILE . 0.3 OUTLIER -80.99 -28.8 11.19 Favored 'Isoleucine or valine' 0 N--CA 1.405 -2.679 0 CA-C-N 114.051 -1.431 . . . . 0.0 112.136 -176.852 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . 0.563 ' C ' ' H ' ' A' ' 46' ' ' GLY . 48.0 t -63.11 -49.93 72.5 Favored 'General case' 0 N--CA 1.428 -1.546 0 N-CA-C 103.922 -2.622 . . . . 0.0 103.922 176.337 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . 0.455 ' O ' ' N ' ' A' ' 47' ' ' ASN . 63.0 m -51.49 -1.16 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.914 0 CA-C-N 112.278 -2.237 . . . . 0.0 112.744 171.362 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . 0.563 ' H ' ' C ' ' A' ' 44' ' ' SER . . . 29.27 28.36 0.01 OUTLIER Glycine 0 C--N 1.343 0.969 0 C-N-CA 126.082 1.801 . . . . 0.0 115.174 -172.834 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . 0.455 ' N ' ' O ' ' A' ' 45' ' ' SER . 39.7 t-20 -61.62 -42.52 98.99 Favored 'General case' 0 CA--C 1.512 -0.491 0 N-CA-C 104.225 -2.509 . . . . 0.0 104.225 175.571 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.539 ' O ' HG23 ' A' ' 43' ' ' VAL . 16.3 pt -118.22 136.02 56.73 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.023 0 CA-C-N 111.695 -2.502 . . . . 0.0 107.791 176.443 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 84.6 p -79.94 159.87 26.17 Favored 'General case' 0 C--N 1.317 -0.829 0 C-N-CA 119.666 -0.814 . . . . 0.0 110.45 -179.337 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.515 ' HA ' ' HB3' ' A' ' 53' ' ' ALA . 60.7 tp60 -57.86 -8.16 0.9 Allowed 'General case' 0 CA--C 1.546 0.79 0 CA-C-N 115.95 -0.568 . . . . 0.0 112.023 -179.69 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 10.9 ptmt -78.83 -43.87 24.26 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 103.956 -2.609 . . . . 0.0 103.956 176.491 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . 0.755 ' HG2' HG21 ' A' ' 20' ' ' VAL . 3.7 mt-30 -68.37 -47.6 66.98 Favored 'General case' 0 N--CA 1.429 -1.49 0 CA-C-N 112.724 -2.034 . . . . 0.0 108.411 176.315 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.61 ' HA ' HD22 ' A' ' 39' ' ' LEU . . . -63.78 -43.7 95.56 Favored 'General case' 0 C--N 1.343 0.284 0 C-N-CA 119.412 -0.915 . . . . 0.0 111.309 -178.384 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 98.0 m-20 -62.37 -29.31 70.38 Favored 'General case' 0 C--N 1.319 -0.756 0 C-N-CA 120.22 -0.592 . . . . 0.0 110.641 178.906 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . 0.769 ' O ' ' HB3' ' A' ' 58' ' ' ALA . 47.5 t -64.47 -39.22 93.4 Favored 'General case' 0 N--CA 1.44 -0.939 0 CA-C-N 115.452 -0.795 . . . . 0.0 110.659 178.211 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . 0.564 ' HB3' HD21 ' A' ' 39' ' ' LEU . 0.4 OUTLIER -72.62 -40.22 66.62 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 118.886 -1.126 . . . . 0.0 111.606 -178.515 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -57.68 -28.83 64.13 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 107.275 -1.38 . . . . 0.0 107.275 176.334 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.769 ' HB3' ' O ' ' A' ' 55' ' ' SER . . . -66.63 -39.67 88.4 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 112.606 -2.088 . . . . 0.0 109.694 175.937 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 89.9 t80 -66.35 -45.66 79.42 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-O 121.113 0.482 . . . . 0.0 110.754 177.211 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.609 ' CE1' HG22 ' A' ' 67' ' ' THR . 1.4 t80 -59.95 -46.54 89.09 Favored 'General case' 0 CA--C 1.511 -0.542 0 N-CA-C 106.944 -1.502 . . . . 0.0 106.944 176.466 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -54.53 -41.72 74.0 Favored Glycine 0 C--N 1.309 -0.936 0 CA-C-N 112.05 -2.341 . . . . 0.0 112.105 179.585 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 41.0 ttmt -58.27 -45.88 87.05 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 112.429 0.529 . . . . 0.0 112.429 -178.386 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 79.5 m80 -114.75 118.12 32.7 Favored 'General case' 0 N--CA 1.465 0.303 0 C-N-CA 120.511 -0.476 . . . . 0.0 111.721 -179.143 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 47.5 t -64.64 -50.22 67.97 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.289 0.566 . . . . 0.0 111.236 179.042 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -63.42 -39.72 98.06 Favored Glycine 0 N--CA 1.46 0.288 0 CA-C-N 115.042 -0.981 . . . . 0.0 111.639 -179.202 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 46.6 tp10 -97.06 121.66 39.2 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.444 -0.378 . . . . 0.0 110.7 -178.961 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . 0.609 HG22 ' CE1' ' A' ' 60' ' ' TYR . 78.2 p -123.42 142.9 50.52 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 120.446 -0.501 . . . . 0.0 111.203 -179.277 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . 0.647 ' NE2' ' H ' ' A' ' 70' ' ' VAL . 0.1 OUTLIER -117.62 -86.93 0.63 Allowed 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 115.279 1.585 . . . . 0.0 115.279 -176.261 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.488 ' CB ' ' HB3' ' A' ' 72' ' ' ASN . 0.3 OUTLIER 30.96 34.47 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.595 0 C-N-CA 123.867 0.867 . . . . 0.0 111.718 -176.121 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.973 HG11 ' HB1' ' A' ' 25' ' ' ALA . 0.0 OUTLIER 56.21 -80.8 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.426 0 C-N-CA 125.018 1.327 . . . . 0.0 108.621 -177.488 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . 0.511 ' HB2' ' HB2' ' A' ' 36' ' ' LYS . . . -63.71 -16.7 61.77 Favored 'General case' 0 N--CA 1.431 -1.382 0 C-N-CA 120.646 -0.422 . . . . 0.0 110.478 177.977 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . 0.488 ' HB3' ' CB ' ' A' ' 69' ' ' THR . 20.2 t30 . . . . . 0 N--CA 1.478 0.95 0 CA-C-O 118.367 -0.825 . . . . 0.0 110.362 -179.122 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 56.3 t30 . . . . . 0 N--CA 1.491 1.613 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 86.9 mt -113.36 136.6 52.58 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.189 179.669 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 65.7 p -131.68 159.64 37.78 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.749 179.952 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 30.3 mtpp -73.38 144.01 46.6 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.264 179.644 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 72.2 tp60 -123.63 128.56 49.85 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.729 179.946 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 68.7 mttm -128.25 145.96 50.89 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.418 179.725 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 67.8 t0 -133.69 -70.83 0.52 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.427 179.957 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -153.15 158.76 42.29 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.531 -179.655 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 8.4 p -57.09 -30.16 33.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.143 179.907 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 42.0 t -123.23 132.96 54.23 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.902 -0.59 . . . . 0.0 109.883 179.403 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 53.8 p-10 -82.42 -179.71 7.51 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.91 0.386 . . . . 0.0 111.53 -179.354 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 94.0 m -119.26 130.03 55.22 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.247 179.906 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . 0.705 ' HA3' ' HB3' ' A' ' 16' ' ' ALA . . . -92.63 124.2 7.62 Favored Glycine 0 CA--C 1.509 -0.336 0 C-N-CA 120.771 -0.728 . . . . 0.0 111.785 -179.635 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.676 ' O ' HG12 ' A' ' 17' ' ' VAL . 6.1 t -75.38 -53.51 8.59 Favored 'General case' 0 N--CA 1.444 -0.745 0 N-CA-C 107.133 -1.432 . . . . 0.0 107.133 177.43 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.471 ' N ' HG23 ' A' ' 14' ' ' THR . . . -68.02 -40.63 82.92 Favored 'General case' 0 N--CA 1.446 -0.643 0 CA-C-O 121.739 0.78 . . . . 0.0 109.641 176.404 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . 0.705 ' HB3' ' HA3' ' A' ' 13' ' ' GLY . . . -62.14 -39.8 93.83 Favored 'General case' 0 N--CA 1.444 -0.73 0 CA-C-N 114.846 -1.07 . . . . 0.0 110.535 -179.274 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . 0.676 HG12 ' O ' ' A' ' 14' ' ' THR . 11.8 p -62.66 -31.99 54.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 C-N-CA 117.873 -1.531 . . . . 0.0 110.646 -178.879 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 62.9 t -60.08 -46.4 94.39 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.743 0 N-CA-C 108.764 -0.828 . . . . 0.0 108.764 -179.084 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 40.2 ttpt -63.66 -38.38 90.91 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 115.043 1.497 . . . . 0.0 115.043 -179.612 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.491 HG23 ' N ' ' A' ' 21' ' ' VAL . 27.0 m -78.25 -54.38 12.31 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.306 0 N-CA-C 113.835 1.05 . . . . 0.0 113.835 -177.214 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . 0.491 ' N ' HG23 ' A' ' 20' ' ' VAL . 62.3 t -62.13 -43.75 98.18 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.764 0 C-N-CA 119.705 -0.798 . . . . 0.0 111.163 -178.274 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -65.27 -32.25 73.82 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 112.821 0.674 . . . . 0.0 112.821 -179.417 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 87.5 p -75.88 -47.64 24.63 Favored 'General case' 0 C--O 1.231 0.107 0 C-N-CA 119.671 -0.811 . . . . 0.0 111.744 179.306 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.513 ' HB3' HD22 ' A' ' 42' ' ' LEU . 17.4 mp0 -72.07 -39.38 69.05 Favored 'General case' 0 C--O 1.22 -0.467 0 N-CA-C 112.183 0.438 . . . . 0.0 112.183 178.597 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -58.7 -41.46 86.36 Favored 'General case' 0 CA--C 1.512 -0.501 0 CA-C-O 121.422 0.629 . . . . 0.0 109.359 -177.321 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 54.0 tp10 -60.5 -46.66 89.29 Favored 'General case' 0 C--N 1.318 -0.775 0 N-CA-C 107.595 -1.261 . . . . 0.0 107.595 178.837 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 57.7 tp -64.23 -39.58 94.26 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.444 -0.798 . . . . 0.0 112.539 -179.086 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . 0.562 ' HD2' ' HB2' ' A' ' 37' ' ' ALA . 73.2 t80 -62.44 -44.08 97.28 Favored 'General case' 0 CA--C 1.505 -0.77 0 N-CA-C 106.4 -1.704 . . . . 0.0 106.4 179.305 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 93.3 mt-10 -60.25 -37.74 81.31 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 114.818 -1.083 . . . . 0.0 108.939 178.627 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 66.5 tp -61.88 -47.98 82.56 Favored 'General case' 0 N--CA 1.435 -1.175 0 C-N-CA 117.975 -1.49 . . . . 0.0 107.153 177.908 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -50.54 -50.75 52.52 Favored 'General case' 0 CA--C 1.519 -0.229 0 CA-C-N 115.543 -0.753 . . . . 0.0 109.473 177.529 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 82.2 m-20 -129.41 109.08 10.78 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 114.621 -1.172 . . . . 0.0 110.116 179.256 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 10.2 t -94.16 -15.64 24.45 Favored 'General case' 0 C--N 1.324 -0.529 0 C-N-CA 120.645 -0.422 . . . . 0.0 111.864 -179.149 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 28.6 m120 -60.81 -39.67 89.81 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.116 0.484 . . . . 0.0 109.831 -179.598 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 95.0 mt-10 -124.22 150.66 45.02 Favored 'General case' 0 CA--C 1.507 -0.699 0 N-CA-C 108.581 -0.896 . . . . 0.0 108.581 179.189 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 49.4 mmtm -89.03 137.82 31.97 Favored 'General case' 0 N--CA 1.43 -1.457 0 C-N-CA 118.567 -1.253 . . . . 0.0 108.906 178.122 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . 0.562 ' HB2' ' HD2' ' A' ' 28' ' ' TYR . . . -49.46 179.77 0.01 OUTLIER 'General case' 0 C--N 1.314 -0.964 0 CA-C-N 114.873 -1.058 . . . . 0.0 110.643 -179.949 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . 0.41 ' H ' ' HB2' ' A' ' 41' ' ' LYS . 76.4 p -153.04 170.66 19.91 Favored 'General case' 0 C--N 1.315 -0.929 0 N-CA-C 108.546 -0.909 . . . . 0.0 108.546 178.419 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.725 HD21 ' HB3' ' A' ' 56' ' ' TYR . 87.7 mt -60.84 -43.08 98.77 Favored 'General case' 0 C--N 1.312 -1.047 0 N-CA-C 107.748 -1.204 . . . . 0.0 107.748 179.689 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 74.7 m -63.08 -40.44 97.68 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.488 -0.778 . . . . 0.0 112.298 179.562 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . 0.41 ' HB2' ' H ' ' A' ' 38' ' ' SER . 68.4 mttm -63.55 -48.72 76.34 Favored 'General case' 0 N--CA 1.47 0.567 0 N-CA-C 113.43 0.9 . . . . 0.0 113.43 -177.988 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.513 HD22 ' HB3' ' A' ' 24' ' ' GLN . 92.3 mt -60.98 -35.32 76.49 Favored 'General case' 0 CA--C 1.494 -1.186 0 N-CA-C 107.405 -1.331 . . . . 0.0 107.405 -177.757 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.654 ' CG2' ' HB2' ' A' ' 53' ' ' ALA . 1.7 t -76.25 -31.73 21.47 Favored 'Isoleucine or valine' 0 N--CA 1.419 -2.017 0 CA-C-N 113.997 -1.456 . . . . 0.0 111.302 -178.952 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . 0.562 ' C ' ' H ' ' A' ' 46' ' ' GLY . 75.0 m -62.34 -51.28 68.26 Favored 'General case' 0 N--CA 1.431 -1.402 0 N-CA-C 104.905 -2.258 . . . . 0.0 104.905 177.398 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . 0.414 ' O ' ' N ' ' A' ' 47' ' ' ASN . 69.9 m -51.75 -4.36 0.02 OUTLIER 'General case' 0 CA--C 1.549 0.929 0 CA-C-N 113.23 -1.804 . . . . 0.0 112.151 170.644 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . 0.562 ' H ' ' C ' ' A' ' 44' ' ' SER . . . 28.75 34.64 0.01 OUTLIER Glycine 0 C--N 1.346 1.106 0 C-N-CA 126.034 1.778 . . . . 0.0 113.6 -172.68 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . 0.414 ' N ' ' O ' ' A' ' 45' ' ' SER . 57.0 t-20 -63.85 -44.7 92.38 Favored 'General case' 0 CA--C 1.513 -0.462 0 N-CA-C 106.113 -1.81 . . . . 0.0 106.113 176.152 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.644 ' O ' HD12 ' A' ' 48' ' ' ILE . 1.2 pp -117.47 160.8 16.75 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.936 0 CA-C-N 111.329 -2.669 . . . . 0.0 108.649 179.829 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 88.6 p -77.73 170.99 15.64 Favored 'General case' 0 N--CA 1.446 -0.65 0 CA-C-O 121.583 0.706 . . . . 0.0 112.089 -178.401 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.405 ' HA ' HG21 ' A' ' 43' ' ' VAL . 3.9 tm0? -57.24 -50.1 73.94 Favored 'General case' 0 N--CA 1.437 -1.121 0 CA-C-N 115.084 -0.962 . . . . 0.0 110.347 -179.782 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.438 ' O ' ' N ' ' A' ' 55' ' ' SER . 64.1 pttt -61.13 -25.9 67.31 Favored 'General case' 0 CA--C 1.479 -1.779 0 O-C-N 120.836 -1.165 . . . . 0.0 110.09 -178.218 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . 0.415 ' HG2' HG21 ' A' ' 20' ' ' VAL . 3.2 tm0? -64.96 -38.14 89.98 Favored 'General case' 0 N--CA 1.423 -1.806 0 N-CA-C 105.146 -2.168 . . . . 0.0 105.146 176.186 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.654 ' HB2' ' CG2' ' A' ' 43' ' ' VAL . . . -66.07 -49.04 69.02 Favored 'General case' 0 C--N 1.349 0.559 0 C-N-CA 118.09 -1.444 . . . . 0.0 110.786 176.522 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 96.2 m-20 -76.0 -13.97 60.23 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 118.986 -1.085 . . . . 0.0 113.628 -178.782 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . 0.772 ' O ' ' HB3' ' A' ' 58' ' ' ALA . 48.8 m -68.27 -38.77 82.07 Favored 'General case' 0 C--N 1.31 -1.13 0 N-CA-C 109.736 -0.468 . . . . 0.0 109.736 179.162 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . 0.725 ' HB3' HD21 ' A' ' 39' ' ' LEU . 1.6 t80 -73.63 -37.22 65.42 Favored 'General case' 0 N--CA 1.465 0.295 0 C-N-CA 117.654 -1.618 . . . . 0.0 108.372 179.603 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -57.96 -30.34 65.93 Favored 'General case' 0 C--O 1.221 -0.439 0 N-CA-C 107.021 -1.474 . . . . 0.0 107.021 175.894 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.772 ' HB3' ' O ' ' A' ' 55' ' ' SER . . . -65.48 -38.79 90.79 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 112.431 -2.168 . . . . 0.0 109.37 176.506 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 83.8 t80 -68.49 -41.46 80.03 Favored 'General case' 0 C--N 1.344 0.33 0 CA-C-O 121.564 0.697 . . . . 0.0 109.325 176.699 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 82.0 t80 -59.23 -40.76 86.88 Favored 'General case' 0 CA--C 1.511 -0.552 0 N-CA-C 106.954 -1.499 . . . . 0.0 106.954 177.196 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -53.24 -39.92 59.33 Favored Glycine 0 N--CA 1.44 -1.08 0 CA-C-N 113.007 -1.906 . . . . 0.0 110.766 -179.731 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 24.6 tptm -57.82 -46.48 84.63 Favored 'General case' 0 C--N 1.33 -0.241 0 C-N-CA 120.916 -0.313 . . . . 0.0 110.547 179.73 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 97.4 m-70 -125.26 107.77 11.06 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-O 121.163 0.506 . . . . 0.0 110.779 179.649 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 47.1 t -62.67 -45.57 92.2 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.598 179.823 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -60.32 -37.54 93.24 Favored Glycine 0 N--CA 1.454 -0.112 0 CA-C-N 115.157 -0.929 . . . . 0.0 110.81 -178.641 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 98.2 mt-10 -83.97 139.89 32.26 Favored 'General case' 0 C--N 1.32 -0.716 0 C-N-CA 120.458 -0.497 . . . . 0.0 110.627 -179.267 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 94.3 m -115.4 122.9 47.24 Favored 'General case' 0 C--N 1.332 -0.194 0 C-N-CA 120.884 -0.326 . . . . 0.0 110.57 179.755 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . 0.435 ' OE1' ' O ' ' A' ' 70' ' ' VAL . 0.8 OUTLIER -38.89 166.75 0.0 OUTLIER 'General case' 0 N--CA 1.453 -0.295 0 CA-C-O 123.348 1.547 . . . . 0.0 114.887 -175.464 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 96.9 m -56.25 -35.51 67.5 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 111.628 -2.533 . . . . 0.0 111.706 -178.128 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.435 ' O ' ' OE1' ' A' ' 68' ' ' GLN . 2.5 p -115.01 162.91 12.77 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.608 0 N-CA-C 108.708 -0.849 . . . . 0.0 108.708 -178.845 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -85.04 99.57 11.11 Favored 'General case' 0 N--CA 1.466 0.342 0 C-N-CA 119.455 -0.898 . . . . 0.0 113.42 -176.216 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 45.1 p30 . . . . . 0 C--O 1.22 -0.492 0 CA-C-O 117.942 -1.027 . . . . 0.0 110.281 177.073 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 17.2 p30 . . . . . 0 N--CA 1.491 1.576 0 N-CA-C 109.399 -0.593 . . . . 0.0 109.399 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . 0.441 ' C ' HG23 ' A' ' 3' ' ' THR . 88.5 mt -113.84 142.06 46.56 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.548 -179.977 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . 0.441 HG23 ' C ' ' A' ' 2' ' ' LEU . 1.3 p 60.22 163.26 0.06 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.172 179.62 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 60.8 tptt -116.84 128.18 55.01 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.279 179.874 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 12.6 mp0 -120.77 177.71 4.98 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.147 0.499 . . . . 0.0 111.713 -179.671 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 98.1 mttt 59.61 51.49 6.35 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.319 -0.855 . . . . 0.0 111.358 179.571 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -61.26 -44.76 96.71 Favored 'General case' 0 C--N 1.319 -0.76 0 C-N-CA 120.592 -0.443 . . . . 0.0 111.314 179.907 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.02 -40.91 97.32 Favored 'General case' 0 N--CA 1.467 0.399 0 N-CA-C 112.363 0.505 . . . . 0.0 112.363 -178.87 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 97.5 t -119.23 128.17 75.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 C-N-CA 121.04 -0.264 . . . . 0.0 110.36 -179.505 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 83.2 p -65.23 157.98 27.42 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.297 0.57 . . . . 0.0 111.129 -178.772 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 53.9 p-10 -83.73 -173.48 4.74 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.292 -0.867 . . . . 0.0 111.217 -179.415 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 99.1 m -60.34 -44.74 95.24 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.107 179.991 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 166.62 -98.31 0.15 Allowed Glycine 0 C--N 1.331 0.259 0 C-N-CA 120.412 -0.899 . . . . 0.0 112.518 179.588 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.613 ' O ' HG12 ' A' ' 17' ' ' VAL . 4.0 m 72.18 -75.11 0.08 Allowed 'General case' 0 N--CA 1.452 -0.375 0 N-CA-C 107.008 -1.479 . . . . 0.0 107.008 -176.706 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -66.97 -39.97 87.36 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 122.57 1.176 . . . . 0.0 108.549 176.078 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -60.61 -36.09 77.73 Favored 'General case' 0 N--CA 1.443 -0.809 0 CA-C-N 113.48 -1.691 . . . . 0.0 109.838 179.515 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . 0.682 HG21 ' HB2' ' A' ' 55' ' ' SER . 0.3 OUTLIER -53.24 -29.72 16.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 C-N-CA 119.827 -0.749 . . . . 0.0 110.195 -178.119 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . 0.401 HG13 ' HE1' ' A' ' 56' ' ' TYR . 53.1 t -70.03 -44.0 78.73 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 N-CA-C 108.745 -0.835 . . . . 0.0 108.745 177.134 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 29.5 tptp -63.57 -44.38 94.24 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 114.58 -1.191 . . . . 0.0 113.551 -179.389 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.725 HG21 ' HG2' ' A' ' 52' ' ' GLN . 34.0 m -66.99 -43.02 89.38 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.181 0 N-CA-C 112.756 0.65 . . . . 0.0 112.756 -176.993 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . 0.569 HG21 ' HB2' ' A' ' 56' ' ' TYR . 53.2 t -62.46 -47.2 94.14 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 C-N-CA 118.82 -1.152 . . . . 0.0 110.999 -179.293 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 79.7 mm-40 -66.02 -39.85 90.56 Favored 'General case' 0 C--N 1.332 -0.192 0 N-CA-C 112.091 0.404 . . . . 0.0 112.091 -179.935 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 48.4 t -63.93 -48.35 76.9 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-O 121.95 0.881 . . . . 0.0 108.887 178.553 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.45 ' HG3' HD22 ' A' ' 42' ' ' LEU . 72.0 tp60 -61.87 -39.28 91.35 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 113.962 -1.472 . . . . 0.0 109.78 179.653 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.843 ' CB ' HG11 ' A' ' 70' ' ' VAL . . . -57.78 -49.98 74.79 Favored 'General case' 0 N--CA 1.447 -0.61 0 N-CA-C 108.277 -1.009 . . . . 0.0 108.277 -178.133 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 88.8 tt0 -65.35 -39.25 92.12 Favored 'General case' 0 CA--C 1.51 -0.565 0 CA-C-N 115.903 -0.59 . . . . 0.0 111.359 179.687 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 61.8 tp -61.39 -42.19 98.32 Favored 'General case' 0 N--CA 1.447 -0.588 0 C-N-CA 119.332 -0.947 . . . . 0.0 108.778 -179.789 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . 0.448 ' HB3' ' HB2' ' A' ' 37' ' ' ALA . 89.8 t80 -60.99 -43.7 98.47 Favored 'General case' 0 N--CA 1.44 -0.946 0 N-CA-C 107.043 -1.466 . . . . 0.0 107.043 178.47 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -61.18 -31.21 70.96 Favored 'General case' 0 N--CA 1.446 -0.649 0 N-CA-C 109.875 -0.417 . . . . 0.0 109.875 178.618 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 67.0 tp -64.63 -48.72 73.81 Favored 'General case' 0 N--CA 1.44 -0.963 0 N-CA-C 106.302 -1.74 . . . . 0.0 106.302 176.91 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 64.5 tttp -51.58 -50.77 59.5 Favored 'General case' 0 CA--C 1.52 -0.185 0 CA-C-N 115.046 -0.979 . . . . 0.0 109.263 177.396 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 98.6 m-20 -129.78 98.96 4.96 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 114.499 -1.228 . . . . 0.0 110.055 179.444 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 12.7 t -76.9 -14.74 59.84 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 112.258 0.466 . . . . 0.0 112.258 -178.926 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 98.9 m-20 -61.3 -43.09 99.46 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 120.559 -0.456 . . . . 0.0 111.836 -178.175 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 99.2 mt-10 -108.1 -173.59 2.32 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.685 0.279 . . . . 0.0 111.112 -178.574 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 14.4 mptt -121.03 120.82 36.5 Favored 'General case' 0 N--CA 1.444 -0.752 0 N-CA-C 107.575 -1.268 . . . . 0.0 107.575 177.332 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . 0.448 ' HB2' ' HB3' ' A' ' 28' ' ' TYR . . . -54.9 149.8 11.0 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-O 121.073 0.464 . . . . 0.0 111.42 -177.729 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . 0.637 ' HB3' ' HB3' ' A' ' 71' ' ' ALA . 89.1 p -137.03 159.18 42.64 Favored 'General case' 0 N--CA 1.444 -0.763 0 CA-C-N 115.079 -0.964 . . . . 0.0 109.766 -179.645 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.543 ' CD2' ' HB1' ' A' ' 53' ' ' ALA . 2.0 tt -52.3 -48.32 65.43 Favored 'General case' 0 C--N 1.311 -1.082 0 CA-C-N 115.248 -0.887 . . . . 0.0 110.296 -178.38 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 47.9 t -62.54 -42.92 99.84 Favored 'General case' 0 C--N 1.313 -0.981 0 CA-C-N 115.243 -0.89 . . . . 0.0 110.61 179.456 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 29.1 mtpp -65.52 -49.91 67.21 Favored 'General case' 0 CA--C 1.513 -0.473 0 N-CA-C 114.052 1.13 . . . . 0.0 114.052 -177.777 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.521 HD11 ' HA ' ' A' ' 25' ' ' ALA . 98.0 mt -61.1 -40.03 92.2 Favored 'General case' 0 CA--C 1.485 -1.549 0 CA-C-O 122.499 1.142 . . . . 0.0 108.08 -176.298 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -72.27 -45.37 61.54 Favored 'Isoleucine or valine' 0 N--CA 1.402 -2.862 0 CA-C-N 112.302 -2.226 . . . . 0.0 111.038 -172.48 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . 0.531 ' C ' ' H ' ' A' ' 46' ' ' GLY . 46.7 t -61.25 -47.83 84.22 Favored 'General case' 0 N--CA 1.419 -2.023 0 C-N-CA 116.101 -2.239 . . . . 0.0 105.993 177.574 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . 0.416 ' O ' ' N ' ' A' ' 47' ' ' ASN . 33.4 t -49.91 6.75 0.0 OUTLIER 'General case' 0 N--CA 1.479 1.023 0 CA-C-N 113.844 -1.526 . . . . 0.0 114.47 173.148 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . 0.531 ' H ' ' C ' ' A' ' 44' ' ' SER . . . 28.83 37.4 0.01 OUTLIER Glycine 0 C--N 1.346 1.136 0 C-N-CA 124.479 1.037 . . . . 0.0 113.428 -173.437 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . 0.416 ' N ' ' O ' ' A' ' 45' ' ' SER . 21.6 m120 -66.72 -38.78 87.39 Favored 'General case' 0 CA--C 1.512 -0.493 0 N-CA-C 106.724 -1.584 . . . . 0.0 106.724 173.339 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.416 HG23 ' HG2' ' A' ' 24' ' ' GLN . 11.2 pt -137.09 -166.5 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.44 -0.967 0 CA-C-N 112.259 -2.246 . . . . 0.0 107.251 179.302 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 84.8 p -127.99 148.73 50.54 Favored 'General case' 0 C--N 1.321 -0.631 0 C-N-CA 119.986 -0.686 . . . . 0.0 110.639 178.938 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.734 ' HA ' ' HB3' ' A' ' 53' ' ' ALA . 9.3 mt-30 -54.11 0.47 0.02 OUTLIER 'General case' 0 C--O 1.214 -0.768 0 N-CA-C 114.577 1.325 . . . . 0.0 114.577 -177.133 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.413 ' CG ' ' N ' ' A' ' 52' ' ' GLN . 62.8 pttt -77.06 -41.74 41.13 Favored 'General case' 0 C--N 1.313 -1.008 0 N-CA-C 103.679 -2.712 . . . . 0.0 103.679 175.934 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . 0.725 ' HG2' HG21 ' A' ' 20' ' ' VAL . 11.3 mt-30 -71.2 -53.43 14.44 Favored 'General case' 0 N--CA 1.423 -1.823 0 CA-C-N 111.891 -2.413 . . . . 0.0 107.829 176.312 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.734 ' HB3' ' HA ' ' A' ' 50' ' ' GLN . . . -62.66 -40.73 97.99 Favored 'General case' 0 C--O 1.216 -0.678 0 N-CA-C 112.962 0.727 . . . . 0.0 112.962 -177.088 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -62.54 -39.53 93.92 Favored 'General case' 0 C--N 1.311 -1.106 0 C-N-CA 118.709 -1.197 . . . . 0.0 113.319 -178.651 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . 0.682 ' HB2' HG21 ' A' ' 17' ' ' VAL . 75.8 m -65.44 -42.04 92.81 Favored 'General case' 0 C--N 1.316 -0.888 0 C-N-CA 118.987 -1.085 . . . . 0.0 110.555 179.575 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . 0.569 ' HB2' HG21 ' A' ' 21' ' ' VAL . 3.1 t80 -72.65 -30.41 64.26 Favored 'General case' 0 C--N 1.334 -0.102 0 C-N-CA 118.988 -1.085 . . . . 0.0 109.405 -179.058 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -61.21 -37.24 82.3 Favored 'General case' 0 CA--C 1.501 -0.925 0 N-CA-C 108.186 -1.042 . . . . 0.0 108.186 177.59 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -65.86 -20.27 66.17 Favored 'General case' 0 N--CA 1.434 -1.24 0 CA-C-N 114.558 -1.201 . . . . 0.0 109.714 178.463 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 88.4 t80 -64.47 -46.51 82.76 Favored 'General case' 0 CA--C 1.531 0.22 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 176.083 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.418 ' HD1' ' HG1' ' A' ' 67' ' ' THR . 61.3 t80 -62.14 -50.0 73.6 Favored 'General case' 0 C--N 1.348 0.502 0 CA-C-O 122.253 1.025 . . . . 0.0 109.873 176.187 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -55.06 -50.17 60.05 Favored Glycine 0 CA--C 1.529 0.955 0 CA-C-N 113.404 -1.726 . . . . 0.0 114.338 -178.114 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 27.4 ttpp -59.09 -43.02 91.79 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 112.736 0.643 . . . . 0.0 112.736 -177.586 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 76.2 m80 -99.37 155.36 17.57 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.173 0.511 . . . . 0.0 111.894 -178.13 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 68.8 m -119.87 147.81 44.25 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.46 -0.791 . . . . 0.0 109.368 177.848 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 80.63 2.08 89.54 Favored Glycine 0 CA--C 1.528 0.895 0 N-CA-C 110.07 -1.212 . . . . 0.0 110.07 -179.064 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -146.81 167.85 22.86 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-O 120.681 0.277 . . . . 0.0 110.352 -179.913 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . 0.418 ' HG1' ' HD1' ' A' ' 60' ' ' TYR . 14.7 t -143.9 -150.33 0.31 Allowed 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.714 -178.055 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . 0.407 ' N ' HG23 ' A' ' 67' ' ' THR . 0.0 OUTLIER -95.41 158.27 15.53 Favored 'General case' 0 CA--C 1.534 0.333 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 177.699 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 98.9 m -57.38 -40.06 77.35 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 113.195 0.813 . . . . 0.0 113.195 -176.936 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.843 HG11 ' CB ' ' A' ' 25' ' ' ALA . 13.4 m -84.1 -156.61 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.517 0 C-N-CA 118.59 -1.244 . . . . 0.0 111.212 -179.339 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . 0.637 ' HB3' ' HB3' ' A' ' 38' ' ' SER . . . -61.48 -38.35 86.95 Favored 'General case' 0 N--CA 1.437 -1.088 0 C-N-CA 119.108 -1.037 . . . . 0.0 112.444 -176.438 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 15.0 t-20 . . . . . 0 C--O 1.219 -0.521 0 CA-C-O 117.895 -1.05 . . . . 0.0 111.335 179.97 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 14.6 t-20 . . . . . 0 N--CA 1.491 1.585 0 N-CA-C 109.286 -0.635 . . . . 0.0 109.286 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 86.2 mt -109.81 137.1 48.09 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.464 -0.334 . . . . 0.0 110.48 -179.854 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 70.5 p -69.51 -33.5 72.92 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.402 179.693 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -138.63 127.79 24.15 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 109.349 -0.612 . . . . 0.0 109.349 179.444 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 54.1 tt0 -147.36 142.49 27.15 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.983 0.42 . . . . 0.0 111.447 -178.778 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 68.7 mttm -116.65 138.54 51.37 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 109.021 -0.733 . . . . 0.0 109.021 178.836 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . 0.482 ' OD1' HG22 ' A' ' 9' ' ' VAL . 68.2 t0 -119.28 111.17 17.86 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.155 0.502 . . . . 0.0 111.161 -178.535 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.53 -39.18 90.12 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.328 179.886 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.482 HG22 ' OD1' ' A' ' 7' ' ' ASP . 35.1 m -87.87 29.83 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.261 0 N-CA-C 112.023 0.379 . . . . 0.0 112.023 -178.593 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 65.9 m -60.73 -39.04 87.15 Favored 'General case' 0 C--N 1.331 -0.222 0 C-N-CA 120.908 -0.317 . . . . 0.0 110.34 179.4 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 98.9 m-20 -59.06 143.51 48.29 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.003 0.43 . . . . 0.0 110.456 -179.461 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 67.5 p -100.14 10.56 41.08 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.756 -0.656 . . . . 0.0 111.365 -179.085 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -77.46 -133.76 0.66 Allowed Glycine 0 C--N 1.331 0.304 0 C-N-CA 120.593 -0.813 . . . . 0.0 111.358 -179.607 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.647 ' O ' HG12 ' A' ' 17' ' ' VAL . 3.0 m 75.16 -67.85 0.23 Allowed 'General case' 0 CA--C 1.515 -0.389 0 N-CA-C 106.676 -1.601 . . . . 0.0 106.676 -177.094 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -66.29 -38.9 88.84 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 122.044 0.926 . . . . 0.0 108.744 176.355 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -60.32 -37.3 80.17 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-N 114.32 -1.309 . . . . 0.0 110.036 179.894 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . 0.856 HG21 ' HB2' ' A' ' 55' ' ' SER . 0.8 OUTLIER -54.09 -31.75 21.99 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 C-N-CA 119.296 -0.962 . . . . 0.0 109.599 -178.275 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 66.1 t -64.11 -46.88 92.42 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 N-CA-C 107.699 -1.222 . . . . 0.0 107.699 177.641 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 41.0 ttmt -60.37 -44.39 95.64 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-N 114.064 -1.426 . . . . 0.0 113.482 -177.997 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.613 HG21 ' CG ' ' A' ' 52' ' ' GLN . 28.5 m -68.14 -49.7 65.16 Favored 'Isoleucine or valine' 0 N--CA 1.46 0.055 0 CA-C-N 118.833 0.742 . . . . 0.0 111.827 -178.59 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . 0.682 HG21 ' HB2' ' A' ' 56' ' ' TYR . 54.0 t -61.23 -47.78 91.94 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.851 0 C-N-CA 119.846 -0.742 . . . . 0.0 111.529 -177.954 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -68.46 -29.83 68.56 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 112.605 0.595 . . . . 0.0 112.605 -179.247 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 70.9 m -73.45 -50.79 19.82 Favored 'General case' 0 N--CA 1.464 0.249 0 C-N-CA 119.771 -0.771 . . . . 0.0 109.351 177.732 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 99.8 mm-40 -65.04 -37.7 88.43 Favored 'General case' 0 C--O 1.217 -0.649 0 CA-C-N 114.648 -1.16 . . . . 0.0 109.595 179.953 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.7 ' HB1' ' HB ' ' A' ' 70' ' ' VAL . . . -55.37 -44.95 76.52 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 108.126 -1.064 . . . . 0.0 108.126 -177.872 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 88.9 tt0 -66.61 -38.45 87.0 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.451 -0.795 . . . . 0.0 110.803 178.364 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 66.5 tp -63.75 -45.82 88.14 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.17 -0.923 . . . . 0.0 109.937 179.392 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . 0.582 ' CD2' ' HB2' ' A' ' 37' ' ' ALA . 38.8 t80 -65.94 -40.05 91.01 Favored 'General case' 0 N--CA 1.441 -0.917 0 N-CA-C 107.261 -1.385 . . . . 0.0 107.261 -178.919 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 95.6 mt-10 -72.91 -10.85 60.25 Favored 'General case' 0 N--CA 1.441 -0.884 0 CA-C-N 115.083 -0.962 . . . . 0.0 110.287 177.432 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.404 ' HA ' HD12 ' A' ' 30' ' ' LEU . 62.7 tp -69.15 -48.22 62.92 Favored 'General case' 0 N--CA 1.437 -1.103 0 N-CA-C 104.25 -2.5 . . . . 0.0 104.25 174.843 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 64.9 tttp -51.5 -48.44 62.91 Favored 'General case' 0 CA--C 1.509 -0.629 0 CA-C-N 113.519 -1.673 . . . . 0.0 108.164 176.174 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 98.7 m-20 -128.6 94.56 3.9 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-N 114.492 -1.231 . . . . 0.0 110.738 -179.969 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 68.8 p -83.51 -15.37 49.62 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 120.882 -0.327 . . . . 0.0 111.429 -179.308 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 98.5 m-20 -95.01 4.03 54.24 Favored 'General case' 0 C--N 1.33 -0.248 0 C-N-CA 120.83 -0.348 . . . . 0.0 110.746 179.499 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 94.1 mt-10 -134.33 157.89 45.21 Favored 'General case' 0 CA--C 1.509 -0.599 0 N-CA-C 109.329 -0.619 . . . . 0.0 109.329 179.925 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 14.7 mptt -100.09 137.82 38.0 Favored 'General case' 0 N--CA 1.437 -1.104 0 N-CA-C 106.859 -1.534 . . . . 0.0 106.859 176.129 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . 0.582 ' HB2' ' CD2' ' A' ' 28' ' ' TYR . . . -85.98 -156.06 0.27 Allowed 'General case' 0 C--N 1.316 -0.85 0 N-CA-C 107.724 -1.213 . . . . 0.0 107.724 177.73 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . 0.465 ' H ' ' HB2' ' A' ' 41' ' ' LYS . 79.0 p -160.91 168.92 23.66 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 175.96 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.554 ' HB3' ' HB1' ' A' ' 53' ' ' ALA . 72.7 mt -59.88 -46.8 88.18 Favored 'General case' 0 C--N 1.316 -0.885 0 C-N-CA 119.374 -0.93 . . . . 0.0 109.541 179.727 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 91.9 p -60.38 -34.42 73.87 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 120.431 -0.507 . . . . 0.0 109.682 179.858 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . 0.465 ' HB2' ' H ' ' A' ' 38' ' ' SER . 98.0 mttt -69.33 -36.77 77.26 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-O 121.078 0.465 . . . . 0.0 111.014 178.274 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.445 HD23 ' HA ' ' A' ' 42' ' ' LEU . 87.2 mt -69.25 -35.86 76.55 Favored 'General case' 0 CA--C 1.496 -1.102 0 CA-C-N 115.47 -0.787 . . . . 0.0 109.267 179.896 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.778 HG21 ' HA ' ' A' ' 50' ' ' GLN . 0.3 OUTLIER -80.27 -34.96 15.18 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.713 0 C-N-CA 119.264 -0.974 . . . . 0.0 110.908 -176.641 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . 0.548 ' C ' ' H ' ' A' ' 46' ' ' GLY . 47.9 t -59.24 -51.15 71.22 Favored 'General case' 0 N--CA 1.431 -1.39 0 N-CA-C 104.635 -2.357 . . . . 0.0 104.635 179.691 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . 0.433 ' O ' ' N ' ' A' ' 47' ' ' ASN . 24.7 p -54.41 12.65 0.0 OUTLIER 'General case' 0 CA--C 1.558 1.264 0 CA-C-N 113.926 -1.488 . . . . 0.0 113.677 170.429 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . 0.548 ' H ' ' C ' ' A' ' 44' ' ' SER . . . 28.59 33.78 0.01 OUTLIER Glycine 0 C--N 1.347 1.171 0 C-N-CA 125.201 1.382 . . . . 0.0 114.486 -173.161 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . 0.433 ' N ' ' O ' ' A' ' 45' ' ' SER . 19.1 m120 -66.95 -40.82 87.62 Favored 'General case' 0 CA--C 1.52 -0.186 0 CA-C-O 122.329 1.062 . . . . 0.0 109.138 174.519 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.594 ' O ' HG23 ' A' ' 43' ' ' VAL . 23.4 pt -137.37 164.76 28.63 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-N 113.098 -1.865 . . . . 0.0 111.716 -177.447 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 67.6 m -76.48 155.75 33.57 Favored 'General case' 0 N--CA 1.439 -0.983 0 N-CA-C 107.524 -1.287 . . . . 0.0 107.524 178.192 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.778 ' HA ' HG21 ' A' ' 43' ' ' VAL . 71.5 tp60 -56.88 -46.4 81.91 Favored 'General case' 0 C--O 1.202 -1.401 0 C-N-CA 119.697 -0.801 . . . . 0.0 109.801 -179.163 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 21.9 pttp -64.11 -30.93 71.96 Favored 'General case' 0 CA--C 1.501 -0.939 0 CA-C-N 119.089 0.858 . . . . 0.0 110.709 -179.248 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . 0.613 ' CG ' HG21 ' A' ' 20' ' ' VAL . 33.5 tt0 -66.5 -38.14 86.59 Favored 'General case' 0 N--CA 1.421 -1.875 0 N-CA-C 103.639 -2.726 . . . . 0.0 103.639 177.437 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.603 ' HB3' ' O ' ' A' ' 50' ' ' GLN . . . -65.96 -51.84 54.91 Favored 'General case' 0 N--CA 1.443 -0.777 0 CA-C-N 114.413 -1.267 . . . . 0.0 110.315 177.822 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 98.2 m-20 -58.11 -47.0 84.59 Favored 'General case' 0 CA--C 1.504 -0.805 0 C-N-CA 120.291 -0.563 . . . . 0.0 112.119 -177.172 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . 0.856 ' HB2' HG21 ' A' ' 17' ' ' VAL . 74.2 m -53.8 -36.06 62.06 Favored 'General case' 0 N--CA 1.436 -1.172 0 C-N-CA 119.312 -0.955 . . . . 0.0 110.724 -177.282 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . 0.682 ' HB2' HG21 ' A' ' 21' ' ' VAL . 8.3 t80 -70.16 -41.51 73.73 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 116.996 -1.882 . . . . 0.0 109.052 176.984 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -47.92 -44.39 29.81 Favored 'General case' 0 CA--C 1.498 -1.042 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.22 -175.912 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -59.64 -51.28 70.5 Favored 'General case' 0 N--CA 1.434 -1.234 0 N-CA-C 106.959 -1.497 . . . . 0.0 106.959 179.432 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 91.9 t80 -48.92 -45.66 41.82 Favored 'General case' 0 N--CA 1.466 0.356 0 N-CA-C 109.583 -0.525 . . . . 0.0 109.583 -177.236 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -58.53 -43.33 89.19 Favored 'General case' 0 CA--C 1.508 -0.663 0 N-CA-C 108.208 -1.034 . . . . 0.0 108.208 175.791 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -53.63 -43.81 68.47 Favored Glycine 0 CA--C 1.535 1.321 0 CA-C-N 114.159 -1.382 . . . . 0.0 111.93 -179.889 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -58.48 -38.88 78.52 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 112.33 0.493 . . . . 0.0 112.33 -179.857 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' HIS . . . . . 0.419 ' HB2' ' O ' ' A' ' 66' ' ' GLU . 0.6 OUTLIER -37.78 165.0 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.44 0 N-CA-C 114.229 1.196 . . . . 0.0 114.229 -176.668 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 30.1 t -118.72 -76.03 0.58 Allowed 'General case' 0 CA--C 1.537 0.448 0 CA-C-N 114.453 -1.248 . . . . 0.0 111.506 179.182 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -101.14 4.19 55.41 Favored Glycine 0 CA--C 1.537 1.456 0 C-N-CA 121.173 -0.537 . . . . 0.0 114.127 -178.098 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . 0.419 ' O ' ' HB2' ' A' ' 63' ' ' HIS . 24.7 pt-20 -150.06 161.81 41.63 Favored 'General case' 0 C--O 1.216 -0.708 0 CA-C-N 118.39 1.095 . . . . 0.0 111.245 -179.425 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . 0.435 ' O ' ' O ' ' A' ' 68' ' ' GLN . 69.6 p -125.94 153.85 43.67 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 120.574 -0.45 . . . . 0.0 109.808 179.96 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . 0.472 ' HB3' ' HE2' ' A' ' 56' ' ' TYR . 21.6 pt20 -42.95 -178.97 0.0 OUTLIER 'General case' 0 C--N 1.344 0.361 0 CA-C-O 122.715 1.245 . . . . 0.0 114.187 -178.266 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 98.0 m -61.52 -39.3 90.51 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 113.772 -1.558 . . . . 0.0 111.778 178.771 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.7 ' HB ' ' HB1' ' A' ' 25' ' ' ALA . 7.4 p -109.23 144.88 16.75 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.642 0 CA-C-O 121.404 0.621 . . . . 0.0 111.68 -177.512 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -70.05 76.26 0.49 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.532 -178.446 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.469 0.505 0 CA-C-O 117.962 -1.018 . . . . 0.0 111.482 179.707 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 99.1 m-20 . . . . . 0 N--CA 1.491 1.605 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 66.8 tp -108.21 124.06 49.71 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.353 179.99 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 2.6 m 75.55 -49.9 0.63 Allowed 'General case' 0 N--CA 1.468 0.433 0 O-C-N 123.702 0.626 . . . . 0.0 111.538 179.93 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 64.0 tttm -60.42 -44.85 95.35 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.909 -0.316 . . . . 0.0 110.725 -179.706 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 64.7 tt0 -129.71 127.11 39.79 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.935 0.398 . . . . 0.0 111.006 179.88 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 74.1 mmtt -63.58 -39.23 93.86 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.454 179.563 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 52.8 t0 56.24 43.89 25.8 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.547 -179.734 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . 62.2 151.37 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.211 179.526 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 7.9 p -63.89 -28.76 45.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.328 179.587 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 5.2 t 67.54 47.15 1.25 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.127 179.815 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 99.1 m-20 -65.56 146.41 54.88 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.387 179.354 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 12.0 t -147.45 151.36 36.29 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.969 0.414 . . . . 0.0 110.877 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . 0.468 ' HA3' ' HB3' ' A' ' 16' ' ' ALA . . . -103.72 57.88 0.54 Allowed Glycine 0 CA--C 1.502 -0.731 0 N-CA-C 111.619 -0.593 . . . . 0.0 111.619 179.894 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.709 ' O ' HG12 ' A' ' 17' ' ' VAL . 99.1 m -61.0 -46.19 91.78 Favored 'General case' 0 N--CA 1.438 -1.068 0 N-CA-C 106.28 -1.748 . . . . 0.0 106.28 177.407 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -68.35 -39.87 81.71 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.057 -0.974 . . . . 0.0 110.97 177.282 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . 0.468 ' HB3' ' HA3' ' A' ' 13' ' ' GLY . . . -59.93 -37.18 78.76 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 114.305 -1.316 . . . . 0.0 110.28 -178.419 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . 0.709 HG12 ' O ' ' A' ' 14' ' ' THR . 2.6 p -53.28 -35.64 24.46 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 C-N-CA 119.34 -0.944 . . . . 0.0 109.919 -178.076 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 61.4 t -63.63 -48.48 86.57 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-O 121.635 0.731 . . . . 0.0 109.207 178.936 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -61.93 -43.77 98.16 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 114.637 -1.165 . . . . 0.0 113.587 -178.7 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.673 HG21 ' HG2' ' A' ' 52' ' ' GLN . 28.5 m -71.95 -54.11 17.87 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.186 0 C-N-CA 119.949 -0.7 . . . . 0.0 112.621 -178.321 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . 0.596 HG21 ' HB2' ' A' ' 56' ' ' TYR . 53.2 t -61.1 -45.32 98.8 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.666 0 C-N-CA 119.398 -0.921 . . . . 0.0 111.975 -177.38 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -61.72 -51.64 67.57 Favored 'General case' 0 C--N 1.331 -0.207 0 C-N-CA 118.557 -1.257 . . . . 0.0 109.973 -179.892 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 48.4 t -58.54 -48.73 79.9 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 120.26 -0.576 . . . . 0.0 110.801 -176.771 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 28.3 mm100 -63.97 -40.38 96.26 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.647 0.737 . . . . 0.0 109.186 179.536 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.483 ' HB1' ' HB ' ' A' ' 70' ' ' VAL . . . -57.47 -42.76 83.24 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 114.608 -1.178 . . . . 0.0 110.484 -177.133 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 54.0 tp10 -65.24 -39.12 92.28 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.935 0.874 . . . . 0.0 109.18 178.394 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 53.6 tp -62.2 -44.22 97.08 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 114.316 -1.311 . . . . 0.0 109.622 -179.844 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 55.3 t80 -62.26 -38.85 90.87 Favored 'General case' 0 CA--C 1.504 -0.81 0 N-CA-C 107.475 -1.306 . . . . 0.0 107.475 -179.142 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.44 ' O ' ' N ' ' A' ' 33' ' ' THR . 96.4 mt-10 -59.43 -43.79 93.01 Favored 'General case' 0 N--CA 1.44 -0.926 0 N-CA-C 106.72 -1.585 . . . . 0.0 106.72 178.694 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 64.3 tp -62.46 -43.58 98.47 Favored 'General case' 0 N--CA 1.443 -0.805 0 C-N-CA 118.513 -1.275 . . . . 0.0 108.743 178.387 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -49.03 -49.11 42.75 Favored 'General case' 0 CA--C 1.519 -0.224 0 CA-C-N 115.345 -0.843 . . . . 0.0 110.513 179.759 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 32.5 m120 -109.44 -66.11 1.09 Allowed 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 120.066 -0.654 . . . . 0.0 112.396 -179.356 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.44 ' N ' ' O ' ' A' ' 29' ' ' GLU . 0.2 OUTLIER 79.28 -34.75 0.15 Allowed 'General case' 0 N--CA 1.471 0.582 0 O-C-N 123.653 0.595 . . . . 0.0 112.53 179.067 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 99.2 m-20 -61.07 -39.28 89.3 Favored 'General case' 0 C--N 1.332 -0.162 0 N-CA-C 108.636 -0.876 . . . . 0.0 108.636 179.41 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 9.6 mm-40 -117.84 153.94 32.65 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 114.748 -1.115 . . . . 0.0 108.122 178.579 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -87.61 129.76 35.0 Favored 'General case' 0 N--CA 1.435 -1.215 0 C-N-CA 118.57 -1.252 . . . . 0.0 109.802 179.962 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . 0.666 ' C ' HG23 ' A' ' 70' ' ' VAL . . . -45.59 143.02 2.08 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 114.02 -1.446 . . . . 0.0 109.083 -178.522 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . 0.556 ' CA ' HG23 ' A' ' 70' ' ' VAL . 14.2 m -122.92 147.91 46.06 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 107.198 -1.408 . . . . 0.0 107.198 179.818 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.675 HD21 ' HB1' ' A' ' 53' ' ' ALA . 7.7 tt -54.72 -50.24 68.82 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 108.448 -0.945 . . . . 0.0 108.448 -177.708 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 74.1 m -59.42 -38.66 81.2 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 179.586 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . 0.425 ' HB2' ' H ' ' A' ' 38' ' ' SER . 61.7 mtpt -65.85 -38.24 88.33 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 120.781 0.324 . . . . 0.0 111.864 178.714 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.575 ' CD1' HG21 ' A' ' 70' ' ' VAL . 88.5 mt -64.51 -38.73 92.02 Favored 'General case' 0 CA--C 1.485 -1.542 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 -178.025 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -81.93 -35.29 13.27 Favored 'Isoleucine or valine' 0 N--CA 1.417 -2.105 0 C-N-CA 118.956 -1.098 . . . . 0.0 110.92 -176.762 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . 0.585 ' C ' ' H ' ' A' ' 46' ' ' GLY . 47.9 t -60.85 -50.87 71.69 Favored 'General case' 0 N--CA 1.43 -1.442 0 N-CA-C 105.353 -2.091 . . . . 0.0 105.353 178.583 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . 0.452 ' O ' ' N ' ' A' ' 47' ' ' ASN . 89.6 p -54.08 9.5 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.125 0 CA-C-N 113.727 -1.579 . . . . 0.0 113.055 171.579 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . 0.585 ' H ' ' C ' ' A' ' 44' ' ' SER . . . 29.04 30.45 0.01 OUTLIER Glycine 0 C--N 1.343 0.964 0 C-N-CA 125.531 1.539 . . . . 0.0 114.613 -172.702 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . 0.452 ' N ' ' O ' ' A' ' 45' ' ' SER . 56.1 t30 -66.16 -42.66 88.67 Favored 'General case' 0 CA--C 1.517 -0.29 0 N-CA-C 104.874 -2.269 . . . . 0.0 104.874 175.193 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 36.2 pt -129.14 166.83 25.75 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.766 0 CA-C-N 111.619 -2.537 . . . . 0.0 107.902 177.922 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . 0.537 ' C ' ' H ' ' A' ' 51' ' ' LYS . 67.6 m -119.5 156.5 30.14 Favored 'General case' 0 C--N 1.32 -0.702 0 C-N-CA 120.534 -0.466 . . . . 0.0 110.815 -179.151 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.838 ' HA ' ' HB3' ' A' ' 53' ' ' ALA . 12.6 tp60 -50.84 6.14 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.348 0 N-CA-C 114.743 1.386 . . . . 0.0 114.743 -179.536 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.537 ' H ' ' C ' ' A' ' 49' ' ' SER . 71.9 mmtt -83.43 -52.99 6.04 Favored 'General case' 0 C--N 1.309 -1.183 0 N-CA-C 104.757 -2.312 . . . . 0.0 104.757 176.147 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . 0.673 ' HG2' HG21 ' A' ' 20' ' ' VAL . 4.1 mt-30 -85.28 -29.22 24.76 Favored 'General case' 0 N--CA 1.431 -1.425 0 CA-C-N 110.989 -2.823 . . . . 0.0 110.333 178.105 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.838 ' HB3' ' HA ' ' A' ' 50' ' ' GLN . . . -65.17 -49.99 67.66 Favored 'General case' 0 N--CA 1.443 -0.801 0 C-N-CA 118.304 -1.358 . . . . 0.0 109.606 179.8 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 99.2 m-20 -60.9 -51.84 67.58 Favored 'General case' 0 CA--C 1.498 -1.038 0 C-N-CA 117.932 -1.507 . . . . 0.0 112.13 -178.152 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . 0.606 ' HB2' HG21 ' A' ' 17' ' ' VAL . 67.2 m -56.67 -38.27 71.99 Favored 'General case' 0 N--CA 1.434 -1.269 0 C-N-CA 118.534 -1.267 . . . . 0.0 112.122 -175.62 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . 0.596 ' HB2' HG21 ' A' ' 21' ' ' VAL . 22.9 t80 -72.21 -39.5 68.51 Favored 'General case' 0 CA--C 1.516 -0.355 0 C-N-CA 117.488 -1.685 . . . . 0.0 109.627 178.806 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 64.8 tttp -50.71 -40.27 53.66 Favored 'General case' 0 CA--C 1.493 -1.221 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.453 -176.348 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.41 ' O ' ' N ' ' A' ' 61' ' ' GLY . . . -59.13 -50.86 72.43 Favored 'General case' 0 N--CA 1.431 -1.391 0 N-CA-C 106.459 -1.682 . . . . 0.0 106.459 178.783 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 90.1 t80 -45.37 -44.51 11.91 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 120.02 -0.672 . . . . 0.0 110.14 -176.345 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.446 ' CE1' HG23 ' A' ' 67' ' ' THR . 35.7 t80 -60.0 -47.34 86.22 Favored 'General case' 0 CA--C 1.514 -0.436 0 CA-C-O 122.184 0.992 . . . . 0.0 108.952 175.092 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . 0.41 ' N ' ' O ' ' A' ' 58' ' ' ALA . . . -53.69 -47.08 65.5 Favored Glycine 0 CA--C 1.536 1.391 0 CA-C-N 113.491 -1.686 . . . . 0.0 113.251 -179.196 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 63.9 tttm -58.5 -46.46 86.65 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.971 0.386 . . . . 0.0 111.962 -179.028 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 98.7 m-70 -81.85 144.91 30.68 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.199 0.523 . . . . 0.0 111.53 -179.104 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 69.0 m -127.65 152.39 47.75 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.245 179.31 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 81.48 0.94 89.85 Favored Glycine 0 CA--C 1.525 0.668 0 N-CA-C 110.116 -1.194 . . . . 0.0 110.116 -178.895 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 24.7 pt-20 -151.63 153.24 34.07 Favored 'General case' 0 C--O 1.231 0.112 0 CA-C-O 120.893 0.378 . . . . 0.0 110.458 179.599 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . 0.473 ' O ' ' O ' ' A' ' 68' ' ' GLN . 91.9 m -128.74 133.33 48.09 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.756 -179.546 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . 0.521 ' OE1' HG13 ' A' ' 70' ' ' VAL . 23.5 pt20 -42.06 -178.73 0.0 OUTLIER 'General case' 0 CA--C 1.557 1.242 0 CA-C-O 121.984 0.897 . . . . 0.0 113.049 179.776 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 77.8 p -65.92 -17.08 64.42 Favored 'General case' 0 N--CA 1.48 1.034 0 N-CA-C 112.458 0.54 . . . . 0.0 112.458 -179.78 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.666 HG23 ' C ' ' A' ' 37' ' ' ALA . 0.1 OUTLIER -123.43 115.03 44.22 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.718 0 N-CA-C 107.269 -1.382 . . . . 0.0 107.269 -179.778 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -87.71 114.1 24.01 Favored 'General case' 0 C--O 1.22 -0.463 0 O-C-N 121.014 -1.053 . . . . 0.0 113.327 -175.777 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 53.9 m-20 . . . . . 0 C--O 1.22 -0.462 0 CA-C-O 118.019 -0.991 . . . . 0.0 111.23 178.797 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' ASN . . . . . . . . . . . . . 75.3 m-20 . . . . . 0 N--CA 1.493 1.682 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -69.17 144.44 53.8 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.17 -179.659 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 80.6 p -128.23 160.0 33.48 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.155 179.786 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -62.55 -39.55 93.99 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.914 -179.422 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 65.0 tt0 -76.1 128.47 35.05 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.475 -0.33 . . . . 0.0 110.978 -179.654 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 23.1 pttp -175.93 38.64 0.01 OUTLIER 'General case' 0 C--O 1.233 0.199 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.256 179.7 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 55.3 p-10 -138.4 13.62 2.78 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 113.212 0.819 . . . . 0.0 113.212 -178.655 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -140.62 135.93 32.23 Favored 'General case' 0 C--N 1.331 -0.222 0 C-N-CA 120.363 -0.535 . . . . 0.0 110.84 179.561 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 60.8 t -62.87 -45.93 97.61 Favored 'Isoleucine or valine' 0 C--O 1.232 0.164 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.333 179.633 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 77.3 p -160.66 -34.22 0.05 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.782 179.543 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -115.53 148.75 39.16 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.883 -179.795 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 76.7 p -106.2 -9.37 16.92 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.198 179.663 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . 74.34 19.32 79.86 Favored Glycine 0 CA--C 1.505 -0.587 0 N-CA-C 111.271 -0.732 . . . . 0.0 111.271 -179.918 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.617 ' O ' HG12 ' A' ' 17' ' ' VAL . 98.5 m -59.91 -41.71 92.31 Favored 'General case' 0 N--CA 1.434 -1.236 0 N-CA-C 106.335 -1.728 . . . . 0.0 106.335 178.175 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -67.62 -40.98 84.66 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.025 -0.989 . . . . 0.0 111.517 178.451 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -61.92 -39.42 91.97 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 115.481 -0.782 . . . . 0.0 110.826 -178.87 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . 0.617 HG12 ' O ' ' A' ' 14' ' ' THR . 14.1 p -67.8 -28.96 43.42 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 C-N-CA 118.98 -1.088 . . . . 0.0 111.113 -179.046 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . 0.444 HG23 ' O ' ' A' ' 14' ' ' THR . 55.8 t -60.55 -44.61 97.0 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.821 0 N-CA-C 108.955 -0.758 . . . . 0.0 108.955 -179.236 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.1 tmmt? -65.44 -36.01 82.64 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 114.99 -1.005 . . . . 0.0 113.631 -179.685 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.533 HG22 ' HA ' ' A' ' 17' ' ' VAL . 33.0 m -82.96 -49.9 16.3 Favored 'Isoleucine or valine' 0 C--N 1.342 0.263 0 O-C-N 121.449 -0.782 . . . . 0.0 113.086 -178.527 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . 0.509 ' N ' HG23 ' A' ' 20' ' ' VAL . 59.3 t -63.1 -44.75 99.65 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 C-N-CA 120.309 -0.556 . . . . 0.0 111.258 -178.861 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 96.3 mt-10 -60.72 -42.48 97.35 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 119.884 -0.727 . . . . 0.0 111.467 -178.988 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 74.6 m -64.9 -42.74 94.49 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 119.542 -0.863 . . . . 0.0 110.816 179.349 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 97.9 mm-40 -68.97 -40.19 79.0 Favored 'General case' 0 CA--C 1.53 0.177 0 C-N-CA 120.467 -0.493 . . . . 0.0 110.757 -178.948 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.431 ' O ' ' HG3' ' A' ' 29' ' ' GLU . . . -58.04 -41.49 83.39 Favored 'General case' 0 CA--C 1.502 -0.889 0 N-CA-C 108.61 -0.885 . . . . 0.0 108.61 -177.9 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 89.0 tt0 -59.79 -43.48 94.38 Favored 'General case' 0 C--N 1.31 -1.144 0 CA-C-N 114.084 -1.416 . . . . 0.0 108.354 179.088 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 60.2 tp -68.41 -39.15 81.72 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 113.162 0.801 . . . . 0.0 113.162 -179.651 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . 0.515 ' HD2' ' HB2' ' A' ' 37' ' ' ALA . 94.1 t80 -63.51 -49.36 73.84 Favored 'General case' 0 CA--C 1.494 -1.21 0 N-CA-C 108.465 -0.939 . . . . 0.0 108.465 -179.561 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.431 ' HG3' ' O ' ' A' ' 25' ' ' ALA . 2.6 pp20? -69.18 -23.21 63.9 Favored 'General case' 0 N--CA 1.428 -1.558 0 C-N-CA 118.997 -1.081 . . . . 0.0 109.022 178.235 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 64.3 tp -63.9 -49.05 74.22 Favored 'General case' 0 N--CA 1.44 -0.948 0 N-CA-C 105.828 -1.916 . . . . 0.0 105.828 177.803 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -51.01 -49.21 60.89 Favored 'General case' 0 CA--C 1.519 -0.239 0 CA-C-N 114.275 -1.33 . . . . 0.0 108.805 176.159 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 98.7 m-20 -127.24 106.96 9.59 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-N 114.828 -1.078 . . . . 0.0 109.967 179.507 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 76.6 p -90.3 -2.44 58.01 Favored 'General case' 0 C--N 1.324 -0.524 0 C-N-CA 120.287 -0.565 . . . . 0.0 112.307 -177.948 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 66.5 t30 -60.26 -38.22 82.84 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 108.451 -0.944 . . . . 0.0 108.451 179.385 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 21.0 pt-20 -139.88 157.56 45.51 Favored 'General case' 0 CA--C 1.506 -0.742 0 CA-C-N 114.664 -1.153 . . . . 0.0 111.259 179.053 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 30.4 mtpp -89.36 145.37 25.39 Favored 'General case' 0 N--CA 1.425 -1.696 0 C-N-CA 119.625 -0.83 . . . . 0.0 108.86 177.459 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . 0.515 ' HB2' ' HD2' ' A' ' 28' ' ' TYR . . . -57.41 -178.97 0.04 OUTLIER 'General case' 0 C--N 1.297 -1.682 0 CA-C-N 114.202 -1.363 . . . . 0.0 109.157 179.354 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . 0.442 ' OG ' ' HG3' ' A' ' 41' ' ' LYS . 59.7 p -154.41 168.31 27.08 Favored 'General case' 0 C--N 1.315 -0.892 0 C-N-CA 120.048 -0.661 . . . . 0.0 109.464 178.018 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.432 HD11 ' HB2' ' A' ' 57' ' ' LYS . 6.3 tt -57.62 -44.62 85.66 Favored 'General case' 0 C--N 1.31 -1.136 0 N-CA-C 107.658 -1.238 . . . . 0.0 107.658 -179.361 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 94.0 p -70.81 -37.08 73.22 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 115.187 -0.915 . . . . 0.0 113.033 178.616 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . 0.442 ' HG3' ' OG ' ' A' ' 38' ' ' SER . 97.9 mttt -69.69 -50.92 39.21 Favored 'General case' 0 N--CA 1.471 0.582 0 N-CA-C 113.278 0.844 . . . . 0.0 113.278 -177.914 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.604 ' HB3' HG12 ' A' ' 48' ' ' ILE . 89.9 mt -61.73 -38.05 86.5 Favored 'General case' 0 CA--C 1.482 -1.635 0 CA-C-O 122.225 1.012 . . . . 0.0 108.665 -176.129 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.41 HG21 ' CB ' ' A' ' 53' ' ' ALA . 0.4 OUTLIER -81.44 -26.55 10.19 Favored 'Isoleucine or valine' 0 N--CA 1.404 -2.757 0 CA-C-N 113.316 -1.765 . . . . 0.0 112.285 -177.056 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . 0.583 ' C ' ' H ' ' A' ' 46' ' ' GLY . 48.0 t -65.81 -50.42 64.71 Favored 'General case' 0 N--CA 1.422 -1.874 0 N-CA-C 102.963 -2.977 . . . . 0.0 102.963 175.294 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . 0.496 ' O ' ' N ' ' A' ' 47' ' ' ASN . 60.3 m -51.97 2.53 0.01 OUTLIER 'General case' 0 CA--C 1.547 0.846 0 CA-C-N 111.443 -2.617 . . . . 0.0 113.214 170.902 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . 0.583 ' H ' ' C ' ' A' ' 44' ' ' SER . . . 28.89 21.21 0.0 OUTLIER Glycine 0 CA--C 1.536 1.346 0 C-N-CA 126.478 1.989 . . . . 0.0 116.389 -172.771 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . 0.496 ' N ' ' O ' ' A' ' 45' ' ' SER . 50.5 t30 -59.8 -55.25 36.52 Favored 'General case' 0 CA--C 1.507 -0.693 0 N-CA-C 104.602 -2.37 . . . . 0.0 104.602 177.74 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.604 HG12 ' HB3' ' A' ' 42' ' ' LEU . 29.5 pt -92.95 146.72 6.04 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.242 0 N-CA-C 104.1 -2.555 . . . . 0.0 104.1 174.47 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . 0.401 ' O ' ' N ' ' A' ' 52' ' ' GLN . 68.2 m -98.82 163.22 12.71 Favored 'General case' 0 C--N 1.311 -1.091 0 C-N-CA 119.309 -0.956 . . . . 0.0 110.903 -178.177 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 63.3 tp60 -50.22 -15.24 0.21 Allowed 'General case' 0 C--N 1.308 -1.21 0 CA-C-N 114.569 -1.196 . . . . 0.0 112.041 -177.479 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 26.0 pttm -81.62 -36.17 29.21 Favored 'General case' 0 CA--C 1.516 -0.351 0 N-CA-C 107.201 -1.407 . . . . 0.0 107.201 177.618 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . 0.521 ' HG2' HG21 ' A' ' 20' ' ' VAL . 16.2 mt-30 -79.14 -23.34 44.06 Favored 'General case' 0 N--CA 1.439 -0.979 0 CA-C-N 113.047 -1.888 . . . . 0.0 109.603 176.559 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.41 ' CB ' HG21 ' A' ' 43' ' ' VAL . . . -84.7 -44.67 13.17 Favored 'General case' 0 C--O 1.219 -0.529 0 C-N-CA 118.785 -1.166 . . . . 0.0 108.279 175.151 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 99.8 m-20 -63.68 -38.99 93.19 Favored 'General case' 0 CA--C 1.506 -0.714 0 CA-C-N 114.966 -1.016 . . . . 0.0 111.265 179.015 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . 0.726 ' O ' ' HB3' ' A' ' 58' ' ' ALA . 67.6 m -65.7 -40.99 92.86 Favored 'General case' 0 N--CA 1.437 -1.085 0 C-N-CA 119.563 -0.855 . . . . 0.0 110.109 178.866 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . 0.422 ' HB2' HG21 ' A' ' 21' ' ' VAL . 3.5 t80 -71.48 -40.61 70.12 Favored 'General case' 0 C--N 1.342 0.263 0 C-N-CA 118.333 -1.347 . . . . 0.0 109.916 -179.109 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.432 ' HB2' HD11 ' A' ' 39' ' ' LEU . 88.7 tttt -58.23 -24.1 58.11 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.112 -0.949 . . . . 0.0 108.495 177.806 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.726 ' HB3' ' O ' ' A' ' 55' ' ' SER . . . -66.34 -40.21 89.71 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-N 113.595 -1.639 . . . . 0.0 109.233 175.99 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 91.5 t80 -63.92 -47.18 81.57 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-O 121.304 0.573 . . . . 0.0 111.022 177.178 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 91.3 t80 -61.28 -40.8 95.48 Favored 'General case' 0 CA--C 1.512 -0.488 0 N-CA-C 107.325 -1.361 . . . . 0.0 107.325 177.47 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -53.32 -43.27 64.95 Favored Glycine 0 N--CA 1.444 -0.794 0 CA-C-N 113.054 -1.885 . . . . 0.0 111.391 -179.379 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 56.2 mtmt -59.01 -41.05 86.76 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 112.362 0.504 . . . . 0.0 112.362 179.946 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' HIS . . . . . . . . . . . . . 78.8 m80 -126.37 107.77 10.61 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-O 121.221 0.534 . . . . 0.0 112.079 -179.197 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 47.8 t -63.43 -46.52 85.97 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.664 -0.698 . . . . 0.0 111.47 178.929 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -60.33 -36.45 90.99 Favored Glycine 0 C--O 1.229 -0.171 0 CA-C-N 115.001 -0.999 . . . . 0.0 110.892 -178.799 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -83.34 150.27 26.21 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.529 -0.336 . . . . 0.0 110.762 -178.743 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . 0.466 ' O ' HG23 ' A' ' 67' ' ' THR . 9.4 t -124.71 119.46 29.03 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.257 0.551 . . . . 0.0 110.903 -179.965 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 1.2 pt20 -36.85 155.4 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 115.906 1.817 . . . . 0.0 115.906 -175.274 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 89.9 m -46.94 -27.26 1.21 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 110.676 -2.965 . . . . 0.0 112.35 -178.027 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 2.9 p -116.92 155.16 18.5 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.294 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 179.288 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -65.66 78.03 0.07 Allowed 'General case' 0 C--O 1.224 -0.261 0 N-CA-C 114.569 1.322 . . . . 0.0 114.569 -174.892 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 . . . . . 0 C--O 1.22 -0.463 0 CA-C-O 118.006 -0.997 . . . . 0.0 111.336 177.963 . . . . . . . . 0 0 . 1 stop_ save_